data_r6jb7sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2019-03-20 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      6jb7 
_cell.length_a      146.088 
_cell.length_b      38.124 
_cell.length_c      60.266 
_cell.angle_alpha   90.000 
_cell.angle_beta    90.899 
_cell.angle_gamma   90.000 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9796 
# 
_entry.id   6jb7 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               6jb7 
_symmetry.space_group_name_H-M   "C 1 2 1" 
_symmetry.Int_Tables_number      5 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.pdbx_r_free_flag 
_refln.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_F_calc_with_solvent 
_refln.pdbx_phase_calc_with_solvent 
_refln.pdbx_FWT 
_refln.pdbx_PHWT 
_refln.pdbx_DELFWT 
_refln.pdbx_DELPHWT 
1 1 1 0   6  0  o 0 17.3    2.3   14.1  2.3 205.86    -159.976     174.682    20.0238      391.299    20.0238      
1 1 1 1   1  9  o 0 8.3     2.3   11.9  2.3 186.812   68.8347      139.558    -111.165     324.799    -111.165     
1 1 1 -1  3  7  o 0 95.3    2.9   92.8  2.9 165.596   155.175      127.839    155.175      36.7357    -24.8251     
1 1 1 -1  3  6  o 0 18.5    2     18.6  2   238.453   103.404      141.052    -76.5956     378.897    -76.5956     
1 1 1 1   3  5  o 0 34.5    1.7   36.1  1.7 188.29    -69.5716     43.7822    110.428      224.832    110.428      
1 1 1 -1  5  2  o 0 96.5    2.6   88.9  2.6 236.617   -4.75769     105.491    -4.75769     127.659    175.242      
1 1 1 1   5  1  o 0 67.6    2.2   69.4  2.2 202.587   178.243      53.5987    178.243      145.695    -1.75715     
1 1 1 -2  2  7  o 0 63.1    2.6   64.6  2.6 300.05    170.045      9.75246    -9.95547     308.848    -9.95547     
1 1 1 -2  4  1  f 1 128.8   3.3   131.1 3.3 386.597   43.7773      84.0088    43.7773      287.23     -136.223     
1 1 1 2   4  1  f 1 56.6    1.8   57.8  1.8 104.696   124.561      31.9868    124.561      68.3219    -55.4392     
1 1 1 -2  6  3  o 0 68.4    2.5   63.8  2.5 342.699   119.315      34.8015    -60.6852     395.869    -60.6852     
1 1 1 2   6  0  o 0 20.2    1.6   22.8  1.6 187.651   2.15804      100.689    -177.842     297.923    -177.842     
1 1 1 3   1  2  o 0 97.6    2.3   93.3  2.3 96.4028   139.296      101.55     139.296      12.1435    139.296      
1 1 1 -3  3  6  o 0 20.9    1.6   21    1.6 96.8501   45.3534      47.1703    -134.647     143.606    -134.647     
1 1 1 -3  5  4  o 0 82.1    2.4   83.1  2.4 331.314   -52.8489     21.4728    -52.8489     304.41     127.151      
1 1 1 3   5  0  o 0 120.2   2.9   118.9 2.9 407.757   36.9298      48.7151    36.9298      350.951    -143.07      
1 1 1 -3  7  1  o 0 42      2.3   40.3  2.3 307.333   27.4015      95.5483    -152.598     417.665    -152.598     
1 1 1 -4  4  2  o 0 121.5   2.8   117.1 2.8 333.321   101.72       104.067    101.72       214.283    -78.2802     
1 1 1 -4  4  1  o 0 116.6   2.9   123.9 2.9 533.314   127.242      56.7985    -52.7584     565.781    -52.7584     
1 1 1 4   4  5  o 0 17.6    1.6   14.3  1.6 240.239   -16.8683     152.879    163.132      390.967    163.132      
1 1 1 -4  6  3  o 0 46.6    2.2   41.9  2.2 173.054   -131.894     10.1573    48.1058      192.275    48.1058      
1 1 1 4   6  3  o 0 12.1    1.6   11.4  1.6 186.362   -129.394     141.358    50.6061      337.352    50.6061      
1 1 1 -6  2  9  f 1 29      2.4   23.3  2.4 112.988   74.4949      44.5684    -105.505     165.375    -105.505     
1 1 1 -6  2  7  o 0 40.6    1.8   41.1  1.8 241.304   89.4674      51.3079    -90.5326     290.328    -90.5326     
1 1 1 6   2  1  < 0 17      0.8   17.4  0.8 ?         ?            123.519    -16.6886     ?          ?            
1 1 1 6   2  6  o 0 39.1    2     36.7  2   176.287   -32.285      30.2944    147.715      199.37     147.715      
1 1 1 -6  4  3  o 0 54.1    1.7   57.4  1.7 151.953   48.6612      27.939     48.6612      116.745    -131.339     
1 1 1 -6  4  1  o 0 136.2   3.2   129.3 3.2 167.502   159.942      205.928    159.942      46.4454    159.942      
1 1 1 6   4  0  o 0 53.4    2.2   57    2.2 229.253   -98.1243     3.35954    -98.1243     213.086    81.8757      
1 1 1 6   4  6  o 0 29      2.3   31.9  2.3 132.228   39.9596      37.605     -140.04      168.12     -140.04      
1 1 1 -7  1  8  o 0 71.8    2.9   79.9  2.9 232.691   -19.673      63.1478    -19.673      166.06     160.327      
1 1 1 7   1  0  < 0 3.6     0.6   4.1   0.6 ?         ?            144.572    154.884      ?          ?            
1 1 1 7   1  1  o 0 106.3   3.5   111   3.5 287.484   -16.1865     106.296    -16.1865     154.582    163.814      
1 1 1 7   5  5  o 0 36.2    2.1   42    2.1 224.577   69.4314      51.6265    -110.569     289.412    -110.569     
1 1 1 -8  4  4  o 0 15.1    1.4   13.1  1.4 156.806   60.0219      102.289    -119.978     256.864    -119.978     
1 1 1 -8  4  2  o 0 79.9    2     79.6  2   336.512   131.875      9.79239    131.875      309.561    -48.1247     
1 1 1 8   4  1  o 0 90.2    2.4   90.9  2.4 223.639   -52.343      100.731    -52.343      110.055    127.657      
1 1 1 -9  1  7  o 0 42.4    1.8   41.1  1.8 140.865   115.852      8.25357    -64.1475     146.76     -64.1475     
1 1 1 -9  3  6  o 0 48.1    2.1   43.4  2.1 71.7453   40.4678      7.90466    40.4678      62.7133    -139.532     
1 1 1 -9  3  4  o 0 86.2    2.3   88.3  2.3 170.122   7.60679      106.044    7.60679      55.5925    -172.393     
1 1 1 9   3  2  o 0 56.1    3.1   55.5  3.1 288.028   53.867       25.987     -126.133     298.695    -126.133     
1 1 1 -9  5  2  o 0 1.7     1     0.9   1   200.774   63.7978      189.564    -116.202     385.773    -116.202     
1 1 1 -10 2  7  o 0 58.1    2.2   58.4  2.2 156.21    -129.514     34.975     -129.514     118.28     50.4862      
1 1 1 -10 2  1  o 0 33.5    1.6   19.1  1.6 153.398   -33.2595     51.3006    146.74       193.584    146.74       
1 1 1 -10 4  3  o 0 37.3    1.3   35.9  1.3 40.9262   -147.344     3.63914    32.656       43.849     32.656       
1 1 1 10  4  2  o 0 120.7   2.9   123.1 2.9 224.067   -93.0445     177.414    -93.0445     41.8622    86.9555      
1 1 1 -10 6  2  f 1 67.6    2     64.6  2   244.925   -99.2195     30.3498    -99.2195     226.771    80.7805      
1 1 1 -11 1  5  o 0 77.2    2.2   73.5  2.2 172.198   -127.265     75.9763    -127.265     86.3424    52.7354      
1 1 1 -11 5  1  o 0 93.5    2.5   97.9  2.5 178.434   -63.6795     128.429    -63.6795     45.2674    116.32       
1 1 1 -12 2  10 o 0 5.2     2.2   4.3   2.2 201.223   89.2332      183.712    -90.7668     390.957    -90.7668     
1 1 1 12  2  0  o 0 70.4    2     76.6  2   56.3534   -6.65967     40.4437    -6.65967     11.0166    173.34       
1 1 1 12  2  4  f 1 114     3.1   109.8 3.1 154.609   91.7656      160.621    91.7656      13.5472    91.7656      
1 1 1 -12 4  3  o 0 3.4     0.6   1.3   0.6 183.956   -179.816     167.663    0.184006     347.452    0.184006     
1 1 1 -12 4  2  o 0 41.9    1.8   44.9  1.8 178.136   -61.35       13.9252    118.65       188.173    118.65       
1 1 1 12  6  2  o 0 21.4    2     19.4  2   385.057   128.819      252.681    -51.1805     655.814    -51.1805     
1 1 1 -13 1  8  o 0 59.6    2.5   56.9  2.5 186.804   146.559      30.6326    146.559      165.541    -33.4406     
1 1 1 -13 3  5  o 0 72.4    2.8   65.3  2.8 184.964   -118.012     59.2598    -118.012     121.211    61.9881      
1 1 1 13  3  3  o 0 23      1.3   20.3  1.3 94.4181   28.1622      43.4151    -151.838     135.731    -151.838     
1 1 1 13  3  6  o 0 3.7     2     6.2   2   44.7882   -131.612     41.4467    48.3878      88.9824    48.3878      
1 1 1 -13 5  5  o 0 6.4     1.2   5.6   1.2 139.672   -80.0819     124.094    99.9181      269.805    99.9181      
1 1 1 14  4  2  o 0 78.6    2.7   77.3  2.7 197.848   1.57022      79.736     1.57022      111.996    -178.43      
1 1 1 14  4  5  o 0 58      2.3   57.5  2.3 90.4447   -120.349     34.1263    -120.349     61.1022    59.6509      
1 1 1 -14 6  4  o 0 33.3    2.2   35.6  2.2 190.292   -68.7441     48.9225    111.256      242.551    111.256      
1 1 1 15  1  1  o 0 40.7    2     42.6  2   297.335   137.044      77.3168    -42.9561     354.461    -42.9561     
1 1 1 -15 3  5  o 0 56.7    1.7   54    1.7 232.382   150.214      2.62859    150.214      241.326    -29.786      
1 1 1 -15 5  3  o 0 14.9    1     14.3  1   59.2964   -0.688644    39.3203    179.311      101.077    179.311      
1 1 1 -16 2  3  o 0 5.3     0.9   7.8   0.9 69.1025   51.012       55.7858    -128.988     122.826    -128.988     
1 1 1 -17 1  7  o 0 9.8     1.5   12.7  1.5 68.7359   155.175      51.2535    -24.825      122.756    -24.825      
1 1 1 17  1  3  o 0 118.2   2.9   113.6 2.9 123.118   -31.5305     162.979    -31.5305     43.3501    -31.5305     
1 1 1 17  3  2  f 1 56.5    2     56.5  2   122.09    -112.685     31.8853    -112.685     86.6039    67.3148      
1 1 1 -17 7  2  o 0 1.5     1.6   5.8   1.6 29.45     28.3198      26.2859    -151.68      55.7327    -151.68      
1 1 1 -18 2  8  o 0 31.5    2.2   29.3  2.2 89.1241   -156.6       22.8763    23.4002      113.722    23.4002      
1 1 1 -18 4  4  o 0 62.7    2.5   58.3  2.5 48.0496   -9.33241     24.3321    -9.33241     25.5149    170.668      
1 1 1 -19 1  3  o 0 104.2   2.7   97.6  2.7 346.389   -95.565      54.677     -95.565      277.989    84.435       
1 1 1 -19 3  3  o 0 8.9     1.7   6.4   1.7 298.836   -84.6727     255.284    95.3273      566.019    95.3273      
1 1 1 -19 5  4  o 0 9.6     1.4   8.1   1.4 86.3238   -159.837     67.7945    20.163       155.193    20.163       
1 1 1 -20 2  4  o 0 29.2    1.9   26.3  1.9 326.487   -118.729     166.266    61.2713      504.614    61.2713      
1 1 1 -21 1  4  o 0 79.6    2.1   79.3  2.1 153.553   -148.232     95.2487    -148.232     63.3132    31.7681      
1 1 1 22  2  4  o 0 0.1     2.1   -2.3  2.1 45.3911   -152.769     45.8391    27.2314      92.9753    27.2314      
1 1 1 -22 4  6  o 0 1.8     1.8   2.3   1.8 79.7661   -96.6413     75.5518    83.3587      155.627    83.3587      
1 1 1 -23 1  7  o 0 64.6    2.1   72.6  2.1 137.522   86.481       66.6957    86.481       71.6283    -93.519      
1 1 1 -23 1  5  o 0 81.3    2.2   83.9  2.2 142.567   59.8533      101.749    59.8533      44.319     -120.147     
1 1 1 -23 1  2  o 0 101.4   2.3   103.2 2.3 303.323   106.18       94.189     106.18       218.04     -73.8205     
1 1 1 -23 1  1  o 0 74.1    2.4   80    2.4 164.086   -84.084      88.6725    -84.084      80.476     95.916       
1 1 1 23  1  0  o 0 45.7    1.6   42.9  1.6 104.001   43.3853      4.48628    43.3853      102.609    -136.615     
1 1 1 23  1  3  o 0 52      2.3   58    2.3 321.81    75.1264      54.3407    -104.874     387.704    -104.874     
1 1 1 24  2  2  o 0 18.6    1.6   15.8  1.6 157.501   14.9487      95.817     -165.051     257.892    -165.051     
1 1 1 -25 1  4  o 0 69      2     70.5  2   335.412   -97.951      18.1084    82.049       363.126    82.049       
1 1 1 25  1  1  o 0 14.2    2.1   12.4  2.1 15.1318   -63.1569     10.3413    116.843      25.8709    116.843      
1 1 1 25  3  1  o 0 43.3    2.2   40.7  2.2 232.764   158.685      42.1746    -21.3146     276.503    -21.3146     
1 1 1 -30 2  2  o 0 17.3    1.8   15.6  1.8 320.42    158.386      209.39     -21.6135     526.924    -21.6135     
1 1 1 -34 2  4  o 0 17.8    1.6   15.4  1.6 132.041   -67.8425     75.1383    112.158      198.352    112.158      
1 1 1 0   0  3  o 0 433.1   11.5  ?     ?   501.008   0            454.515    0            9.519      180          
1 1 1 0   0  4  o 0 166.9   4.9   ?     ?   243.19    0            262.368    0            37.47      0            
1 1 1 0   0  5  o 0 285.8   11.2  ?     ?   336.011   0            373.272    0            57.0176    0            
1 1 1 0   0  6  o 0 878.4   22.5  ?     ?   336.739   180          656.117    180          339.938    180          
1 1 1 0   0  7  o 0 27      2.7   ?     ?   281.893   180          75.983     180          193.996    2.74826e-15  
1 1 1 0   0  8  o 0 1686.4  42.2  ?     ?   934.916   0            961.746    0            32.9343    0            
1 1 1 0   0  9  o 0 1280.3  32.7  ?     ?   829.352   0            834.921    0            14.0307    0            
1 1 1 0   0  10 o 0 11.7    3.8   ?     ?   244.58    180          32.3005    180          228.701    9.91005e-16  
1 1 1 0   0  11 o 0 8.1     4.7   ?     ?   160.01    180          12.376     180          159.081    5.4588e-16   
1 1 1 0   0  12 o 0 1767    45.1  ?     ?   583.694   0            1023.93    0            415.562    0            
1 1 1 0   0  13 o 0 -9.4    7.1   ?     ?   67.0832   180          1.03832    180          68.5039    1.06353e-16  
1 1 1 0   0  14 o 0 221.3   14    ?     ?   590.929   180          339.889    180          245.566    9.71186e-15  
1 1 1 0   0  15 o 0 89.3    11.1  ?     ?   324.335   0            197.029    0            122.302    180          
1 1 1 0   0  16 o 0 86.1    14    ?     ?   340.684   180          190.015    180          138.848    9.6024e-15   
1 1 1 0   0  17 o 0 28.2    13.7  ?     ?   85.9651   0            20.8819    0            63.7401    180          
1 1 1 0   0  18 o 0 199.9   16.8  ?     ?   65.9071   0            140.614    0            76.9895    0            
1 1 1 0   0  19 o 0 268.8   18.7  ?     ?   418.018   180          370.775    180          21.2619    1.2236e-13   
1 1 1 0   0  20 o 0 16.5    15.5  ?     ?   188.154   180          31.7407    180          144.799    1.5381e-15   
1 1 1 0   0  21 o 0 7.6     15.5  ?     ?   228.541   0            34.5455    0            205.487    180          
1 1 1 0   0  22 o 0 246.4   21.7  ?     ?   341.372   0            388.418    0            39.3097    0            
1 1 1 0   0  23 o 0 791.2   31.7  ?     ?   592.589   0            691.451    0            101.14     0            
1 1 1 0   0  24 o 0 197.7   22.8  ?     ?   382.465   0            339.221    0            30.0568    180          
1 1 1 0   0  25 o 0 22.6    26.1  ?     ?   94.4924   0            53.5809    0            37.5234    180          
1 1 1 0   0  26 o 0 41.7    28.4  ?     ?   124.604   180          112.274    180          17.7428    4.44008e-14  
1 1 1 0   0  27 o 0 -7.2    35.5  ?     ?   192.124   180          64.353     180          127.275    3.5478e-15   
1 1 1 0   0  28 o 0 2.9     29.7  ?     ?   86.4043   180          46.8682    180          35.4882    9.26676e-15  
1 1 1 0   2  0  o 0 720.7   18.6  ?     ?   427.668   -178.933     674.436    -178.933     279.063    -178.933     
1 1 1 0   2  1  o 0 1683.1  28.9  ?     ?   660.929   -153.702     1152.19    -153.702     538.205    -153.702     
1 1 1 0   2  2  o 0 1936.9  33.5  ?     ?   991.259   28.3939      988.683    28.3939      65.852     28.3939      
1 1 1 0   2  3  f 1 2592.3  44.2  ?     ?   1090.08   -170.053     1195.87    -170.053     176.274    -170.053     
1 1 1 0   2  4  o 0 998.3   19.4  ?     ?   697.141   -31.2443     720.676    -31.2443     60.4347    -31.2443     
1 1 1 0   2  5  o 0 867.4   15.9  ?     ?   627.443   -114.318     685.536    -114.318     92.9744    -114.318     
1 1 1 0   2  6  o 0 2997.9  51.3  ?     ?   1062.96   -133.865     1441.98    -133.865     418.52     -133.865     
1 1 1 0   2  7  o 0 687.9   13.2  ?     ?   620.72    -96.7009     579.102    -96.7009     40.5721    83.2991      
1 1 1 0   2  8  o 0 573.2   11    ?     ?   469.943   19.1493      607.512    19.1493      140.271    19.1493      
1 1 1 0   2  9  o 0 1287.2  24.9  ?     ?   924.516   110.657      796.396    110.657      194.33     -69.343      
1 1 1 0   2  10 o 0 175.4   5.1   ?     ?   352.602   -70.4349     218.563    -70.435      157.485    109.565      
1 1 1 0   2  11 o 0 923.4   18.2  ?     ?   537.014   -96.4134     882.199    -96.4134     320.364    -96.4134     
1 1 1 0   2  12 o 0 1165    21.9  ?     ?   669.792   -111.062     929.935    -111.062     233.052    -111.062     
1 1 1 0   2  13 o 0 244     10.8  ?     ?   304.271   18.5963      363.137    18.5963      48.4255    18.5963      
1 1 1 0   2  14 o 0 85.4    7.2   ?     ?   277.368   159.702      57.1306    159.702      216.917    -20.2979     
1 1 1 0   2  15 o 0 1445.6  28.4  ?     ?   408.443   -43.0895     1269.45    -43.0895     868.587    -43.0895     
1 1 1 0   2  16 o 0 1218.9  25.5  ?     ?   524.327   9.5252       1023.95    9.5252       519.627    9.5252       
1 1 1 0   2  17 o 0 689.6   17.9  ?     ?   525.426   112.871      651.8      112.871      142.808    112.871      
1 1 1 0   2  18 o 0 -5.4    8.8   ?     ?   131.617   178.884      113.273    -1.11618     239.776    -1.11618     
1 1 1 0   2  19 o 0 145.2   10.7  ?     ?   199.498   163.712      242.819    163.712      56.6064    163.712      
1 1 1 0   2  20 o 0 53.2    11.7  ?     ?   149.069   -18.8068     59.645     -18.8068     79.5104    161.193      
1 1 1 0   2  21 o 0 211.7   14.2  ?     ?   337.713   66.0713      331.967    66.0713      20.7966    -113.929     
1 1 1 0   2  22 o 0 182.1   16.2  ?     ?   187.435   85.497       416.43     85.497       225.856    85.497       
1 1 1 0   2  23 o 0 76.7    15.8  ?     ?   233.524   121.448      163.848    121.448      61.599     -58.552      
1 1 1 0   2  24 o 0 29.6    12.9  ?     ?   193.988   133.96       22.5716    133.96       163.52     -46.0404     
1 1 1 0   2  25 o 0 122.4   18.3  ?     ?   285.419   111.009      236.966    111.009      49.5826    -68.9913     
1 1 1 0   2  26 o 0 64      26.3  ?     ?   124.906   -93.0787     188.87     -93.0787     59.4647    -93.0787     
1 1 1 0   2  27 o 0 227.8   23.9  ?     ?   359.956   -66.9182     366.164    -66.9182     17.2361    -66.9182     
1 1 1 0   2  28 o 0 75.5    22    ?     ?   250.839   -85.3774     145.988    -85.3774     91.2451    94.6226      
1 1 1 0   4  0  o 0 924     24.3  ?     ?   630.312   140.439      696.307    140.439      95.7242    140.439      
1 1 1 0   4  1  o 0 689.3   13.7  ?     ?   618.16    -110.544     557.46     -110.544     32.8498    69.4563      
1 1 1 0   4  2  o 0 396.9   9.1   ?     ?   363.121   -154.855     490.717    -154.855     143.473    -154.855     
1 1 1 0   4  3  o 0 1806.1  31.8  ?     ?   927.146   -88.8014     1007.23    -88.8014     120.327    -88.8014     
1 1 1 0   4  4  o 0 1259.7  22    ?     ?   777.547   -36.8624     829.328    -36.8624     86.0815    -36.8624     
1 1 1 0   4  5  o 0 314.7   6.6   ?     ?   435.044   -42.9008     346.531    -42.9008     85.5064    137.099      
1 1 1 0   4  6  o 0 656.8   12.4  ?     ?   754.864   21.031       420.162    21.031       327.564    -158.969     
1 1 1 0   4  7  o 0 84.9    3     ?     ?   303.853   174.598      50.6292    174.598      274.15     -5.40158     
1 1 1 0   4  8  f 1 1448.2  25.9  ?     ?   685.103   -45.6484     1142.89    -45.6484     409.685    -45.6484     
1 1 1 0   4  9  o 0 375.3   8.9   ?     ?   500.794   -74.7846     386.118    -74.7846     149.387    105.215      
1 1 1 0   4  10 o 0 550.2   12.9  ?     ?   503.155   68.2962      572.212    68.2962      48.8164    68.2962      
1 1 1 0   4  11 o 0 342.3   9.6   ?     ?   374.771   12.6864      445.833    12.6864      58.0528    12.6864      
1 1 1 0   4  12 o 0 1525.7  29.8  ?     ?   910.257   -27.7084     905.863    -27.7084     41.9006    152.292      
1 1 1 0   4  13 o 0 1001.4  20.3  ?     ?   668.869   -16.9026     747.02     -16.9026     89.598     -16.9026     
1 1 1 0   4  14 o 0 894.7   19.2  ?     ?   832.749   39.7298      510.288    39.7298      302.852    -140.27      
1 1 1 0   4  15 o 0 1448.7  29.1  ?     ?   762.291   111.978      945.779    111.978      216.232    111.978      
1 1 1 0   4  16 o 0 101.9   10.6  ?     ?   334.948   141.76       62.1789    141.76       260.707    -38.2401     
1 1 1 0   4  17 o 0 189.3   10.8  ?     ?   300.41    167.764      254.512    167.764      32.841     -12.236      
1 1 1 0   4  18 o 0 1119.2  25.2  ?     ?   826.957   110.34       710.74     110.34       57.5089    -69.6599     
1 1 1 0   4  19 o 0 151.5   13.6  ?     ?   386.172   146.793      147.052    146.793      211.769    -33.2073     
1 1 1 0   4  20 o 0 220.1   15.2  ?     ?   346.766   -46.2746     336.221    -46.2746     24.3498    133.725      
1 1 1 0   4  21 o 0 321     16.5  ?     ?   445.354   -26.835      406.312    -26.835      44.4711    153.165      
1 1 1 0   4  22 o 0 166.2   14.5  ?     ?   101.64    -152.471     433.783    -152.471     333.598    -152.471     
1 1 1 0   4  23 o 0 43.7    15    ?     ?   237.458   -1.18096     46.5466    -1.18096     179.402    178.819      
1 1 1 0   4  24 o 0 51.9    16.6  ?     ?   207.463   32.6076      98.9164    32.6076      98.8983    -147.392     
1 1 1 0   4  25 o 0 22.4    16.2  ?     ?   73.9029   17.3866      52.298     17.3866      23.3741    -162.613     
1 1 1 0   4  26 o 0 3.9     18.8  ?     ?   28.2232   48.742       12.2828    48.742       15.5407    -131.258     
1 1 1 0   4  27 o 0 -24.7   23.4  ?     ?   38.2793   108.62       7.47197    108.62       28.5793    -71.3796     
1 1 1 0   4  28 < 0 54      23.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   6  1  o 0 203.2   6.3   ?     ?   414.447   148.276      212.526    148.276      224.061    -31.7242     
1 1 1 0   6  2  f 1 208     4.6   ?     ?   165.283   -145.959     376.91     -145.959     201.806    -145.959     
1 1 1 0   6  3  o 0 484.6   9.7   ?     ?   450.308   -79.5094     566.388    -79.5094     91.8202    -79.5094     
1 1 1 0   6  4  o 0 288.9   6.1   ?     ?   547.961   142.803      223.39     142.803      353.614    -37.197      
1 1 1 0   6  5  o 0 454.6   9     ?     ?   741.654   -130.678     245.66     -130.678     534.086    49.3223      
1 1 1 0   6  6  f 1 597     11.3  ?     ?   557.895   149.809      574.35     149.809      19.0004    -30.1911     
1 1 1 0   6  7  o 0 251.7   6.7   ?     ?   338.323   108.24       347.261    108.24       1.65518    -71.7599     
1 1 1 0   6  8  f 1 172.1   5.5   ?     ?   388.672   -126.963     169.276    -126.963     232.184    53.0368      
1 1 1 0   6  9  o 0 2036.3  36.6  ?     ?   1195.31   -110.391     917.353    -110.391     305.854    69.6085      
1 1 1 0   6  10 o 0 204     6.9   ?     ?   163.991   -110.726     331.462    -110.726     170.902    -110.726     
1 1 1 0   6  11 o 0 613.5   14.1  ?     ?   580.737   106.406      511.587    106.406      54.0265    -73.5938     
1 1 1 0   6  12 o 0 514.9   12.7  ?     ?   264.688   -17.7016     674.865    -17.7016     418.543    -17.7016     
1 1 1 0   6  13 o 0 430.2   13.3  ?     ?   341.427   -134.655     530.181    -134.655     205.871    -134.655     
1 1 1 0   6  14 o 0 390.5   12.8  ?     ?   431.399   -105.024     424.011    -105.024     5.97285    -105.024     
1 1 1 0   6  15 o 0 478.9   13.5  ?     ?   406.158   -96.4699     542.571    -96.4699     156.448    -96.4699     
1 1 1 0   6  16 o 0 314.6   12.1  ?     ?   633.18    -119.47      176.118    -119.47      408.873    60.5301      
1 1 1 0   6  17 o 0 351.9   13.9  ?     ?   496.919   -52.4833     335.825    -52.4833     119.645    127.517      
1 1 1 0   6  18 o 0 88.2    10.4  ?     ?   162.064   -67.0725     151.184    -67.0725     2.584      -67.0725     
1 1 1 0   6  19 o 0 54.8    13.2  ?     ?   113.974   85.0145      104.625    85.0145      12.3448    -94.9855     
1 1 1 0   6  20 o 0 47.2    12.3  ?     ?   159.898   -137.774     97.1583    -137.774     62.6072    42.2258      
1 1 1 0   6  21 o 0 273.1   19.8  ?     ?   356.763   -118.261     420.726    -118.261     73.5429    -118.261     
1 1 1 0   6  22 o 0 105     15.9  ?     ?   270.639   10.0288      200.115    10.0288      55.1202    -169.971     
1 1 1 0   6  23 o 0 14.4    19    ?     ?   92.2696   1.08966      25.1029    1.08966      61.7762    -178.91      
1 1 1 0   6  24 o 0 -17.7   21.6  ?     ?   50.1419   163.729      6.79973    -16.2711     57.5054    -16.2711     
1 1 1 0   6  25 o 0 56.3    25.2  ?     ?   160.84    117.292      140.564    117.292      16.0441    -62.7081     
1 1 1 0   6  26 o 0 57.3    24.8  ?     ?   81.7093   -121.939     189.782    -121.939     113.771    -121.939     
1 1 1 0   6  27 f 1 12.2    26.9  ?     ?   75.8844   126.968      77.9246    126.968      7.64341    126.968      
1 1 1 0   8  0  o 0 2645.6  64.6  ?     ?   1030.83   -146.09      1342.55    -146.09      302.523    -146.09      
1 1 1 0   8  1  o 0 1392.6  66.6  ?     ?   572.282   -107.119     1142.7     -107.119     565.059    -107.119     
1 1 1 0   8  2  o 0 342.3   9.5   ?     ?   550.412   -91.1781     277.337    -91.1781     278.202    88.8219      
1 1 1 0   8  3  f 1 964.4   21    ?     ?   529.365   -67.5496     886.7      -67.5497     349.974    -67.5497     
1 1 1 0   8  4  o 0 1789.8  32.2  ?     ?   949.991   -49.3224     1012.93    -49.3224     55.7664    -49.3224     
1 1 1 0   8  5  o 0 872.7   17.9  ?     ?   754.939   -100.799     591.017    -100.799     177.451    79.2008      
1 1 1 0   8  6  o 0 50.4    4     ?     ?   291.406   -81.8641     51.6343    98.1359      332.714    98.1359      
1 1 1 0   8  7  o 0 374.4   8.5   ?     ?   458.436   -100.573     371.579    -100.573     69.3049    79.4272      
1 1 1 0   8  8  o 0 458.7   10    ?     ?   194.907   -30.7064     645.178    -30.7064     458.396    -30.7064     
1 1 1 0   8  9  o 0 852.6   18.4  ?     ?   755.826   49.3005      546.073    49.3005      165.87     -130.699     
1 1 1 0   8  10 f 1 704.2   15.3  ?     ?   602.138   85.4344      560.425    85.4344      7.01296    -94.5656     
1 1 1 0   8  11 o 0 50.9    6.8   ?     ?   207.368   -2.99151     9.25633    177.008      202.666    177.008      
1 1 1 0   8  12 o 0 587.2   14.6  ?     ?   655.654   -135.235     428.909    -135.235     188.063    44.7649      
1 1 1 0   8  13 o 0 48.8    9.5   ?     ?   184.53    -78.0806     5.27155    101.919      177.84     101.919      
1 1 1 0   8  14 o 0 96.5    9.7   ?     ?   223.882   44.0578      127.257    44.0578      76.3825    -135.942     
1 1 1 0   8  15 o 0 239.2   11    ?     ?   345.985   -3.6557      314.879    -3.6557      0.315751   176.344      
1 1 1 0   8  16 o 0 96      10.3  ?     ?   113.311   -111.696     160.602    -111.696     58.1568    -111.696     
1 1 1 0   8  17 o 0 680.3   19.1  ?     ?   623.679   -70.7112     609.206    -70.7112     22.3513    109.289      
1 1 1 0   8  18 o 0 238.7   14.1  ?     ?   420.013   -137.093     301.453    -137.093     112.909    42.9067      
1 1 1 0   8  19 o 0 46.7    12.4  ?     ?   269.204   137.907      29.7436    137.907      229.085    -42.0933     
1 1 1 0   8  20 o 0 58.2    14.8  ?     ?   277.933   51.7776      67.9296    51.7776      190.221    -128.222     
1 1 1 0   8  21 f 1 116.2   16.8  ?     ?   122.862   171.481      321.401    171.481      207.38     171.481      
1 1 1 0   8  22 f 1 289.7   20    ?     ?   355.756   -30.2749     444.621    -30.2749     86.7342    -30.2749     
1 1 1 0   8  23 o 0 15.7    22.8  ?     ?   172.506   -37.499      4.22864    -37.499      167.896    142.501      
1 1 1 0   8  24 o 0 43.1    25.1  ?     ?   143.278   132.249      106.43     132.249      27.368     -47.7511     
1 1 1 0   8  25 o 0 42.4    20.8  ?     ?   171.865   -107.84      93.2587    -107.84      63.361     72.16        
1 1 1 0   8  26 < 0 6.2     30.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   10 0  o 0 826.3   23.6  ?     ?   769.068   -68.6987     474.626    -68.6987     235.5      111.301      
1 1 1 0   10 1  o 0 455.6   14    ?     ?   740.978   37.4815      208.763    37.4815      475.404    -142.518     
1 1 1 0   10 2  o 0 684.4   15.5  ?     ?   711.451   -92.9469     442.871    -92.9469     213.704    87.0531      
1 1 1 0   10 3  o 0 3985.8  70.1  ?     ?   1519.73   -112.337     1307.9     -112.337     93.2218    67.6628      
1 1 1 0   10 4  o 0 880.2   18.7  ?     ?   779.272   -38.2915     533.149    -38.2915     184.217    141.708      
1 1 1 0   10 5  o 0 786.5   18.4  ?     ?   837.596   72.9466      410.557    72.9466      358.929    -107.053     
1 1 1 0   10 6  o 0 127     7.3   ?     ?   84.0001   -17.8039     133.256    -17.8039     54.2081    -17.8039     
1 1 1 0   10 7  o 0 1738.7  35.7  ?     ?   1101.92   118.876      789.08     118.876      232.283    -61.1235     
1 1 1 0   10 8  o 0 2421.6  45    ?     ?   770.845   165.148      1411.56    165.148      699.682    165.148      
1 1 1 0   10 9  o 0 625.5   14.3  ?     ?   647.534   -118.01      460.102    -118.01      135.388    61.9895      
1 1 1 0   10 10 o 0 260     8.9   ?     ?   376.29    -34.7519     309.294    -34.7519     27.9436    145.248      
1 1 1 0   10 11 o 0 1153.3  23.1  ?     ?   644.681   139.672      859.913    139.672      285.169    139.672      
1 1 1 0   10 12 o 0 892.7   20    ?     ?   640.353   173.769      684.824    173.769      112.25     173.769      
1 1 1 0   10 13 o 0 564.8   15.5  ?     ?   652.675   -60.8634     409.415    -60.8634     170.531    119.137      
1 1 1 0   10 14 o 0 138.6   10    ?     ?   281.217   -91.9779     232.671    -91.9779     47.5697    88.0221      
1 1 1 0   10 15 o 0 38.8    10.4  ?     ?   144.066   -119.441     69.9696    -119.441     70.0726    60.5593      
1 1 1 0   10 16 o 0 159.8   12.6  ?     ?   283.317   -35.874      293.17     -35.874      24.4428    -35.874      
1 1 1 0   10 17 o 0 191.6   14.5  ?     ?   319.102   -76.4097     325.785    -76.4097     33.0486    -76.4097     
1 1 1 0   10 18 o 0 35.9    12.7  ?     ?   73.5464   -99.8007     84.0567    -99.8007     16.9129    -99.8007     
1 1 1 0   10 19 o 0 24.6    13.9  ?     ?   80.826    172.464      50.0878    172.464      23.6781    -7.53586     
1 1 1 0   10 20 o 0 41.2    15    ?     ?   154.121   -46.3009     98.3139    -46.3009     52.9354    133.699      
1 1 1 0   10 21 o 0 45.2    18.3  ?     ?   174.06    -143.578     94.5608    -143.578     75.8422    36.422       
1 1 1 0   10 22 o 0 66.1    18.8  ?     ?   98.2067   -119.509     212.301    -119.509     120.348    -119.509     
1 1 1 0   10 23 o 0 93.2    21.7  ?     ?   124.162   -37.3385     280.183    -37.3385     169.034    -37.3385     
1 1 1 0   10 24 < 0 22.6    23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   12 0  o 0 292.2   15.5  ?     ?   569.818   136.539      156.284    136.539      343.968    -43.4611     
1 1 1 0   12 1  o 0 20.8    5.5   ?     ?   209.465   -139.849     91.5536    40.1509      275.371    40.1509      
1 1 1 0   12 2  o 0 73.6    6.6   ?     ?   272.388   52.7873      45.6688    52.7873      193.159    -127.213     
1 1 1 0   12 3  o 0 151.1   7.1   ?     ?   226.585   -142.128     229.86     -142.128     31.459     -142.128     
1 1 1 0   12 4  f 1 160.1   7.5   ?     ?   436.252   -98.2199     107.422    -98.2199     275.83     81.7801      
1 1 1 0   12 5  o 0 112.6   6.4   ?     ?   172.889   -171.943     197.247    -171.943     45.1701    -171.943     
1 1 1 0   12 6  o 0 109.7   7.4   ?     ?   304.32    125.997      122.105    125.997      144.824    -54.003      
1 1 1 0   12 7  o 0 439.3   12.1  ?     ?   474.172   100.916      432.824    100.916      18.3001    100.916      
1 1 1 0   12 8  o 0 219.2   8.5   ?     ?   263.641   84.1505      387.199    84.1505      127.969    84.1505      
1 1 1 0   12 9  f 1 647.2   15.4  ?     ?   675.075   87.6649      507.335    87.6649      156.951    -92.3351     
1 1 1 0   12 10 o 0 131.9   9.3   ?     ?   287.461   78.9363      208.956    78.9363      71.0938    -101.064     
1 1 1 0   12 11 o 0 100.8   8.7   ?     ?   279.517   123.952      161.974    123.952      104.147    -56.0477     
1 1 1 0   12 12 f 1 105.4   10    ?     ?   154.254   -68.672      271.514    -68.672      127.215    -68.672      
1 1 1 0   12 13 o 0 158.4   11    ?     ?   342.929   -136.771     233.595    -136.771     83.5328    43.2293      
1 1 1 0   12 14 o 0 78.5    12.1  ?     ?   257.661   -165.561     139.846    -165.561     90.9079    14.4385      
1 1 1 0   12 15 o 0 70.7    12.9  ?     ?   267.496   39.2197      109.562    39.2197      129.143    -140.78      
1 1 1 0   12 16 f 1 19.4    14.9  ?     ?   160.1     113.364      4.8865     113.364      138.847    -66.6355     
1 1 1 0   12 17 o 0 165.3   17.4  ?     ?   239.792   110.638      338.185    110.638      107.606    110.638      
1 1 1 0   12 18 o 0 35.1    14.7  ?     ?   41.3208   31.6089      82.2104    31.6089      42.5272    31.6089      
1 1 1 0   12 19 o 0 124.7   20.3  ?     ?   125.025   13.2437      347.071    13.2437      232.104    13.2437      
1 1 1 0   12 20 o 0 -16     21.1  ?     ?   74.0221   -93.3194     1.14506    86.6806      67.1541    86.6806      
1 1 1 0   12 21 o 0 33.5    19.8  ?     ?   133.182   -137.879     91.7153    -137.879     24.588     42.1212      
1 1 1 0   12 22 < 0 58.5    22.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   14 0  o 0 214.7   13.6  ?     ?   260.758   -179.007     342.21     -179.007     98.9985    -179.007     
1 1 1 0   14 1  o 0 341.3   11.6  ?     ?   444.811   122.091      400.993    122.091      13.5842    -57.9091     
1 1 1 0   14 2  o 0 292.1   10.2  ?     ?   348.65    69.9687      421.402    69.9687      96.8345    69.9687      
1 1 1 0   14 3  o 0 42.8    7.1   ?     ?   126.515   -7.4023      86.9974    -7.4023      30.5847    172.598      
1 1 1 0   14 4  o 0 168.6   8.6   ?     ?   394.698   -72.7635     205.06     -72.7635     154.876    107.237      
1 1 1 0   14 5  o 0 77.5    7.3   ?     ?   173.654   43.7011      188.644    43.7011      30.6954    43.7011      
1 1 1 0   14 6  o 0 13.5    7.4   ?     ?   127.753   37.2257      28.5186    -142.774     144.359    -142.774     
1 1 1 0   14 7  o 0 145.6   9.1   ?     ?   262.425   -51.9596     279.699    -51.9596     48.4986    -51.9596     
1 1 1 0   14 8  o 0 177     9.8   ?     ?   323.286   -105.911     285.379    -105.911     1.71576    -105.911     
1 1 1 0   14 9  o 0 30.1    9.2   ?     ?   62.5249   107.646      58.7064    107.646      4.09472    107.646      
1 1 1 0   14 10 o 0 45.5    10.1  ?     ?   177.009   61.5711      98.3197    61.5711      56.0865    -118.429     
1 1 1 0   14 11 o 0 108     13.4  ?     ?   194.283   118.69       250.368    118.69       80.3561    118.69       
1 1 1 0   14 12 o 0 75.3    12.5  ?     ?   278.057   155.081      109.924    155.081      131.93     -24.9191     
1 1 1 0   14 13 o 0 102.3   15.7  ?     ?   192.438   110.384      242.8      110.384      62.2829    110.384      
1 1 1 0   14 14 o 0 177     18.1  ?     ?   274.453   -39.8301     317.933    -39.8301     60.3626    -39.8301     
1 1 1 0   14 15 o 0 88.3    17.5  ?     ?   137.505   6.65404      251.267    6.65404      127.497    6.65404      
1 1 1 0   14 16 o 0 3.1     17.4  ?     ?   28.1515   110.666      10.3515    110.666      14.2631    -69.3339     
1 1 1 0   14 17 o 0 -37.7   18.9  ?     ?   91.4123   -107.11      26.7498    72.89        104.973    72.89        
1 1 1 0   14 18 o 0 69.4    23.4  ?     ?   102.763   161.868      210.719    161.868      123.366    161.868      
1 1 1 0   14 19 < 0 61.3    25.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   16 0  o 0 356.5   19.1  ?     ?   480.114   161.782      374.351    161.782      70.1433    -18.2177     
1 1 1 0   16 1  f 1 148.5   10.8  ?     ?   227.166   150.652      307.982    150.652      96.8028    150.652      
1 1 1 0   16 2  o 0 42.8    10.2  ?     ?   66.7563   22.633       128.676    22.633       67.0252    22.633       
1 1 1 0   16 3  o 0 36.7    10.1  ?     ?   95.3971   73.5469      111.334    73.5469      23.4033    73.5469      
1 1 1 0   16 4  o 0 9.8     9.6   ?     ?   95.0787   41.6686      10.4597    -138.331     97.8877    -138.331     
1 1 1 0   16 5  o 0 81      10    ?     ?   238.015   130.449      155.237    130.449      62.9999    -49.551      
1 1 1 0   16 6  o 0 67.3    11    ?     ?   153.276   -179.884     185.305    -179.884     44.1836    -179.884     
1 1 1 0   16 7  o 0 60      12    ?     ?   182.744   156.089      141.806    156.089      25.8054    -23.9111     
1 1 1 0   16 8  o 0 -3.4    11.1  ?     ?   43.2422   -39.6287     12.1199    140.371      50.2815    140.371      
1 1 1 0   16 9  o 0 124     14.8  ?     ?   80.3383   -133.176     349.228    -133.176     278.667    -133.176     
1 1 1 0   16 10 f 1 50.8    15.2  ?     ?   122.852   -116.437     155.797    -116.437     50.1608    -116.437     
1 1 1 0   16 11 f 1 9.5     12.1  ?     ?   141.994   177.281      12.7042    -2.71887     134.1      -2.71887     
1 1 1 0   16 12 o 0 38.5    17.6  ?     ?   93.7286   130.823      120.189    130.823      41.9948    130.823      
1 1 1 0   16 13 o 0 46      16.1  ?     ?   137.725   58.1072      131.239    58.1072      16.8536    58.1072      
1 1 1 0   16 14 < 0 59.2    16.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   16 15 < 0 18.8    18.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   18 0  o 0 -8.4    19.9  ?     ?   188.611   -112.652     62.9002    67.3476      216.755    67.3476      
1 1 1 0   18 1  o 0 24.5    13.6  ?     ?   48.1975   -82.1247     79.1319    -82.1247     39.8659    -82.1247     
1 1 1 0   18 2  o 0 65.8    14.5  ?     ?   227.394   92.4346      130.486    92.4346      54.4502    -87.5654     
1 1 1 0   18 3  o 0 108.1   14.3  ?     ?   249.064   137.101      211.588    137.101      9.47006    137.101      
1 1 1 0   18 4  < 0 -6.3    13.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   18 5  < 0 29.6    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   18 6  < 0 224.7   18.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 0   18 7  < 0 71.9    16.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  1  29 < 0 36      27    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  1  28 f 1 28.4    22.7  ?     ?   19.2781   92.2164      45.9445    92.2164      27.5533    92.2164      
1 1 1 -1  1  27 o 0 -16.2   22.8  ?     ?   42.9749   52.4148      1.4662     52.4148      41.2252    -127.585     
1 1 1 -1  1  26 f 1 19.3    18.2  ?     ?   109.798   32.7668      45.9454    32.7668      68.7721    -147.233     
1 1 1 -1  1  25 o 0 11.8    16.2  ?     ?   80.3916   66.7787      12.7255    66.7787      64.5042    -113.221     
1 1 1 -1  1  24 o 0 34.5    16.6  ?     ?   103.542   97.3528      83.0085    97.3528      16.6241    -82.6472     
1 1 1 -1  1  23 o 0 52.7    12.9  ?     ?   106.457   80.6861      150.592    80.6861      44.8831    80.6861      
1 1 1 -1  1  22 o 0 42      11.9  ?     ?   251.19    104.071      17.1133    104.071      239.004    -75.9285     
1 1 1 -1  1  21 o 0 134.9   13.8  ?     ?   47.2694   162.149      215.518    162.149      166.009    162.149      
1 1 1 -1  1  20 o 0 592.4   17.1  ?     ?   432.848   -159.944     650.289    -159.944     245.196    -159.944     
1 1 1 -1  1  19 o 0 83.1    10.6  ?     ?   337.087   149.073      31.276     149.073      284.122    -30.9266     
1 1 1 -1  1  18 o 0 446.6   13.7  ?     ?   453.582   72.288       475.938    72.288       38.9905    72.288       
1 1 1 -1  1  17 o 0 319.5   12.6  ?     ?   364.279   8.39753      398.089    8.39753      40.1775    8.39753      
1 1 1 -1  1  16 o 0 364.6   12.5  ?     ?   390.51    -134.971     425.095    -134.971     48.7542    -134.971     
1 1 1 -1  1  15 f 1 123.7   8.3   ?     ?   448.137   150.217      11.5079    150.217      431.364    -29.7827     
1 1 1 -1  1  14 o 0 567.8   12.7  ?     ?   603.223   -116.952     456.003    -116.952     140.952    63.0476      
1 1 1 -1  1  13 f 1 387.3   9.3   ?     ?   359.57    -12.1201     515.026    -12.1201     140.681    -12.1201     
1 1 1 -1  1  12 o 0 116     4.7   ?     ?   96.2668   57.7638      156.906    57.7638      56.6261    57.7638      
1 1 1 -1  1  11 o 0 714.7   17    ?     ?   504.607   172.482      752.022    172.482      211.446    172.482      
1 1 1 -1  1  10 o 0 194.9   5.3   ?     ?   276.812   66.4721      314.229    66.4721      18.7972    66.4721      
1 1 1 -1  1  9  o 0 239.7   5.5   ?     ?   517.561   73.8274      166.789    73.8274      345.76     -106.173     
1 1 1 -1  1  8  o 0 2370.9  41    ?     ?   1174.18   -87.0507     1096.61    -87.0507     71.0589    92.9493      
1 1 1 -1  1  7  o 0 1905.8  33    ?     ?   1002.29   167.007      991.963    167.007      30.5632    167.007      
1 1 1 -1  1  6  o 0 2373.3  41.4  ?     ?   930.784   119.141      1292.25    119.141      396.307    119.141      
1 1 1 -1  1  5  f 1 3041.4  52    ?     ?   1340.77   23.4183      1167.15    23.4183      105.138    -156.582     
1 1 1 -1  1  4  o 0 589.3   13.9  ?     ?   527.423   84.2472      533.669    84.2472      43.911     84.2472      
1 1 1 -1  1  3  f 1 1149.6  20.6  ?     ?   657.132   -102.946     842.686    -102.946     227.554    -102.946     
1 1 1 -1  1  2  f 1 290.5   6     ?     ?   468.364   -128.514     265.679    -128.514     173.905    51.4858      
1 1 1 1   1  2  f 1 879.9   16    ?     ?   232.947   125.55       995.523    125.55       776.964    125.55       
1 1 1 1   1  3  f 1 547.8   10.4  ?     ?   675.007   17.029       365.633    17.029       266.595    -162.971     
1 1 1 1   1  4  o 0 363.9   8.1   ?     ?   67.8616   -97.2106     408.407    -97.2106     345.333    -97.2106     
1 1 1 1   1  5  f 1 3736.6  62.7  ?     ?   1681.98   -83.2645     1113.65    -83.2645     484.113    96.7355      
1 1 1 1   1  6  o 0 2189.9  37.7  ?     ?   965.499   102.353      1173.95    102.353      243.522    102.353      
1 1 1 1   1  7  o 0 1168.7  20.6  ?     ?   694.957   -0.760346    850.067    -0.760346    182.661    -0.760346    
1 1 1 1   1  8  o 0 551.7   11.1  ?     ?   498.206   -6.93801     561.732    -6.93801     65.6743    -6.93801     
1 1 1 1   1  10 o 0 21.1    3.2   ?     ?   41.1643   125.698      20.8687    -54.3016     64.8605    -54.3016     
1 1 1 1   1  11 o 0 629.4   14.6  ?     ?   531.75    -86.2563     643.812    -86.2563     73.3721    -86.2563     
1 1 1 1   1  12 o 0 138.5   5.2   ?     ?   379.612   -113.511     115.032    -113.511     280.971    66.4889      
1 1 1 1   1  13 f 1 1602    28.8  ?     ?   684.709   135.446      1194.72    135.446      480.82     135.446      
1 1 1 1   1  14 o 0 65.7    6.7   ?     ?   105.062   -100.951     47.5629    -100.951     56.5672    79.0491      
1 1 1 1   1  15 f 1 1474.2  27.8  ?     ?   892.861   -22.9687     838.769    -22.9687     45.0115    157.031      
1 1 1 1   1  16 o 0 767.7   19.2  ?     ?   606.427   54.4194      628.762    54.4194      43.3686    54.4194      
1 1 1 1   1  17 o 0 372.5   14.1  ?     ?   643.614   133.638      226.816    133.638      399.064    -46.3618     
1 1 1 1   1  18 o 0 112.1   10.3  ?     ?   163.238   93.5433      156.839    93.5433      0.69548    -86.4567     
1 1 1 1   1  19 o 0 221     13.4  ?     ?   410.226   -66.3785     238.675    -66.3785     145.873    113.621      
1 1 1 1   1  20 o 0 201.5   12.9  ?     ?   381.269   -10.289      237.825    -10.289      119.69     169.711      
1 1 1 1   1  21 o 0 113.2   11.2  ?     ?   154.993   -8.16066     272.455    -8.16066     109.791    -8.16066     
1 1 1 1   1  22 o 0 137.4   15.6  ?     ?   288.452   2.7121       247.941    2.7121       46.7862    -177.288     
1 1 1 1   1  23 o 0 423.6   18.8  ?     ?   365.455   53.5719      623.253    53.5719      259.573    53.5719      
1 1 1 1   1  24 o 0 192.1   16.2  ?     ?   234.108   21.8455      413.073    21.8455      187.295    21.8455      
1 1 1 1   1  25 o 0 12.8    19.6  ?     ?   148.362   -134.413     0.772283   -134.413     142.089    45.5872      
1 1 1 1   1  26 f 1 226.7   20.9  ?     ?   315.905   -98.7072     397.292    -98.7072     66.4273    -98.7072     
1 1 1 1   1  27 o 0 9.7     23.4  ?     ?   154.434   -138.889     2.57452    -138.889     151.23     41.1105      
1 1 1 1   1  28 f 1 17.1    26    ?     ?   71.7816   -145.051     77.8316    -145.051     9.17238    -145.051     
1 1 1 -1  3  28 o 0 46      31.8  ?     ?   170.273   -38.971      97.6295    -38.971      62.4183    141.029      
1 1 1 -1  3  27 o 0 63.2    22.3  ?     ?   213.228   -37.1546     128.911    -37.1546     76.0972    142.845      
1 1 1 -1  3  26 o 0 42.3    21    ?     ?   65.5524   93.3673      129.055    93.3673      61.6809    93.3673      
1 1 1 -1  3  25 o 0 39.1    20.1  ?     ?   104.658   59.1109      115.604    59.1109      7.6532     59.1109      
1 1 1 -1  3  24 o 0 92.6    18.5  ?     ?   173.641   -82.1814     245.266    -82.1814     79.9504    -82.1814     
1 1 1 -1  3  23 o 0 15.9    15.9  ?     ?   93.2159   -134.209     14.107     -134.209     75.2238    45.7906      
1 1 1 -1  3  22 o 0 65      12    ?     ?   137.199   123.485      186.444    123.485      50.258     123.485      
1 1 1 -1  3  21 o 0 297.3   15.3  ?     ?   339.997   -19.4902     475.986    -19.4902     129.46     -19.4902     
1 1 1 -1  3  20 o 0 324.6   13.6  ?     ?   400.958   -70.4168     389.286    -70.4168     17.5177    -70.4168     
1 1 1 -1  3  19 o 0 668     18    ?     ?   633.346   47.4374      541.727    47.4374      50.7166    -132.563     
1 1 1 -1  3  18 o 0 315.5   13.3  ?     ?   561.843   85.1691      241.877    85.1691      283.534    -94.8309     
1 1 1 -1  3  17 o 0 585.6   17.7  ?     ?   539.73    81.6634      541.026    81.6634      21.388     81.6634      
1 1 1 -1  3  16 o 0 1780    35.4  ?     ?   924.852   71.2926      979.194    71.2926      94.9161    71.2926      
1 1 1 -1  3  15 f 1 381.6   11.1  ?     ?   484.033   -86.4057     364.533    -86.4057     104.043    93.5943      
1 1 1 -1  3  14 o 0 525.3   13.1  ?     ?   402.518   40.8283      589.932    40.8283      194.43     40.8283      
1 1 1 -1  3  13 o 0 60.1    6.3   ?     ?   281.819   138.142      16.0554    -41.8583     294.768    -41.8583     
1 1 1 -1  3  12 o 0 757.9   16.7  ?     ?   678.458   -73.5413     597.05     -73.5414     105.23     106.459      
1 1 1 -1  3  11 o 0 1465.2  26.7  ?     ?   938.668   -101.885     861.99     -101.885     115.213    78.115       
1 1 1 -1  3  10 o 0 957.7   23    ?     ?   748.332   170.548      716.695    170.548      84.5121    -9.45238     
1 1 1 -1  3  9  o 0 346     8.4   ?     ?   462.721   14.7677      389.53     14.7677      104.04     -165.232     
1 1 1 -1  3  8  o 0 146.5   4.1   ?     ?   198.393   -157.874     258.749    -157.874     46.1662    -157.874     
1 1 1 -1  3  5  o 0 433.8   8.3   ?     ?   359.624   -46.9697     537.272    -46.9697     191.548    -46.9697     
1 1 1 -1  3  4  o 0 679.3   13.2  ?     ?   492.621   8.22067      665.631    8.22067      190.962    8.22067      
1 1 1 -1  3  3  o 0 1129.4  19.8  ?     ?   644.144   52.9557      854.637    52.9557      247.098    52.9557      
1 1 1 -1  3  2  o 0 1760.5  30.2  ?     ?   897.283   -155.417     996.589    -155.417     150.371    -155.417     
1 1 1 -1  3  1  o 0 1491.6  26.4  ?     ?   893.189   27.6947      834.083    27.6947      9.40584    27.6947      
1 1 1 1   3  0  o 0 1247    22.4  ?     ?   790.479   -114.538     777.937    -114.538     51.7445    -114.538     
1 1 1 1   3  1  o 0 246.1   5.1   ?     ?   615.691   110.895      80.4886    110.895      487.053    -69.1048     
1 1 1 1   3  2  o 0 2750.5  46.4  ?     ?   1049.64   -113.432     1321.04    -113.432     332.204    -113.432     
1 1 1 1   3  3  o 0 934.7   16.8  ?     ?   969.822   -41.3101     423.414    -41.3101     490.776    138.69       
1 1 1 1   3  4  o 0 911.5   18.9  ?     ?   819.897   -106.085     555.636    -106.085     234.276    73.9154      
1 1 1 1   3  6  o 0 338     6.8   ?     ?   631.836   -56.3243     199.079    -56.3243     431.44     123.676      
1 1 1 1   3  7  o 0 141.8   3.6   ?     ?   237.558   -172.757     216.456    -172.757     19.7981    7.2427       
1 1 1 1   3  8  o 0 351.4   7.4   ?     ?   357.967   -169.622     495.104    -169.622     111.212    -169.622     
1 1 1 1   3  9  o 0 406.2   10.2  ?     ?   462.288   -122.666     468.642    -122.666     24.9506    57.334       
1 1 1 1   3  10 o 0 901.6   21.6  ?     ?   645.412   -87.1379     776.707    -87.1379     84.9314    -87.1379     
1 1 1 1   3  11 o 0 790.2   19.8  ?     ?   427.044   -36.4324     871.294    -36.4324     426.182    -36.4324     
1 1 1 1   3  12 o 0 155.5   6.7   ?     ?   185.315   -165.414     271.325    -165.414     79.2539    -165.414     
1 1 1 1   3  13 o 0 294.6   10.6  ?     ?   227.532   72.8872      456.205    72.8872      230.868    72.8872      
1 1 1 1   3  14 o 0 792.9   17.6  ?     ?   853.274   24.5254      415.013    24.5254      424.627    -155.475     
1 1 1 1   3  15 f 1 397.9   12.3  ?     ?   387.661   105.424      464.847    105.424      88.9779    105.424      
1 1 1 1   3  16 o 0 270.2   13.4  ?     ?   309.92    -142.891     363.074    -142.891     66.2608    -142.891     
1 1 1 1   3  17 o 0 229     11.8  ?     ?   164.696   177.823      370.577    177.823      211.737    177.823      
1 1 1 1   3  18 o 0 193.7   13.1  ?     ?   328.729   129.154      258.323    129.154      49.6485    -50.8456     
1 1 1 1   3  19 o 0 299.3   13.3  ?     ?   315.004   -116.04      430.704    -116.04      135.483    -116.04      
1 1 1 1   3  20 o 0 173.5   12.3  ?     ?   171.695   -44.1087     325.54     -44.1087     166.028    -44.1087     
1 1 1 1   3  21 o 0 505.1   16.4  ?     ?   282.303   63.5429      789.902    63.5429      501.582    63.5429      
1 1 1 1   3  22 o 0 176.6   13.3  ?     ?   248.205   95.205       369.663    95.205       122.758    95.205       
1 1 1 1   3  23 o 0 100.6   14.1  ?     ?   339.173   137.125      135.712    137.125      190.055    -42.8752     
1 1 1 1   3  24 o 0 -9.8    16.6  ?     ?   285.262   148.277      166.055    -31.7227     438.275    -31.7227     
1 1 1 1   3  25 o 0 159.8   19.3  ?     ?   264.803   147.351      327.957    147.351      54.1588    147.351      
1 1 1 1   3  26 o 0 -46.3   20.8  ?     ?   42.759    93.2716      18.1809    -86.7284     62.2391    -86.7284     
1 1 1 1   3  27 o 0 94.7    20.7  ?     ?   188.153   -26.9077     251.925    -26.9077     70.5497    -26.9077     
1 1 1 1   3  28 o 0 39.5    24.2  ?     ?   210.844   35.5168      51.2476    35.5168      147.474    -144.483     
1 1 1 -1  5  28 < 0 26.1    17.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  5  27 o 0 -6.3    16.1  ?     ?   125.247   105.033      20.3129    -74.9674     136.814    -74.9674     
1 1 1 -1  5  26 o 0 35.9    18.2  ?     ?   103.403   65.8906      114.053    65.8906      15.4531    65.8906      
1 1 1 -1  5  25 o 0 39.2    16.2  ?     ?   210.166   52.8262      47.8701    52.8262      166.35     -127.174     
1 1 1 -1  5  24 o 0 78.6    15.6  ?     ?   214.083   28.7501      187.326    28.7501      24.1619    -151.25      
1 1 1 -1  5  23 o 0 31.8    19.5  ?     ?   125.565   -8.30782     66.2537    -8.30782     52.2869    171.692      
1 1 1 -1  5  22 o 0 1.7     17.9  ?     ?   83.3904   -95.4933     10.852     84.5067      90.0887    84.5067      
1 1 1 -1  5  21 o 0 155.3   12.6  ?     ?   334.469   -97.2685     249.927    -97.2685     79.2266    82.7315      
1 1 1 -1  5  20 o 0 51.3    11.9  ?     ?   206.705   -117.114     64.0334    -117.114     148.524    62.8856      
1 1 1 -1  5  19 o 0 -16.2   11.7  ?     ?   54.3723   -146.024     40.5537    33.9764      90.6838    33.9764      
1 1 1 -1  5  18 o 0 187.8   12.1  ?     ?   403.035   -64.7911     195.54     -64.7911     178.109    115.209      
1 1 1 -1  5  17 o 0 367.2   13.3  ?     ?   445.495   -23.5472     400.785    -23.5472     12.0575    156.453      
1 1 1 -1  5  16 o 0 36.7    9.4   ?     ?   373.696   -108.947     154.843    71.0532      511.325    71.0532      
1 1 1 -1  5  15 o 0 206.4   11    ?     ?   367.508   -171.67      230.91     -171.67      126.585    8.32994      
1 1 1 -1  5  14 o 0 186.1   8.9   ?     ?   614.283   25.3649      14.3647    -154.635     600.352    -154.635     
1 1 1 -1  5  13 o 0 3127.9  55.9  ?     ?   1035.71   -53.3354     1484.88    -53.3354     477.133    -53.3354     
1 1 1 -1  5  12 o 0 758.4   15.1  ?     ?   738.007   19.3805      493.811    19.3805      228.767    -160.62      
1 1 1 -1  5  11 o 0 1608.8  34    ?     ?   1141.96   68.8009      731.873    68.8009      438.009    -111.199     
1 1 1 -1  5  10 o 0 270.3   6.7   ?     ?   447.618   133.872      279.663    133.872      181.36     -46.1279     
1 1 1 -1  5  9  o 0 1358.6  25    ?     ?   915.884   -136.954     811.305    -136.954     136.606    43.0456      
1 1 1 -1  5  8  o 0 20.2    2.9   ?     ?   79.3701   59.4674      40.8735    -120.533     123.377    -120.533     
1 1 1 -1  5  7  o 0 1968    40    ?     ?   909.341   78.4662      1224.81    78.4662      262.591    78.4662      
1 1 1 -1  5  6  o 0 59.4    2.5   ?     ?   124.253   61.2233      42.7209    61.2233      89.1718    -118.777     
1 1 1 -1  5  5  o 0 498     10.3  ?     ?   498.364   87.9026      541.249    87.9026      10.947     87.9026      
1 1 1 -1  5  4  o 0 1165.1  21.1  ?     ?   722.605   -44.1421     842.94     -44.1421     131.507    -44.1421     
1 1 1 -1  5  3  f 1 1801    31.2  ?     ?   690.63    -32.4421     1256.17    -32.4421     572.145    -32.4421     
1 1 1 -1  5  1  o 0 940.1   17.4  ?     ?   649.353   149.784      750.398    149.784      111.076    149.784      
1 1 1 1   5  0  o 0 221.5   4.8   ?     ?   362.536   -21.7285     270.01     -21.7285     86.0389    158.272      
1 1 1 1   5  2  o 0 1678.5  29.8  ?     ?   1011.36   -124.508     884.907    -124.508     111.056    55.4915      
1 1 1 1   5  3  f 1 318.6   6.5   ?     ?   200.644   -82.0938     511.618    -82.0938     312.962    -82.0938     
1 1 1 1   5  4  o 0 519.7   10.2  ?     ?   408.721   127.373      601.226    127.373      198.864    127.373      
1 1 1 1   5  5  o 0 509.7   9.8   ?     ?   420.819   140.676      627.758    140.676      179.914    140.676      
1 1 1 1   5  6  o 0 503.8   9.8   ?     ?   604.672   -150.746     442.415    -150.746     199.652    29.2541      
1 1 1 1   5  7  o 0 171.3   4.5   ?     ?   360.312   97.4571      202.63     97.4571      178.835    -82.5429     
1 1 1 1   5  8  o 0 882.1   16.9  ?     ?   644.109   -73.4263     739.416    -73.4263     69.4144    -73.4263     
1 1 1 1   5  9  o 0 209.8   6.7   ?     ?   305.938   136.634      306.945    136.634      9.96161    -43.3657     
1 1 1 1   5  10 o 0 335.1   8.8   ?     ?   274.734   104.31       514.023    104.31       230.781    104.31       
1 1 1 1   5  11 o 0 152     6.2   ?     ?   348.705   0.898673     165.915    0.898673     191.718    -179.101     
1 1 1 1   5  12 o 0 1106.1  21.5  ?     ?   724.793   -52.4078     765.852    -52.4078     55.3326    -52.4078     
1 1 1 1   5  13 o 0 179.5   7.8   ?     ?   376.501   136.016      176.092    136.016      190.736    -43.9842     
1 1 1 1   5  14 o 0 474.1   14.1  ?     ?   591.514   162.885      370.067    162.885      195.021    -17.1146     
1 1 1 1   5  15 o 0 455     14.3  ?     ?   654.281   -148.449     299.783    -148.449     337.662    31.5507      
1 1 1 1   5  16 o 0 370.7   12.9  ?     ?   385.08    -129.773     442.789    -129.773     74.8398    -129.773     
1 1 1 1   5  17 o 0 325.3   14    ?     ?   386.564   -157.405     398.192    -157.405     39.333     -157.405     
1 1 1 1   5  18 o 0 623.5   19    ?     ?   447.448   162.342      660.996    162.342      245.406    162.342      
1 1 1 1   5  19 o 0 123.4   11.7  ?     ?   343.704   157.691      153.615    157.691      203.74     -22.3089     
1 1 1 1   5  20 o 0 5.7     13.3  ?     ?   140.657   155.974      64.2228    -24.0262     206.625    -24.0262     
1 1 1 1   5  21 o 0 123.7   14.7  ?     ?   227.406   -135.199     276.623    -135.199     52.3545    -135.199     
1 1 1 1   5  22 o 0 144.2   17.7  ?     ?   335.876   122.366      232.25     122.366      87.6053    -57.6344     
1 1 1 1   5  23 o 0 -21.5   19.1  ?     ?   102.145   28.67        43.3783    -151.33      140.032    -151.33      
1 1 1 1   5  24 o 0 44      23.7  ?     ?   208.682   89.4978      62.5215    89.4978      144.128    -90.5022     
1 1 1 1   5  25 o 0 -8.4    24.7  ?     ?   105.426   141.317      4.39381    141.317      103.335    -38.6828     
1 1 1 1   5  26 o 0 11.7    20.7  ?     ?   145.89    -107.656     16.5079    -107.656     122.969    72.3444      
1 1 1 1   5  27 o 0 101.4   21.5  ?     ?   195.265   139.204      261.796    139.204      79.6738    139.204      
1 1 1 1   5  28 < 0 72.7    27.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  7  26 o 0 -3.2    23.3  ?     ?   62.8944   -114.34      43.7655    -114.34      13.9151    65.6604      
1 1 1 -1  7  25 o 0 21.5    21.2  ?     ?   115.911   -67.5487     60.744     -67.5488     47.9764    112.451      
1 1 1 -1  7  24 o 0 5.6     21    ?     ?   100.194   -157.856     17.8847    -157.856     82.562     22.1439      
1 1 1 -1  7  23 o 0 88.6    19.9  ?     ?   165.416   -101.394     243.254    -101.394     76.8591    -101.394     
1 1 1 -1  7  22 o 0 620.9   23.3  ?     ?   532.954   -100.273     653.876    -100.273     154.806    -100.273     
1 1 1 -1  7  21 o 0 131.4   14.6  ?     ?   269.376   -106.347     259.837    -106.347     8.19048    -106.347     
1 1 1 -1  7  20 o 0 73.9    12.7  ?     ?   334.175   19.3139      59.2182    19.3139      264.051    -160.686     
1 1 1 -1  7  19 o 0 23.2    10.2  ?     ?   98.0196   47.9947      10.5009    47.9947      86.8309    -132.005     
1 1 1 -1  7  18 o 0 303.1   13    ?     ?   398.052   -88.5193     408.787    -88.5193     2.91406    -88.5193     
1 1 1 -1  7  17 f 1 1654.5  32.5  ?     ?   981.786   -50.8721     860.889    -50.8721     37.8655    129.128      
1 1 1 -1  7  16 f 1 214.9   13.3  ?     ?   350.377   -119.178     266.672    -119.178     53.8584    60.8225      
1 1 1 -1  7  15 o 0 507.6   19.2  ?     ?   520.288   29.6018      483.918    29.6018      6.76433    29.6018      
1 1 1 -1  7  14 o 0 489.2   14.5  ?     ?   302.045   -65.468      626.633    -65.468      341.697    -65.468      
1 1 1 -1  7  13 f 1 124.9   8.3   ?     ?   139.35    176.365      173.254    176.365      38.6196    176.365      
1 1 1 -1  7  12 o 0 387.3   11.7  ?     ?   354.57    177.04       468.992    177.04       135.044    177.04       
1 1 1 -1  7  11 o 0 2136.7  38.4  ?     ?   952.717   89.6486      1123.54    89.6486      221.03     89.6486      
1 1 1 -1  7  10 o 0 347     10    ?     ?   254.157   64.6661      496.464    64.6661      251.235    64.6661      
1 1 1 -1  7  9  o 0 352.3   9     ?     ?   264.9     82.0654      498.763    82.0654      241.953    82.0654      
1 1 1 -1  7  8  o 0 1028.5  19.5  ?     ?   782.407   40.9813      687.799    40.9813      114.14     -139.019     
1 1 1 -1  7  7  o 0 900.8   19.6  ?     ?   535.052   175.71       841.183    175.71       297.355    175.71       
1 1 1 -1  7  6  o 0 334.8   7.7   ?     ?   215.337   144.454      542.733    144.454      323.206    144.454      
1 1 1 -1  7  5  o 0 1423.5  29.4  ?     ?   904.743   -156.597     853.564    -156.597     70.9663    23.403       
1 1 1 -1  7  4  o 0 40.1    2.8   ?     ?   234.213   104.042      50.8232    -75.9581     290.57     -75.9581     
1 1 1 -1  7  3  o 0 603.7   13.5  ?     ?   475.244   -128.572     642.995    -128.572     156.003    -128.572     
1 1 1 -1  7  2  o 0 865.2   16.4  ?     ?   762.07    -159.349     599.525    -159.349     181.726    20.6511      
1 1 1 -1  7  1  o 0 118     3.3   ?     ?   199.029   -158.323     189.826    -158.323     18.8669    21.6773      
1 1 1 1   7  0  o 0 1040.5  19.4  ?     ?   777.627   -146.393     735.965    -146.393     78.4833    33.6073      
1 1 1 1   7  1  o 0 863.8   16.9  ?     ?   630.706   37.1259      743.19     37.1259      82.0853    37.1259      
1 1 1 1   7  2  o 0 148.8   4     ?     ?   284.084   -135.01      208.278    -135.01      82.9007    44.9902      
1 1 1 1   7  3  o 0 300.9   6.4   ?     ?   463.492   -91.2033     307.269    -91.2033     167.663    88.7967      
1 1 1 1   7  4  o 0 301.3   7.2   ?     ?   391.317   -16.1333     371.982    -16.1333     28.6304    163.867      
1 1 1 1   7  5  o 0 949.6   17.9  ?     ?   791.882   -118.958     635.45     -118.958     173.982    61.0421      
1 1 1 1   7  6  o 0 1107.1  24.1  ?     ?   635.427   54.3652      903.756    54.3652      255.68     54.3652      
1 1 1 1   7  7  o 0 7.4     2.8   ?     ?   237.924   -109.738     200.47     70.2621      442.44     70.2621      
1 1 1 1   7  8  o 0 3554.9  62.3  ?     ?   1324.19   -87.4257     1449.37    -87.4257     91.1204    -87.4257     
1 1 1 1   7  9  o 0 395.2   10.8  ?     ?   532.981   -34.1096     333.205    -34.1096     183.953    145.89       
1 1 1 1   7  10 o 0 2260.7  40.3  ?     ?   897.577   -95.2124     1230.71    -95.2124     363.792    -95.2124     
1 1 1 1   7  11 o 0 3145.8  55.1  ?     ?   1286.57   -151.214     1251.69    -151.214     31.5391    -151.214     
1 1 1 1   7  12 o 0 1390.6  28.6  ?     ?   888.205   -125.241     783.299    -125.241     54.2968    54.7586      
1 1 1 1   7  13 f 1 183.3   9.3   ?     ?   213.895   -95.7575     286.345    -95.7575     81.8797    -95.7575     
1 1 1 1   7  14 o 0 139.7   10.6  ?     ?   299.737   54.2621      163.304    54.2621      119.872    -125.738     
1 1 1 1   7  15 o 0 314.6   13    ?     ?   409.992   -122.981     362.326    -122.981     14.2717    57.0187      
1 1 1 1   7  16 f 1 1142.6  25    ?     ?   647.863   -173.582     866.421    -173.582     272.745    -173.582     
1 1 1 1   7  17 f 1 29.4    12    ?     ?   65.0758   163.495      4.01374    -16.5052     63.6927    -16.5052     
1 1 1 1   7  18 o 0 137.3   11.9  ?     ?   382.136   116.45       145.607    116.45       244.775    -63.5504     
1 1 1 1   7  19 o 0 191.1   15.3  ?     ?   135.139   107.281      452.009    107.281      317.551    107.281      
1 1 1 1   7  20 o 0 96.6    14.3  ?     ?   161.31    88.7426      255.772    88.7426      99.4001    88.7426      
1 1 1 1   7  21 o 0 10.2    14.9  ?     ?   14.1706   119.939      1.07778    119.939      12.1891    -60.0605     
1 1 1 1   7  22 o 0 120.9   20.3  ?     ?   154.884   -13.766      320.246    -13.766      174.878    -13.766      
1 1 1 1   7  23 o 0 2.4     19.2  ?     ?   33.079    -49.8616     6.93839    -49.8616     26.4159    130.138      
1 1 1 1   7  24 o 0 14.7    20.2  ?     ?   78.4522   168.527      42.024     168.527      36.8215    -11.4729     
1 1 1 1   7  25 o 0 101.4   24.7  ?     ?   218.814   -30.5041     231.05     -30.5041     25.2789    -30.5041     
1 1 1 1   7  26 o 0 11.2    24.1  ?     ?   58.0557   -28.4019     70.4583    -28.4019     17.072     -28.4019     
1 1 1 1   7  27 < 0 13.6    26.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  9  25 < 0 28.6    20.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  9  24 o 0 19      17.7  ?     ?   46.7496   38.4594      55.3545    38.4594      13.1385    38.4594      
1 1 1 -1  9  23 f 1 59.6    16.6  ?     ?   277.131   -25.9606     64.3365    -25.9606     198.856    154.039      
1 1 1 -1  9  22 o 0 55.5    17.3  ?     ?   29.0018   -112.866     120.799    -112.866     92.137     -112.866     
1 1 1 -1  9  21 o 0 226.2   17.1  ?     ?   242.922   135.256      451.886    135.256      211.141    135.256      
1 1 1 -1  9  20 o 0 70.6    15.7  ?     ?   163.694   104.738      186.067    104.738      36.4503    104.738      
1 1 1 -1  9  19 o 0 36.5    12.2  ?     ?   121.327   -160.78      88.9496    -160.78      22.5758    19.2198      
1 1 1 -1  9  18 f 1 -0.9    12.7  ?     ?   159.464   -141.204     80.7741    38.7955      233.241    38.7955      
1 1 1 -1  9  17 o 0 174.2   13.2  ?     ?   259.937   -68.5463     331.895    -68.5463     78.2635    -68.5463     
1 1 1 -1  9  16 f 1 82.1    10.4  ?     ?   326.307   89.3187      63.0314    89.3187      265.351    -90.6813     
1 1 1 -1  9  15 o 0 59.2    10.8  ?     ?   279.201   30.686       37.8365    30.686       243.865    -149.314     
1 1 1 -1  9  14 o 0 338.5   11.9  ?     ?   348.07    -66.4319     436.442    -66.4319     123.148    -66.4319     
1 1 1 -1  9  13 o 0 251     10    ?     ?   358.439   -67.5786     310.829    -67.5787     11.1694    112.421      
1 1 1 -1  9  12 o 0 281.9   10.5  ?     ?   292.933   37.9531      400.399    37.9531      135.588    37.9531      
1 1 1 -1  9  11 o 0 6.7     6.5   ?     ?   132.437   -46.8491     101.286    133.151      224.266    133.151      
1 1 1 -1  9  10 o 0 360.5   11.2  ?     ?   163.808   122.437      534.972    122.437      382.056    122.437      
1 1 1 -1  9  9  o 0 497.9   14.5  ?     ?   198.479   134.309      682.509    134.309      494.092    134.309      
1 1 1 -1  9  8  o 0 380     11.6  ?     ?   462.692   37.2006      369.194    37.2006      60.303     -142.799     
1 1 1 -1  9  7  o 0 451.7   10.6  ?     ?   686.2     -169.378     255.351    -169.378     383.95     10.6221      
1 1 1 -1  9  6  o 0 830.6   16.4  ?     ?   741.503   9.77833      530.398    9.77833      171.709    -170.222     
1 1 1 -1  9  5  o 0 975.4   22.1  ?     ?   862.842   7.30614      526.244    7.30614      292.818    -172.694     
1 1 1 -1  9  4  o 0 3505.4  70.5  ?     ?   1146.42   -62.5        1491.74    -62.5        401.35     -62.5        
1 1 1 -1  9  3  o 0 73.1    3.5   ?     ?   305.853   -177.117     6.00728    -177.117     285.304    2.88251      
1 1 1 -1  9  2  o 0 43.8    3.9   ?     ?   445.048   -66.7889     186.002    113.211      610.255    113.211      
1 1 1 -1  9  1  o 0 671.5   24.5  ?     ?   752.811   23.5813      395.423    23.5813      322.46     -156.419     
1 1 1 1   9  0  o 0 1722.4  31.1  ?     ?   1041.72   -70.4427     814.61     -70.4427     178.538    109.557      
1 1 1 1   9  1  o 0 208.2   7.5   ?     ?   329.402   18.5585      253.987    18.5585      60.1311    -161.442     
1 1 1 1   9  2  o 0 1000.2  19.1  ?     ?   780.024   113.649      622.376    113.649      121.286    -66.3506     
1 1 1 1   9  3  o 0 1066.6  20.2  ?     ?   976.273   -140.246     485.89     -140.246     444.184    39.7537      
1 1 1 1   9  4  o 0 484.1   11.5  ?     ?   544.423   33.2406      410.128    33.2406      107.871    -146.759     
1 1 1 1   9  5  o 0 39.2    3.5   ?     ?   203.807   -38.9361     41.0113    141.064      234.572    141.064      
1 1 1 1   9  6  o 0 117     5.4   ?     ?   345.66    -57.0523     80.2767    -57.0523     247.218    122.948      
1 1 1 1   9  7  o 0 48.8    4.8   ?     ?   143.752   144.011      2.69129    144.011      131.334    -35.9887     
1 1 1 1   9  8  o 0 2291.2  41.2  ?     ?   1210.77   147.477      938.307    147.477      186.56     -32.5232     
1 1 1 1   9  9  o 0 1049.6  22.1  ?     ?   457.968   172.15       956.367    172.15       521.191    172.15       
1 1 1 1   9  10 o 0 34.6    7.9   ?     ?   345.079   47.3055      139.303    -132.695     461.79     -132.695     
1 1 1 1   9  11 o 0 264.5   9.5   ?     ?   447.034   139.994      249.767    139.994      165.85     -40.0063     
1 1 1 1   9  12 o 0 304.1   15.3  ?     ?   557.33    -167.541     223.546    -167.541     280.949    12.4591      
1 1 1 1   9  13 o 0 148     9.8   ?     ?   211.299   -132.687     235.895    -132.687     45.8045    -132.687     
1 1 1 1   9  14 o 0 72.7    9.2   ?     ?   240.785   138.64       80.0359    138.64       137.027    -41.3604     
1 1 1 1   9  15 o 0 166.5   12.4  ?     ?   226.575   122.095      333.431    122.095      104.45     122.095      
1 1 1 1   9  16 f 1 27.1    10.6  ?     ?   78.3859   84.1096      5.94295    84.1096      73.0801    -95.8904     
1 1 1 1   9  17 o 0 134.5   12.7  ?     ?   251.496   -34.9083     262.847    -34.9083     16.9953    -34.9083     
1 1 1 1   9  18 f 1 39.4    12.5  ?     ?   52.1632   165.218      72.9213    165.218      22.9489    165.218      
1 1 1 1   9  19 o 0 58.5    14.1  ?     ?   83.4667   -80.5503     169.034    -80.5503     92.1517    -80.5503     
1 1 1 1   9  20 o 0 37.7    15.3  ?     ?   76.3595   -76.6175     89.1458    -76.6175     19.2024    -76.6175     
1 1 1 1   9  21 o 0 52.3    17.3  ?     ?   135.639   -156.486     150.427    -156.486     15.6993    -156.486     
1 1 1 1   9  22 o 0 -20.6   21.8  ?     ?   90.5488   22.4254      16.0876    -157.575     105.786    -157.575     
1 1 1 1   9  23 f 1 0       17.3  ?     ?   147.681   142.907      32.0765    -37.093      172.676    -37.093      
1 1 1 1   9  24 o 0 43.9    16.8  ?     ?   151.697   144.638      119.857    144.638      17.4806    -35.3619     
1 1 1 1   9  25 < 0 50.7    25.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  11 23 < 0 11.2    22    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  11 22 o 0 75.1    18.1  ?     ?   167.604   129.743      206.975    129.743      58.9716    129.743      
1 1 1 -1  11 21 o 0 31.3    19    ?     ?   114.408   133.088      88.3604    133.088      15.0785    -46.9122     
1 1 1 -1  11 20 o 0 38.6    16.9  ?     ?   218.36    46.0635      32.6295    46.0635      178.127    -133.936     
1 1 1 -1  11 19 f 1 98.7    19.2  ?     ?   206.715   51.803       226.097    51.803       25.1273    51.803       
1 1 1 -1  11 18 o 0 7.7     16.7  ?     ?   88.3119   -14.2114     2.48824    -14.2114     76.9239    165.789      
1 1 1 -1  11 17 f 1 23.2    13.9  ?     ?   230.848   -6.65786     32.4144    173.342      241.065    173.342      
1 1 1 -1  11 16 o 0 352.3   16.3  ?     ?   418.559   0.165212     462.415    0.165212     84.3407    0.165212     
1 1 1 -1  11 15 o 0 17.9    10.6  ?     ?   119.914   -115.378     3.19456    64.6223      115.145    64.6223      
1 1 1 -1  11 14 f 1 81      11.5  ?     ?   200.216   -44.5601     172.142    -44.5601     20.3376    135.44       
1 1 1 -1  11 13 o 0 491.4   14.8  ?     ?   484.166   -75.3758     551.099    -75.3758     84.8357    -75.3758     
1 1 1 -1  11 12 f 1 99.1    9.5   ?     ?   246.362   178.548      170.032    178.548      74.2277    -1.45243     
1 1 1 -1  11 11 o 0 399     12    ?     ?   548.25    52.3344      337.461    52.3344      145.848    -127.666     
1 1 1 -1  11 10 o 0 928.1   20.7  ?     ?   730.471   34.9187      624.645    34.9187      20.7129    -145.081     
1 1 1 -1  11 9  o 0 727.9   16.1  ?     ?   520.407   22.8501      657.758    22.8501      195.752    22.8501      
1 1 1 -1  11 8  f 1 469.1   12.2  ?     ?   458.418   158.44       477.21     158.44       69.9346    158.44       
1 1 1 -1  11 7  o 0 1266.7  26.1  ?     ?   862.049   145.328      740.516    145.328      24.3498    -34.6722     
1 1 1 -1  11 6  o 0 618.4   14    ?     ?   611.391   87.7564      495.422    87.7564      48.826     -92.2436     
1 1 1 -1  11 5  o 0 530.6   12.6  ?     ?   562.451   161.701      443.134    161.701      69.6141    -18.2988     
1 1 1 -1  11 4  o 0 91.3    5.4   ?     ?   167.306   -107.551     104.409    -107.551     48.4541    72.4487      
1 1 1 -1  11 3  o 0 1083.8  22.7  ?     ?   563.005   -19.2961     873.125    -19.2961     357.835    -19.2961     
1 1 1 -1  11 2  o 0 154     7.4   ?     ?   292.742   -125.696     189.068    -125.696     79.1928    54.3043      
1 1 1 -1  11 1  o 0 65.1    5.3   ?     ?   389.619   -52.9094     69.3813    127.091      426.683    127.091      
1 1 1 1   11 0  o 0 25.1    5.5   ?     ?   85.416    125.415      32.5841    -54.5852     110.951    -54.5852     
1 1 1 1   11 1  o 0 608.3   16.1  ?     ?   641.927   71.6057      448.671    71.6057      140.17     -108.394     
1 1 1 1   11 2  o 0 776.5   20.8  ?     ?   459.919   -38.8118     740.395    -38.8118     318.781    -38.8118     
1 1 1 1   11 3  o 0 954.5   20.5  ?     ?   556.637   -113.773     791.046    -113.773     281.342    -113.773     
1 1 1 1   11 4  o 0 32.8    6.4   ?     ?   26.7109   -109.718     5.4101     70.2823      29.8293    70.2823      
1 1 1 1   11 5  o 0 1730.8  32.9  ?     ?   853.127   13.4356      993.729    13.4356      215.46     13.4356      
1 1 1 1   11 6  o 0 392.9   10.4  ?     ?   364.185   75.4005      476.316    75.4005      151.869    75.4005      
1 1 1 1   11 7  o 0 181.6   7.5   ?     ?   308.734   172.516      239.558    172.516      34.6168    -7.4839      
1 1 1 1   11 8  f 1 289.3   9.3   ?     ?   435.582   -58.1757     296.405    -58.1757     90.9731    121.824      
1 1 1 1   11 9  o 0 319.5   10.4  ?     ?   396.886   57.2646      370.839    57.2646      18.0986    57.2646      
1 1 1 1   11 10 o 0 468.8   12.8  ?     ?   544.151   44.6444      409.57     44.6444      71.7661    -135.356     
1 1 1 1   11 11 o 0 197.5   9.9   ?     ?   324.869   -149.134     270.184    -149.134     16.5854    30.8656      
1 1 1 1   11 12 f 1 622.6   16.4  ?     ?   375.206   -128.27      771.283    -128.27      398.744    -128.27      
1 1 1 1   11 13 o 0 121.8   10.2  ?     ?   240.407   -78.9484     242.271    -78.9484     10.397     -78.9484     
1 1 1 1   11 14 f 1 19.9    9.5   ?     ?   144.441   160.669      19.1339    -19.331      158.222    -19.331      
1 1 1 1   11 15 o 0 22.7    12.4  ?     ?   89.5243   -105.416     23.6053    -105.416     60.12      74.5844      
1 1 1 1   11 16 o 0 186.9   13.9  ?     ?   283.812   13.8597      342.392    13.8597      85.5576    13.8597      
1 1 1 1   11 17 f 1 127.8   16.4  ?     ?   194.365   58.6955      296.851    58.6955      120.834    58.6955      
1 1 1 1   11 18 o 0 21.1    15.9  ?     ?   139.602   -18.4011     22.8159    -18.4011     102.974    161.599      
1 1 1 1   11 19 f 1 61      17.1  ?     ?   83.614    -43.1776     196.296    -43.1776     114.831    -43.1776     
1 1 1 1   11 20 o 0 45.9    17.7  ?     ?   235.915   -78.7499     42.9045    -78.7499     185.308    101.25       
1 1 1 1   11 21 o 0 133     19.9  ?     ?   234.719   -80.8977     286.798    -80.8977     74.0857    -80.8977     
1 1 1 1   11 22 o 0 50      17.9  ?     ?   151.584   -27.1919     137.163    -27.1919     2.9774     -27.1919     
1 1 1 1   11 23 < 0 17.7    24.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  13 21 < 0 17.7    22.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  13 20 o 0 4.5     24.6  ?     ?   80.8647   -80.4977     53.5843    -80.4977     15.7569    99.5023      
1 1 1 -1  13 19 o 0 18.2    23.3  ?     ?   132.404   -50.315      47.5933    -50.315      66.7989    129.685      
1 1 1 -1  13 18 o 0 -11.5   18.4  ?     ?   31.5565   -175.288     1.13909    -175.288     26.7431    4.71154      
1 1 1 -1  13 17 o 0 35.9    18.1  ?     ?   92.208    -149.975     102.132    -149.975     18.1847    -149.975     
1 1 1 -1  13 16 o 0 149.6   16.2  ?     ?   214.433   90.638       325.482    90.638       121.753    90.638       
1 1 1 -1  13 15 o 0 146.1   14.3  ?     ?   283.99    45.7349      262.326    45.7349      7.61069    -134.265     
1 1 1 -1  13 14 o 0 11.9    12.9  ?     ?   48.9127   4.42454      6.77823    4.42454      36.3714    -175.575     
1 1 1 -1  13 13 o 0 155.4   11.8  ?     ?   272.616   143.297      287.231    143.297      47.1546    143.297      
1 1 1 -1  13 12 f 1 17.6    9.4   ?     ?   130.137   136.875      0.0866444  136.875      115.422    -43.1249     
1 1 1 -1  13 11 o 0 21      8.9   ?     ?   127.457   129.294      18.4831    129.294      94.7464    -50.706      
1 1 1 -1  13 10 o 0 142.3   10    ?     ?   285.979   15.5315      249.149    15.5315      12.8344    -164.469     
1 1 1 -1  13 9  o 0 126.7   8.8   ?     ?   449.281   85.6832      80.3236    85.6832      333.328    -94.3168     
1 1 1 -1  13 8  o 0 150.3   8.4   ?     ?   292.555   85.9652      251.592    85.9652      23.5782    -94.0348     
1 1 1 -1  13 7  o 0 132.9   9.2   ?     ?   192.53    -3.04816     294.28     -3.04816     112.464    -3.04816     
1 1 1 -1  13 6  o 0 146.5   6.8   ?     ?   165.145   -43.7746     316.927    -43.7746     157.642    -43.7746     
1 1 1 -1  13 5  o 0 426.8   13.2  ?     ?   419.951   -88.7364     518.911    -88.7364     112.641    -88.7364     
1 1 1 -1  13 4  o 0 25.3    6.1   ?     ?   67.2361   39.4102      5.08972    39.4102      60.1197    -140.59      
1 1 1 -1  13 3  o 0 331.6   10.3  ?     ?   339.379   89.5496      478.683    89.5496      148.865    89.5496      
1 1 1 -1  13 2  f 1 27.1    6.2   ?     ?   109.179   44.6415      7.04583    44.6415      99.7677    -135.359     
1 1 1 -1  13 1  o 0 348.1   10.6  ?     ?   604.298   177.272      230.33     177.272      292.82     -2.72808     
1 1 1 1   13 0  o 0 228.8   8.5   ?     ?   222.985   111.42       365.177    111.42       172.548    111.42       
1 1 1 1   13 1  o 0 75.9    6.5   ?     ?   68.5335   -53.9525     116.601    -53.9525     57.241     -53.9525     
1 1 1 1   13 2  f 1 321.2   10.2  ?     ?   372.748   10.9776      435.523    10.9776      70.6346    10.9776      
1 1 1 1   13 3  o 0 153.6   7     ?     ?   234.991   -96.3749     291.844    -96.3749     63.3175    -96.3749     
1 1 1 1   13 4  o 0 673.3   15.9  ?     ?   385.544   -76.3261     796.815    -76.3261     422.601    -76.3261     
1 1 1 1   13 5  o 0 43.2    6.6   ?     ?   288.669   -43.8133     23.1188    136.187      302.628    136.187      
1 1 1 1   13 6  o 0 6.9     6     ?     ?   168.635   99.1656      113.462    -80.8344     276.272    -80.8344     
1 1 1 1   13 7  o 0 31.3    7.1   ?     ?   185.119   76.1366      20.1931    76.1366      154.812    -103.863     
1 1 1 1   13 8  o 0 281.5   12.1  ?     ?   415.903   172.014      352.847    172.014      38.7968    -7.98634     
1 1 1 1   13 9  o 0 121.4   9.1   ?     ?   179.171   -42.9604     289.648    -42.9604     124.477    -42.9604     
1 1 1 1   13 10 o 0 2.2     9.3   ?     ?   127.767   -48.2718     65.8961    131.728      183.102    131.728      
1 1 1 1   13 11 o 0 14.3    9.7   ?     ?   149.015   172.618      23.1834    -7.38195     155.758    -7.38195     
1 1 1 1   13 12 f 1 61.6    10.3  ?     ?   270.946   95.9033      81.7935    95.9033      159.072    -84.0967     
1 1 1 1   13 13 o 0 39.2    11.5  ?     ?   87.7672   -173.385     103.192    -173.385     25.772     -173.385     
1 1 1 1   13 14 o 0 -1      13.9  ?     ?   129.867   -136.26      41.5436    43.7399      156.31     43.7399      
1 1 1 1   13 15 o 0 37.5    14.5  ?     ?   141.287   -145.154     90.0147    -145.154     44.5296    34.8463      
1 1 1 1   13 16 o 0 377.4   18.5  ?     ?   487.288   179.678      409.942    179.678      53.9237    -0.321609    
1 1 1 1   13 17 o 0 129.4   19.7  ?     ?   246.868   -131.757     258.759    -131.757     33.5477    -131.757     
1 1 1 1   13 18 o 0 87.3    21.3  ?     ?   138.358   -127.548     247.68     -127.548     125.169    -127.548     
1 1 1 1   13 19 o 0 26.5    22.4  ?     ?   68.8836   -162.93      86.5583    -162.93      26.9117    -162.93      
1 1 1 1   13 20 o 0 -3.4    22.9  ?     ?   115.883   71.9976      21.5694    71.9976      78.0332    -108.002     
1 1 1 1   13 21 < 0 27.5    20.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  15 17 < 0 12.1    25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  15 16 o 0 28.4    20.1  ?     ?   110.006   22.3495      86.4753    22.3495      5.68532    -157.65      
1 1 1 -1  15 15 o 0 84.4    19.7  ?     ?   149.291   12.9281      231.138    12.9281      105.331    12.9281      
1 1 1 -1  15 14 o 0 59.2    18.2  ?     ?   41.9121   95.6294      155.46     95.6294      119.401    95.6294      
1 1 1 -1  15 13 o 0 104.5   16.5  ?     ?   242.204   98.318       204.155    98.318       10.1886    -81.682      
1 1 1 -1  15 12 o 0 69.8    14.1  ?     ?   132.8     112.799      205.689    112.799      87.3784    112.799      
1 1 1 -1  15 11 o 0 304.9   15.4  ?     ?   275.817   38.2402      501.433    38.2402      245.57     38.2402      
1 1 1 -1  15 10 o 0 139.5   13.9  ?     ?   143.825   58.7242      352.854    58.7242      219.673    58.7242      
1 1 1 -1  15 9  o 0 225.7   13.5  ?     ?   333.483   -46.4749     347.356    -46.4749     36.9374    -46.4749     
1 1 1 -1  15 8  o 0 210.2   11.9  ?     ?   362.497   -43.7013     295.203    -43.7013     17.106     136.299      
1 1 1 -1  15 7  o 0 16.6    9.2   ?     ?   54.7904   -129.479     15.2102    -129.479     32.1946    50.521       
1 1 1 -1  15 6  o 0 333.5   12.3  ?     ?   409.301   125.305      424.717    125.305      72.3479    125.305      
1 1 1 -1  15 5  o 0 70.3    8.5   ?     ?   258.783   92.128       114.102    92.128       109.413    -87.872      
1 1 1 -1  15 4  o 0 131.9   9.5   ?     ?   352.262   -2.90478     176.946    -2.90478     128.156    177.095      
1 1 1 -1  15 3  o 0 48.3    8.3   ?     ?   245.379   -35.3212     60.9968    -35.3212     151.222    144.679      
1 1 1 -1  15 2  o 0 232.1   10.8  ?     ?   334.419   147.857      357.853    147.857      68.0971    147.857      
1 1 1 -1  15 1  o 0 77.6    8.1   ?     ?   306.124   157.271      97.62      157.271      167.984    -22.7286     
1 1 1 1   15 0  o 0 3.6     6.8   ?     ?   153.524   145.898      79.3212    -34.1016     212.73     -34.1016     
1 1 1 1   15 1  o 0 59.6    8.4   ?     ?   315.339   84.2668      41.9757    84.2668      231.818    -95.7332     
1 1 1 1   15 2  o 0 45.1    8.1   ?     ?   181.251   -15.8022     94.6003    -15.8022     62.5685    164.198      
1 1 1 1   15 3  o 0 214.2   9.9   ?     ?   252.765   18.5738      394.921    18.5738      176.123    18.5738      
1 1 1 1   15 4  o 0 374.4   13.3  ?     ?   436.222   32.528       452.762    32.528       74.5764    32.528       
1 1 1 1   15 5  o 0 57.9    8.7   ?     ?   242.75    59.7697      91.8599    59.7697      118.028    -120.23      
1 1 1 1   15 6  o 0 13.5    8.6   ?     ?   33.3616   -56.2824     1.30819    -56.2824     27.4457    123.718      
1 1 1 1   15 7  o 0 143.6   10.6  ?     ?   277.436   -73.1306     256.398    -73.1306     16.0636    -73.1306     
1 1 1 1   15 8  o 0 110.7   11.2  ?     ?   123.409   -103.475     294.756    -103.475     188.292    -103.475     
1 1 1 1   15 9  o 0 11.8    9.6   ?     ?   99.6474   159.256      3.71345    -20.7441     96.6001    -20.7441     
1 1 1 1   15 10 o 0 405.8   17.7  ?     ?   358.931   137.955      552.443    137.955      219.572    137.955      
1 1 1 1   15 11 o 0 124.1   14.4  ?     ?   288.622   146.835      207.39     146.835      60.7784    -33.1646     
1 1 1 1   15 12 o 0 49.4    14.4  ?     ?   179.477   -178.183     113.352    -178.183     46.8134    1.81716      
1 1 1 1   15 13 o 0 120.6   18.1  ?     ?   139.757   -45.3768     312.479    -45.3768     188.577    -45.3768     
1 1 1 1   15 14 o 0 75.5    16.4  ?     ?   193.399   -64.6475     179.683    -64.6475     12.9792    -64.6475     
1 1 1 1   15 15 o 0 -5.9    16.4  ?     ?   127.29    97.176       17.9069    -82.824      125.384    -82.824      
1 1 1 1   15 16 o 0 71.3    18.8  ?     ?   198.891   118.858      164.155    118.858      2.81543    -61.1424     
1 1 1 1   15 17 < 0 25.2    22.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  17 12 < 1 12.8    10.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  17 11 < 1 19.2    19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -1  17 10 o 0 59.5    17.7  ?     ?   105.007   -43.9829     192.121    -43.9829     106.323    -43.9829     
1 1 1 -1  17 9  o 0 11.8    15.2  ?     ?   123.373   89.6835      25.0318    89.6835      76.3204    -90.3165     
1 1 1 -1  17 8  o 0 173.7   14.6  ?     ?   223.301   -172.85      352.399    -172.85      168.46     -172.85      
1 1 1 -1  17 7  o 0 96.3    13.4  ?     ?   207.954   -65.372      221.004    -65.372      48.9428    -65.372      
1 1 1 -1  17 6  o 0 172.2   14.9  ?     ?   313.915   -122.654     277.425    -122.654     13.2112    -122.654     
1 1 1 -1  17 5  f 1 174.8   14.8  ?     ?   260.039   -137.242     324.746    -137.242     103.981    -137.242     
1 1 1 -1  17 4  f 1 4       12.1  ?     ?   113.121   -147         14.1227    32.9997      110.451    32.9997      
1 1 1 -1  17 3  o 0 104.6   13.1  ?     ?   147.407   79.0425      273.835    79.0425      145.967    79.0425      
1 1 1 -1  17 2  o 0 115.6   13    ?     ?   96.06     62.1054      325.814    62.1054      242.312    62.1054      
1 1 1 -1  17 1  o 0 242.3   15.1  ?     ?   239.884   -86.6862     442.324    -86.6862     233.457    -86.6862     
1 1 1 1   17 0  o 0 276     15.6  ?     ?   230.091   -120.216     496.565    -120.216     295.823    -120.216     
1 1 1 1   17 1  o 0 8.5     12    ?     ?   90.5118   -52.008      3.32102    -52.008      75.558     127.992      
1 1 1 1   17 2  o 0 16.2    12.4  ?     ?   41.3282   6.07044      24.5137    6.07044      11.4468    -173.93      
1 1 1 1   17 3  o 0 71.7    13    ?     ?   188.98    74.952       167.837    74.952       3.73291    74.952       
1 1 1 1   17 4  f 1 22.9    12.6  ?     ?   267.661   0.331937     51.5404    -179.668     279.726    -179.668     
1 1 1 1   17 5  f 1 10.6    12.7  ?     ?   116.725   65.2567      6.25127    65.2567      92.9661    -114.743     
1 1 1 1   17 6  o 0 10.7    12.7  ?     ?   129.26    150.333      0.353597   150.333      108.583    -29.6668     
1 1 1 1   17 7  o 0 212     15.5  ?     ?   336.1     128.245      325.261    128.245      46.7845    128.245      
1 1 1 1   17 8  o 0 30.8    14    ?     ?   180.017   116.7        48.6611    116.7        99.8416    -63.2996     
1 1 1 1   17 9  o 0 16.6    16.2  ?     ?   53.3736   -45.0905     58.1152    -45.0905     14.1999    -45.0905     
1 1 1 1   17 10 o 0 42.5    18.3  ?     ?   163.885   -129.391     95.4234    -129.391     38.7023    50.6093      
1 1 1 1   17 11 < 1 4.4     11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  0  28 o 0 29.1    31.9  ?     ?   71.2412   0            68.8475    0            1.13532    0            
1 1 1 -2  0  27 o 0 -40.3   29.9  ?     ?   67.155    180          16.7075    180          50.0914    2.34036e-15  
1 1 1 -2  0  26 o 0 61.9    23.7  ?     ?   78.2702   180          148.152    180          66.6967    180          
1 1 1 -2  0  25 o 0 32.6    28.4  ?     ?   76.7746   180          59.1426    180          14.6903    2.82491e-14  
1 1 1 -2  0  24 o 0 299.6   20.9  ?     ?   249.098   180          419.224    180          179.309    180          
1 1 1 -2  0  23 o 0 41.4    22.9  ?     ?   12.4335   180          12.2893    180          0.0668167  1.29055e-12  
1 1 1 -2  0  22 o 0 392.4   21    ?     ?   500.199   180          490.533    180          19.8155    1.73698e-13  
1 1 1 -2  0  21 o 0 1329.7  41.6  ?     ?   623.683   180          912.043    180          258.472    180          
1 1 1 -2  0  20 o 0 610     24.7  ?     ?   455.447   180          553.859    180          127.456    180          
1 1 1 -2  0  19 o 0 147.6   16.8  ?     ?   278.922   0            261.996    0            0.963476   0            
1 1 1 -2  0  18 o 0 360     18.2  ?     ?   115.82    0            346.975    0            235.396    0            
1 1 1 -2  0  17 o 0 378.1   18.3  ?     ?   236.998   180          437.864    180          205.036    180          
1 1 1 -2  0  16 f 1 55.2    12.1  ?     ?   51.1513   180          30.3938    180          19.1396    1.11426e-14  
1 1 1 -2  0  15 o 0 62.6    10.5  ?     ?   44.4434   0            32.1547    0            11.5193    180          
1 1 1 -2  0  14 o 0 1707.1  43.8  ?     ?   776.411   0            943.559    0            175.784    0            
1 1 1 -2  0  13 o 0 696.4   19.3  ?     ?   263.085   0            637.609    0            365.386    0            
1 1 1 -2  0  12 o 0 718.4   20.4  ?     ?   593.805   180          651.766    180          33.9934    180          
1 1 1 -2  0  11 o 0 664.7   19.1  ?     ?   512.597   180          644.504    180          96.2439    180          
1 1 1 -2  0  10 o 0 363.7   12.6  ?     ?   506.141   0            478.823    0            60.2999    180          
1 1 1 -2  0  9  o 0 200.3   7.4   ?     ?   362.129   180          326.759    180          30.9974    7.39666e-14  
1 1 1 -2  0  8  o 0 92.9    3.7   ?     ?   134.579   180          134.503    180          1.06592    180          
1 1 1 -2  0  7  o 0 21      3.3   ?     ?   83.9253   180          20.411     180          59.798     2.39503e-15  
1 1 1 -2  0  6  o 0 4125.2  99    ?     ?   1577.16   0            1417.9     0            59.5332    180          
1 1 1 -2  0  5  o 0 3062    73.5  ?     ?   1312.89   0            1224.41    0            7.9859     180          
1 1 1 -2  0  4  o 0 317.2   9     ?     ?   292.072   180          384.016    180          114.805    180          
1 1 1 -2  0  3  o 0 919.4   24    ?     ?   562.27    180          659.23     180          140.803    180          
1 1 1 -2  0  2  o 0 401.6   13    ?     ?   400.196   0            434.748    0            66.3732    0            
1 1 1 2   0  2  o 0 887.9   22.7  ?     ?   177.585   180          646.215    180          481.701    180          
1 1 1 2   0  3  o 0 946.4   24.4  ?     ?   852.165   0            672.091    0            117.442    180          
1 1 1 2   0  4  o 0 5766.5  138   ?     ?   1575.73   180          1656.07    180          197.875    180          
1 1 1 2   0  5  o 0 2753.4  66.3  ?     ?   1392.63   0            1165.18    0            146.632    180          
1 1 1 2   0  6  o 0 809.6   21.2  ?     ?   952.249   0            630.479    0            264.413    180          
1 1 1 2   0  7  o 0 43.2    3.5   ?     ?   187.447   0            85.0141    0            94.6756    180          
1 1 1 2   0  8  o 0 1186.9  30.2  ?     ?   828.271   180          807.694    180          15.9587    3.55127e-13  
1 1 1 2   0  9  o 0 299.1   9.8   ?     ?   404.801   180          403.498    180          2.42699    180          
1 1 1 2   0  10 o 0 10.1    4     ?     ?   49.8449   180          5.58236    180          47.6644    8.21782e-16  
1 1 1 2   0  11 o 0 -6.1    5.2   ?     ?   145.644   0            1.82149    0            154.411    180          
1 1 1 2   0  12 o 0 422.8   13.7  ?     ?   381.788   180          501.275    180          102.895    180          
1 1 1 2   0  13 o 0 5230    125.3 ?     ?   1499.67   180          1753.51    180          197.022    180          
1 1 1 2   0  14 o 0 784.9   24.6  ?     ?   844.504   180          641.779    180          195.94     2.29824e-14  
1 1 1 2   0  15 o 0 22.8    10.6  ?     ?   352.694   0            62.4234    0            285.281    180          
1 1 1 2   0  16 f 1 28.1    12.3  ?     ?   122.003   0            30.1453    0            88.392     180          
1 1 1 2   0  17 o 0 999     34.3  ?     ?   689.095   0            728.754    0            49.4563    0            
1 1 1 2   0  18 o 0 371.3   20.9  ?     ?   375.013   0            440.002    0            77.4352    0            
1 1 1 2   0  19 o 0 563.6   24.2  ?     ?   436.704   0            538.858    0            128.654    0            
1 1 1 2   0  20 o 0 0.9     20.2  ?     ?   44.0822   0            4.8677     0            36.5615    180          
1 1 1 2   0  21 o 0 -10.1   16.3  ?     ?   147.109   180          12.6015    180          142.17     6.21938e-16  
1 1 1 2   0  22 o 0 28.5    23.3  ?     ?   152.443   0            69.5686    0            86.6088    180          
1 1 1 2   0  23 o 0 46.9    18.9  ?     ?   85.4573   0            95.46      0            10.1712    0            
1 1 1 2   0  24 o 0 -0.1    28.8  ?     ?   90.0976   180          29.8857    180          57.2765    3.66117e-15  
1 1 1 2   0  25 o 0 191.5   23.8  ?     ?   429.256   180          330.361    180          84.3541    2.74799e-14  
1 1 1 2   0  26 o 0 31.2    39    ?     ?   58.2126   180          59.0648    180          1.80689    2.29368e-13  
1 1 1 2   0  27 o 0 0.2     32.4  ?     ?   165.713   0            61.5916    0            104.063    180          
1 1 1 -2  2  29 < 0 7.7     24.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  2  28 o 0 17.5    18.7  ?     ?   120.796   87.9946      49.9061    87.9946      64.0042    -92.0054     
1 1 1 -2  2  27 o 0 122.3   19    ?     ?   215.77    110.95       299.046    110.95       90.4772    110.95       
1 1 1 -2  2  26 o 0 92.6    24.6  ?     ?   222.908   99.2075      204.012    99.2075      26.2963    -80.7925     
1 1 1 -2  2  25 o 0 -6.2    17.2  ?     ?   102.57    -92.5517     29.1677    87.4483      131.872    87.4483      
1 1 1 -2  2  24 o 0 177.7   14.7  ?     ?   206.879   -95.1142     406.489    -95.1142     208.538    -95.1142     
1 1 1 -2  2  23 f 1 150.8   14    ?     ?   239.767   91.6217      332.381    91.6217      100.291    91.6217      
1 1 1 -2  2  22 o 0 183.8   13.7  ?     ?   417.741   48.0923      218.395    48.0923      205.328    -131.908     
1 1 1 -2  2  21 o 0 482     15.5  ?     ?   395.826   -48.1967     646.438    -48.1967     233.926    -48.1967     
1 1 1 -2  2  20 f 1 148.3   11.6  ?     ?   353.749   -109.198     166.445    -109.198     164.736    70.8016      
1 1 1 -2  2  19 o 0 82.2    11.3  ?     ?   160.571   -63.9479     108.618    -63.9479     40.9367    116.052      
1 1 1 -2  2  18 o 0 80.8    11.4  ?     ?   154.141   169.088      84.0516    169.088      63.7912    -10.9121     
1 1 1 -2  2  17 o 0 27.4    11.2  ?     ?   163.361   20.7729      67.2368    -159.227     225.169    -159.227     
1 1 1 -2  2  16 o 0 547.1   14.9  ?     ?   540.85    134.156      489.477    134.156      29.7165    -45.8441     
1 1 1 -2  2  15 o 0 32.5    7.3   ?     ?   156.477   77.3229      43.8602    -102.677     197.144    -102.677     
1 1 1 -2  2  14 f 1 1056.3  21.7  ?     ?   786.639   32.056       673.493    32.056       106.295    -147.944     
1 1 1 -2  2  13 o 0 835.6   19.9  ?     ?   643.739   24.7009      696.001    24.7009      31.3555    24.7009      
1 1 1 -2  2  12 o 0 307.4   7.9   ?     ?   547.339   -156.712     241.268    -156.712     327.23     23.2879      
1 1 1 -2  2  11 o 0 2024.5  41.4  ?     ?   1300.99   156.332      820.405    156.332      538.446    -23.6679     
1 1 1 -2  2  10 o 0 -1.2    2.4   ?     ?   66.1378   -69.9567     68.1697    110.043      138.59     110.043      
1 1 1 -2  2  9  o 0 708.8   13.8  ?     ?   691.07    -30.7977     569.28     -30.7977     170.11     149.202      
1 1 1 -2  2  8  o 0 1043.7  18.8  ?     ?   739.4     -86.3186     748.474    -86.3186     14.4585    -86.3186     
1 1 1 -2  2  6  f 1 6144.5  101.8 ?     ?   1759.1    121.988      1839.38    121.988      139.418    121.988      
1 1 1 -2  2  5  o 0 5957.2  99.3  ?     ?   1742.26   52.1744      1775.46    52.1744      132.356    52.1744      
1 1 1 -2  2  4  o 0 1088    19.4  ?     ?   707.388   48.3357      772.498    48.3357      103.42     48.3357      
1 1 1 -2  2  3  o 0 561.9   10.4  ?     ?   472.43    -131.372     555.57     -131.372     116.431    -131.372     
1 1 1 -2  2  2  o 0 239.7   4.7   ?     ?   679.426   122.744      16.2459    122.744      615.838    -57.2557     
1 1 1 -2  2  1  o 0 1517    26.4  ?     ?   847.596   -175.069     894.85     -175.069     107.381    -175.069     
1 1 1 2   2  0  o 0 1322.1  22.8  ?     ?   845.602   8.98162      775.504    8.98162      2.3251     -171.018     
1 1 1 2   2  1  o 0 688.2   12.4  ?     ?   742.729   29.1174      429.689    29.1174      257.36     -150.883     
1 1 1 2   2  2  o 0 1886.7  32.5  ?     ?   1057.58   61.9943      900.356    61.9943      81.2793    -118.006     
1 1 1 2   2  3  o 0 420.6   8     ?     ?   614.768   -175.749     293.374    -175.749     277.659    4.25098      
1 1 1 2   2  4  o 0 2240.1  38.8  ?     ?   1201.52   -54.3212     957.489    -54.3212     179.33     125.679      
1 1 1 2   2  5  o 0 1129    20.1  ?     ?   507.08    140.532      975.493    140.532      496.791    140.532      
1 1 1 2   2  6  f 1 5912.3  98.5  ?     ?   1807.29   47.6496      1727.99    47.6496      21.0798    -132.35      
1 1 1 2   2  7  o 0 212.8   5.6   ?     ?   487.048   98.6773      153.504    98.6773      332.859    -81.3227     
1 1 1 2   2  8  o 0 937.8   17.1  ?     ?   629.116   153.162      775.393    153.162      149.591    153.162      
1 1 1 2   2  9  o 0 1139    24    ?     ?   748.783   -163.279     871.517    -163.279     68.5893    -163.279     
1 1 1 2   2  10 o 0 24.5    3.2   ?     ?   147.212   57.2924      67.2903    -122.708     224.413    -122.708     
1 1 1 2   2  11 o 0 1259.1  25    ?     ?   728.864   -175.887     942.81     -175.887     179.575    -175.887     
1 1 1 2   2  12 o 0 1128.2  21.1  ?     ?   885.794   150.032      687.746    150.032      234.795    -29.9676     
1 1 1 2   2  13 o 0 2508.5  56.9  ?     ?   931.836   8.6321       1435.09    8.6321       470.227    8.6321       
1 1 1 2   2  14 f 1 264.3   9.4   ?     ?   602.959   53.6113      106.777    53.6113      492.735    -126.389     
1 1 1 2   2  15 o 0 815.3   18.3  ?     ?   590.129   5.81792      679.385    5.81792      99.4696    5.81792      
1 1 1 2   2  16 o 0 403.7   13.3  ?     ?   353.835   -103.532     498.77     -103.532     157.977    -103.532     
1 1 1 2   2  17 o 0 1060    24.6  ?     ?   793.701   152.715      696.955    152.715      73.0247    -27.2855     
1 1 1 2   2  18 o 0 318.1   13.3  ?     ?   204.02    -19.1689     494.067    -19.1689     297.676    -19.1689     
1 1 1 2   2  19 o 0 663.8   19.7  ?     ?   474.796   -75.901      678.302    -75.901      234.414    -75.901      
1 1 1 2   2  20 f 1 114.9   12.3  ?     ?   91.3083   32.9461      190.202    32.9461      104.383    32.9461      
1 1 1 2   2  21 o 0 44.5    11.7  ?     ?   301.483   -46.3814     32.631     133.619      348.109    133.619      
1 1 1 2   2  22 o 0 31.9    12.3  ?     ?   149.646   -48.6702     34.5744    -48.6702     117.861    131.33       
1 1 1 2   2  23 f 1 69.7    16.7  ?     ?   93.1587   123.796      215.634    123.796      125.059    123.796      
1 1 1 2   2  24 o 0 20.7    16.6  ?     ?   110.98    112.934      28.9525    112.934      77.7271    -67.0657     
1 1 1 2   2  25 o 0 100.7   17.7  ?     ?   273.796   7.71174      196.039    7.71174      79.4281    -172.288     
1 1 1 2   2  26 o 0 50.9    22.3  ?     ?   184.032   -16.5611     106.671    -16.5611     84.4171    163.439      
1 1 1 2   2  27 o 0 -11.8   23.7  ?     ?   124.208   49.4272      5.01979    -130.573     125.703    -130.573     
1 1 1 2   2  28 o 0 75      22.9  ?     ?   267.113   50.2565      124.138    50.2565      129.669    -129.743     
1 1 1 -2  4  28 < 0 -1.7    22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  4  27 o 0 37.3    19.5  ?     ?   198.745   42.7264      58.2939    42.7264      128.339    -137.274     
1 1 1 -2  4  26 o 0 30      17.4  ?     ?   112.968   78.2518      86.877     78.2518      24.1774    -101.748     
1 1 1 -2  4  25 o 0 -12.2   25.4  ?     ?   110.12    -172.76      6.80491    7.23999      119.254    7.23999      
1 1 1 -2  4  24 o 0 -3.7    17    ?     ?   29.1495   172.511      3.64586    -7.48874     31.3667    -7.48874     
1 1 1 -2  4  23 o 0 376     18.2  ?     ?   369.087   -151.229     559.51     -151.229     209.203    -151.229     
1 1 1 -2  4  22 o 0 31.7    14.3  ?     ?   84.4797   174.32       59.7066    174.32       23.3603    -5.67969     
1 1 1 -2  4  21 f 1 27.4    14    ?     ?   129.732   30.5973      20.3951    30.5973      111.281    -149.403     
1 1 1 -2  4  20 o 0 84.4    10.9  ?     ?   231.112   47.2102      152.299    47.2102      87.466     -132.79      
1 1 1 -2  4  19 o 0 378.4   13.3  ?     ?   441.213   130.979      419.867    130.979      10.8027    130.979      
1 1 1 -2  4  18 o 0 38.8    11.3  ?     ?   309.419   80.4919      84.5941    -99.5081     371.44     -99.5081     
1 1 1 -2  4  17 o 0 295.8   12.3  ?     ?   539.31    -62.5459     219.878    -62.5459     294.946    117.454      
1 1 1 -2  4  16 f 1 891.5   20.8  ?     ?   728.224   -64.8567     625.219    -64.8567     79.0153    115.143      
1 1 1 -2  4  15 o 0 21      8     ?     ?   204.516   -149.417     111.531    30.5831      306.896    30.5831      
1 1 1 -2  4  14 o 0 420.7   12.4  ?     ?   468.985   166.364      419.729    166.364      37.3966    -13.6359     
1 1 1 -2  4  13 f 1 854.1   17    ?     ?   714.385   -166.471     590.056    -166.471     114.515    13.5294      
1 1 1 -2  4  12 o 0 1042.5  19.9  ?     ?   732.87    4.92582      757.498    4.92582      4.34073    -175.074     
1 1 1 -2  4  11 o 0 1401.6  29    ?     ?   758.643   -102.279     995.126    -102.279     211.341    -102.279     
1 1 1 -2  4  10 o 0 280.7   7.2   ?     ?   193.173   -119.559     484.875    -119.559     284.216    -119.559     
1 1 1 -2  4  9  o 0 405.3   9.7   ?     ?   437.371   -120.106     484.27     -120.106     17.1997    -120.106     
1 1 1 -2  4  8  o 0 845.9   17.8  ?     ?   595.693   119.466      784.989    119.466      151.489    119.466      
1 1 1 -2  4  7  o 0 1952.1  34.4  ?     ?   984.807   134.752      1148.69    134.752      97.1829    134.752      
1 1 1 -2  4  6  f 1 1035.1  18.5  ?     ?   727.578   84.6445      747.602    84.6445      23.8524    84.6445      
1 1 1 -2  4  5  f 1 143.5   3.4   ?     ?   299.226   118.891      181.872    118.891      116.602    -61.1085     
1 1 1 -2  4  4  o 0 333.9   6.7   ?     ?   353.938   20.6741      440.063    20.6741      88.1332    20.6741      
1 1 1 -2  4  3  o 0 464.8   8.8   ?     ?   518.147   21.5183      435.154    21.5183      60.4008    -158.482     
1 1 1 -2  4  2  o 0 1320.3  23.4  ?     ?   679.171   103.487      957.868    103.487      308.327    103.487      
1 1 1 2   4  0  o 0 867.9   17.4  ?     ?   855.465   63.8502      482.899    63.8502      330.52     -116.15      
1 1 1 2   4  2  o 0 460.3   8.8   ?     ?   497.462   -52.833      447.686    -52.833      27.3006    127.167      
1 1 1 2   4  3  o 0 704     13    ?     ?   666.6     -18.8856     526.628    -18.8856     110.299    161.114      
1 1 1 2   4  4  o 0 1318.9  23.4  ?     ?   828.895   92.6327      851.761    92.6327      27.8359    92.6327      
1 1 1 2   4  5  f 1 908.7   16.9  ?     ?   589.037   116.959      785.855    116.959      198.161    116.959      
1 1 1 2   4  6  f 1 461.8   9.8   ?     ?   753.317   -124.654     224.489    -124.654     525.403    55.3463      
1 1 1 2   4  7  o 0 1212.7  22.4  ?     ?   641.27    -144.892     1032.61    -144.892     347.134    -144.892     
1 1 1 2   4  8  o 0 150.1   4.1   ?     ?   294.087   -37.9767     214        -37.9767     99.2159    142.023      
1 1 1 2   4  9  o 0 70.4    3.3   ?     ?   231.914   16.5645      52.5799    16.5645      195.525    -163.435     
1 1 1 2   4  10 o 0 195.6   6     ?     ?   497.277   -70.6397     116.469    -70.6397     401.139    109.36       
1 1 1 2   4  11 o 0 702.2   14.6  ?     ?   649.311   -114.656     576.054    -114.656     96.3172    65.3438      
1 1 1 2   4  12 o 0 2950.4  51.6  ?     ?   1351.35   -171.632     1189.49    -171.632     218.815    8.36782      
1 1 1 2   4  13 f 1 164.3   7.9   ?     ?   138.734   119.331      257.644    119.331      120.443    119.331      
1 1 1 2   4  14 o 0 75.2    7.8   ?     ?   424.236   -143.18      78.5471    36.8205      493.266    36.8205      
1 1 1 2   4  15 o 0 270.7   12    ?     ?   362.531   -114.393     325.564    -114.393     21.8263    65.6068      
1 1 1 2   4  16 f 1 821.2   21.4  ?     ?   490.835   -175.422     787.081    -175.422     310.848    -175.422     
1 1 1 2   4  17 o 0 26.3    10.8  ?     ?   288.435   82.1162      143.488    -97.8838     419.786    -97.8838     
1 1 1 2   4  18 o 0 88.6    13    ?     ?   351.517   39.2055      33.9927    39.2055      293.073    -140.794     
1 1 1 2   4  19 o 0 25.2    10.4  ?     ?   89.9497   -36.4595     17.7029    143.541      101.419    143.541      
1 1 1 2   4  20 o 0 137.4   12.8  ?     ?   59.1657   31.5054      254.747    31.5054      193.119    31.5054      
1 1 1 2   4  21 f 1 514     19    ?     ?   543.037   123.55       544.18     123.55       9.3137     -56.4501     
1 1 1 2   4  22 o 0 556.3   21.7  ?     ?   561.58    136.717      579.546    136.717      24.9376    136.717      
1 1 1 2   4  23 o 0 214.5   17.1  ?     ?   348.893   91.5176      349.617    91.5176      16.9635    91.5176      
1 1 1 2   4  24 o 0 32.6    18    ?     ?   120.335   162.909      78.3577    162.909      36.6241    -17.0914     
1 1 1 2   4  25 o 0 116.4   21.5  ?     ?   263.734   157.024      230.009    157.024      40.6361    -22.976      
1 1 1 2   4  26 o 0 58      20.7  ?     ?   77.3727   70.3971      197.37     70.3971      120.917    70.3971      
1 1 1 2   4  27 o 0 29.5    22.1  ?     ?   83.4223   58.6091      103.595    58.6091      24.8379    58.6091      
1 1 1 2   4  28 < 0 32.8    28.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  6  27 o 0 20.9    27.5  ?     ?   82.741    46.24        94.6136    46.24        18.6022    46.24        
1 1 1 -2  6  26 o 0 -34.4   24.4  ?     ?   67.5814   -77.1659     1.26251    -77.1659     61.4242    102.834      
1 1 1 -2  6  25 o 0 199     25.7  ?     ?   132.796   24.3707      498.303    24.3707      369.361    24.3707      
1 1 1 -2  6  24 o 0 48.5    19    ?     ?   140.737   170.763      131.097    170.763      10.8387    -9.23729     
1 1 1 -2  6  23 o 0 329.6   21.3  ?     ?   487.604   -153.086     377.59     -153.086     80.3323    26.9143      
1 1 1 -2  6  22 o 0 371.2   16.9  ?     ?   490.011   -129.662     437.343    -129.662     23.6169    50.3379      
1 1 1 -2  6  21 o 0 126.6   13.1  ?     ?   314.491   -111.701     205.302    -111.701     100.004    68.2991      
1 1 1 -2  6  20 o 0 72      13.9  ?     ?   337.15    -31.2649     41.0307    -31.2649     295.057    148.735      
1 1 1 -2  6  19 o 0 256.3   13.7  ?     ?   552.638   -17.0396     192.844    -17.0396     373.05     162.96       
1 1 1 -2  6  18 o 0 246.6   13.2  ?     ?   387.742   -40.9672     293.154    -40.9672     61.6157    139.033      
1 1 1 -2  6  17 o 0 583.2   19.6  ?     ?   394.803   -54.7362     656.438    -54.7362     295.309    -54.7362     
1 1 1 -2  6  16 o 0 96.8    10.3  ?     ?   481.651   167.753      48.5508    -12.2466     492.673    -12.2466     
1 1 1 -2  6  15 o 0 89.6    8.5   ?     ?   314.367   112.95       46.016     112.95       252.287    -67.0501     
1 1 1 -2  6  14 o 0 893.5   26.2  ?     ?   576.811   8.00305      755.269    8.00305      197.31     8.00305      
1 1 1 -2  6  13 o 0 309     10.9  ?     ?   425.447   57.6725      322.731    57.6725      80.7132    -122.327     
1 1 1 -2  6  12 o 0 1029.4  20.5  ?     ?   776.419   49.3019      654.943    49.3019      95.7576    -130.698     
1 1 1 -2  6  11 o 0 1176.2  27.9  ?     ?   637.318   126.307      887.174    126.307      267.357    126.307      
1 1 1 -2  6  10 o 0 2954.7  58.9  ?     ?   1238.92   147.752      1225.96    147.752      14.5847    147.752      
1 1 1 -2  6  9  o 0 384.3   11.5  ?     ?   649.711   -102.187     238.434    -102.187     425.628    77.8135      
1 1 1 -2  6  8  o 0 1182.2  21.2  ?     ?   922.143   74.3765      679.685    74.3765      266.897    -105.623     
1 1 1 -2  6  7  o 0 26.5    2.4   ?     ?   340.706   -20.1556     181.8      159.844      532.842    159.844      
1 1 1 -2  6  6  o 0 635.6   12.5  ?     ?   505.128   168.832      651.559    168.832      129.488    168.832      
1 1 1 -2  6  5  o 0 158.3   5.5   ?     ?   50.1548   64.0519      145.358    64.0519      92.6604    64.0519      
1 1 1 -2  6  4  o 0 665.5   12.7  ?     ?   295.436   117.905      887.805    117.905      576.849    117.905      
1 1 1 -2  6  2  o 0 687.5   12.9  ?     ?   588.054   -75.1353     643.202    -75.1353     23.4411    -75.1353     
1 1 1 -2  6  1  o 0 97.5    2.7   ?     ?   263.441   59.2866      110.552    59.2866      166.993    -120.713     
1 1 1 2   6  1  o 0 156     3.9   ?     ?   286.066   -54.1478     229.198    -54.1478     71.8533    125.852      
1 1 1 2   6  2  o 0 376.5   7.5   ?     ?   466.93    -104.814     420.632    -104.814     71.1102    75.1858      
1 1 1 2   6  3  o 0 327     6.8   ?     ?   338.908   -71.5778     469.232    -71.5778     112.289    -71.5778     
1 1 1 2   6  4  o 0 325.7   6.7   ?     ?   354.905   73.6593      453.734    73.6593      80.1771    73.6593      
1 1 1 2   6  5  o 0 837.6   15.6  ?     ?   621.119   -27.1067     743.847    -27.1067     90.9753    -27.1067     
1 1 1 2   6  6  o 0 1099.8  23.3  ?     ?   711.587   4.56286      836.103    4.56286      100.092    4.56286      
1 1 1 2   6  7  o 0 110.1   4.1   ?     ?   138.79    155.016      168.925    155.016      25.7676    155.016      
1 1 1 2   6  8  o 0 2630.2  46.3  ?     ?   1175.51   -89.6363     1237.3     -89.6363     28.9295    -89.6363     
1 1 1 2   6  9  o 0 1531.1  27.5  ?     ?   857.145   -145.389     969.802    -145.389     92.2303    -145.389     
1 1 1 2   6  10 o 0 1463.8  27.4  ?     ?   883.948   130.854      841.244    130.854      24.7626    -49.1459     
1 1 1 2   6  11 o 0 1044.9  24.3  ?     ?   625.973   130.709      810.895    130.709      200.75     130.709      
1 1 1 2   6  12 o 0 527.1   13    ?     ?   336.032   -118.932     636.964    -118.932     311.258    -118.932     
1 1 1 2   6  13 o 0 724.1   18.2  ?     ?   508.765   -28.466      669.37     -28.466      185.611    -28.466      
1 1 1 2   6  14 o 0 664.3   21.3  ?     ?   520.164   69.2357      621.032    69.2357      116.397    69.2357      
1 1 1 2   6  15 o 0 237.3   10.8  ?     ?   150.683   -140.101     374.681    -140.101     231.249    -140.101     
1 1 1 2   6  16 o 0 44.8    11.8  ?     ?   168.191   148.19       4.88856    148.19       150.716    -31.8102     
1 1 1 2   6  17 o 0 121.1   11.5  ?     ?   356.6     59.9088      101.885    59.9088      225.455    -120.091     
1 1 1 2   6  18 o 0 132.7   15.6  ?     ?   348.569   -35.7502     139.437    -35.7502     180.682    144.25       
1 1 1 2   6  19 o 0 245     13.1  ?     ?   333.891   152.917      384.788    152.917      41.5453    152.917      
1 1 1 2   6  20 o 0 99.4    12.5  ?     ?   311.286   -137.417     137.95     -137.417     173.634    42.5829      
1 1 1 2   6  21 o 0 179.9   17.9  ?     ?   411.436   -176.267     221.092    -176.267     180.052    3.73313      
1 1 1 2   6  22 o 0 8.9     21.5  ?     ?   217.882   -166.658     52.5171    13.3417      258.406    13.3417      
1 1 1 2   6  23 o 0 61.8    21.3  ?     ?   156.033   178.403      159.392    178.403      12.1677    178.403      
1 1 1 2   6  24 o 0 15.9    20.1  ?     ?   88.5625   168.972      38.0883    168.972      51.6661    -11.028      
1 1 1 2   6  25 o 0 112.8   24.8  ?     ?   89.2332   -7.24203     349.659    -7.24203     262.574    -7.24203     
1 1 1 2   6  26 o 0 62.4    26.5  ?     ?   169.682   -86.1758     151.653    -86.1758     6.57473    93.8242      
1 1 1 2   6  27 o 0 -1.9    26.3  ?     ?   70.5441   -161.685     53.4617    -161.685     11.702     18.3147      
1 1 1 -2  8  26 < 0 35.7    21.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  8  25 o 0 34.6    19.1  ?     ?   154.138   25.109       81.2527    25.109       58.8089    -154.891     
1 1 1 -2  8  24 o 0 85.1    22.2  ?     ?   119.775   117.958      261.886    117.958      150.346    117.958      
1 1 1 -2  8  23 o 0 77      18.8  ?     ?   178.69    -12.6793     200.266    -12.6793     22.4474    -12.6793     
1 1 1 -2  8  22 o 0 51.7    16.9  ?     ?   156.262   -79.2322     136.035    -79.2322     19.955     100.768      
1 1 1 -2  8  21 o 0 95.4    15    ?     ?   124.649   92.4075      272.989    92.4075      158.188    92.4075      
1 1 1 -2  8  20 o 0 50.9    13.9  ?     ?   128.834   67.8352      144.764    67.8352      25.3851    67.8352      
1 1 1 -2  8  19 o 0 24      12.5  ?     ?   35.8282   -153.951     18.1997    -153.951     16.1688    26.0488      
1 1 1 -2  8  18 o 0 -4.8    9.7   ?     ?   133.923   -127.838     95.3082    52.162       227.139    52.162       
1 1 1 -2  8  17 o 0 283.2   11.7  ?     ?   400.367   -27.3345     375.036    -27.3345     29.538     152.666      
1 1 1 -2  8  16 o 0 339.8   12.8  ?     ?   437.168   106.194      367.672    106.194      26.782     -73.8062     
1 1 1 -2  8  15 o 0 523.1   15.1  ?     ?   580.168   25.3252      443.111    25.3252      84.4217    -154.675     
1 1 1 -2  8  14 o 0 756     18.4  ?     ?   532.235   -56.8698     687.589    -56.8698     204.346    -56.8698     
1 1 1 -2  8  13 o 0 805.4   18.7  ?     ?   655.31    -89.0656     609.197    -89.0656     2.59362    90.9344      
1 1 1 -2  8  12 o 0 237.7   10.3  ?     ?   164.083   162.025      374.151    162.025      219.994    162.025      
1 1 1 -2  8  11 o 0 462.1   14.4  ?     ?   360.485   74.6089      538.693    74.6089      202.971    74.6089      
1 1 1 -2  8  10 o 0 443.2   12.5  ?     ?   512.233   -77.692      399.287    -77.692      80.3023    102.308      
1 1 1 -2  8  9  o 0 241.1   8.4   ?     ?   320.723   25.0286      309.019    25.0286      7.29354    25.0286      
1 1 1 -2  8  8  o 0 459.2   11.4  ?     ?   320.672   94.2005      572.689    94.2005      265.732    94.2005      
1 1 1 -2  8  7  o 0 302.2   9     ?     ?   416.293   174.396      319.208    174.396      80.7475    -5.60371     
1 1 1 -2  8  6  o 0 719.7   16.1  ?     ?   568.409   114.082      608.972    114.082      61.1791    114.082      
1 1 1 -2  8  5  o 0 491     12.3  ?     ?   402.397   99.5465      575.014    99.5465      165.705    99.5465      
1 1 1 -2  8  4  f 1 418     9.9   ?     ?   266.745   6.33573      607.909    6.33573      337.929    6.33573      
1 1 1 -2  8  3  o 0 337.9   7.9   ?     ?   544.69    163.985      276.789    163.985      272.401    -16.015      
1 1 1 -2  8  2  f 1 38.8    2.8   ?     ?   415.062   -56.4694     186.833    123.531      607.78     123.531      
1 1 1 -2  8  1  o 0 301.1   7.6   ?     ?   507.532   -122.392     262.775    -122.392     249.414    57.6076      
1 1 1 2   8  0  f 1 78.8    3     ?     ?   260.662   -71.2795     57.5       -71.2795     206.676    108.721      
1 1 1 2   8  1  o 0 961.3   20.6  ?     ?   841.403   5.55848      587.743    5.55848      261.116    -174.442     
1 1 1 2   8  2  f 1 1175.8  23.3  ?     ?   807.679   117.714      771.661    117.714      47.4263    -62.2861     
1 1 1 2   8  3  o 0 22      2.5   ?     ?   57.6713   133.674      25.9362    -46.3257     84.0964    -46.3257     
1 1 1 2   8  4  f 1 434.9   10.7  ?     ?   379.565   103.285      539.541    103.285      155.184    103.285      
1 1 1 2   8  5  o 0 213.4   7     ?     ?   254.674   -169.4       331.93     -169.4       72.6822    -169.4       
1 1 1 2   8  6  o 0 80.3    4     ?     ?   297.319   -65.5272     30.6048    -65.5273     256.231    114.473      
1 1 1 2   8  7  o 0 463.2   10.8  ?     ?   586.068   149.455      356.143    149.455      207.67     -30.5446     
1 1 1 2   8  8  o 0 645     15.2  ?     ?   583.455   71.7843      528.967    71.7843      30.4217    -108.216     
1 1 1 2   8  9  o 0 823.1   19.4  ?     ?   580.852   19.2043      679.75     19.2043      132.295    19.2043      
1 1 1 2   8  10 o 0 944.1   20.2  ?     ?   625.363   -121.182     727.153    -121.182     140.415    -121.182     
1 1 1 2   8  11 o 0 2424.5  44.9  ?     ?   1077.33   -151.859     1124.77    -151.859     119.097    -151.859     
1 1 1 2   8  12 o 0 572     14.8  ?     ?   350.252   -124.832     671.825    -124.832     341.915    -124.832     
1 1 1 2   8  13 o 0 25.5    8.2   ?     ?   95.9323   57.03        37.0098    -122.97      126.822    -122.97      
1 1 1 2   8  14 o 0 27.9    9.2   ?     ?   11.8857   49.4736      2.54143    -130.526     13.3656    -130.526     
1 1 1 2   8  15 o 0 120.6   12.3  ?     ?   266.785   122.279      174.726    122.279      68.6403    -57.7212     
1 1 1 2   8  16 o 0 110.6   13.6  ?     ?   274.348   148.72       147.333    148.72       101.062    -31.28       
1 1 1 2   8  17 o 0 97.3    10.9  ?     ?   108.759   53.0797      223.685    53.0797      113.383    53.0797      
1 1 1 2   8  18 o 0 58.5    13.8  ?     ?   188.569   -74.2965     118.625    -74.2965     67.714     105.703      
1 1 1 2   8  19 o 0 17.5    11.6  ?     ?   28.7479   -178.177     4.68021    -178.177     23.0082    1.82324      
1 1 1 2   8  20 o 0 95.3    14.4  ?     ?   276.152   83.2791      172.156    83.2791      84.8168    -96.7209     
1 1 1 2   8  21 o 0 124.5   15    ?     ?   189.289   79.865       303.273    79.865       128.162    79.865       
1 1 1 2   8  22 o 0 35.6    18.5  ?     ?   82.6363   170.505      102.73     170.505      19.8532    170.505      
1 1 1 2   8  23 o 0 142     21.5  ?     ?   352.753   159.653      193.778    159.653      158.958    -20.3469     
1 1 1 2   8  24 o 0 84.6    24.6  ?     ?   203.739   83.0901      196.817    83.09        6.12642    83.09        
1 1 1 2   8  25 o 0 50.8    25.1  ?     ?   189.085   18.816       101.171    18.816       71.5513    -161.184     
1 1 1 2   8  26 < 0 43.9    26.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  10 24 < 0 182.8   25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  10 23 o 0 151.2   24.8  ?     ?   195.928   -41.8785     349        -41.8785     174.09     -41.8785     
1 1 1 -2  10 22 f 1 294.6   20.9  ?     ?   252.689   173.277      529.689    173.277      292.507    173.277      
1 1 1 -2  10 21 o 0 36.6    18.9  ?     ?   73.6792   74.273       108.557    74.273       36.6104    74.273       
1 1 1 -2  10 20 o 0 13.5    14.3  ?     ?   119.192   50.8515      6.1497     50.8515      110.534    -129.149     
1 1 1 -2  10 19 o 0 53.2    13.1  ?     ?   90.8695   -65.491      164.323    -65.491      81.5867    -65.491      
1 1 1 -2  10 18 o 0 46      12.3  ?     ?   153.328   -159.837     116.626    -159.837     23.0368    20.1628      
1 1 1 -2  10 17 o 0 19.7    11.8  ?     ?   100.32    -146.274     20.2688    -146.274     71.5634    33.7262      
1 1 1 -2  10 16 o 0 167.8   12.1  ?     ?   301.492   92.5195      292.052    92.5195      6.6777     92.5195      
1 1 1 -2  10 15 o 0 101.2   10.7  ?     ?   190.345   -65.207      233.151    -65.207      48.4855    -65.207      
1 1 1 -2  10 14 o 0 18.5    8.6   ?     ?   120.871   -144.099     35.0242    35.9006      155.251    35.9006      
1 1 1 -2  10 13 o 0 231.7   10.9  ?     ?   80.0956   -86.414      352.415    -86.414      281.371    -86.414      
1 1 1 -2  10 12 o 0 69.5    7.6   ?     ?   203.165   87.9762      89.2755    87.9762      92.0836    -92.0238     
1 1 1 -2  10 11 o 0 1750.8  32.6  ?     ?   785.015   7.66517      1077.95    7.66517      379.19     7.66517      
1 1 1 -2  10 10 f 1 1591.9  30.7  ?     ?   838.544   -27.0951     949.95     -27.0951     195.665    -27.0951     
1 1 1 -2  10 9  o 0 238.4   8.5   ?     ?   59.4523   130.382      226.793    130.382      172.193    130.382      
1 1 1 -2  10 8  o 0 186.2   6.9   ?     ?   349.41    -171.625     207.544    -171.625     114.739    8.37474      
1 1 1 -2  10 7  o 0 373.1   10.3  ?     ?   472.515   -28.2876     362.262    -28.2876     75.2185    151.712      
1 1 1 -2  10 6  o 0 650.6   14.9  ?     ?   445.738   27.211       652.924    27.211       233.886    27.211       
1 1 1 -2  10 5  o 0 411.8   9.7   ?     ?   855.975   12.0844      60.8548    12.0844      724.818    -167.916     
1 1 1 -2  10 4  o 0 304.9   9.9   ?     ?   472.245   -20.3312     270.386    -20.3312     164.007    159.669      
1 1 1 -2  10 3  o 0 198.4   6.9   ?     ?   242.317   173.695      285.108    173.695      61.8517    173.695      
1 1 1 -2  10 2  o 0 1067.1  36.1  ?     ?   818.15    107.624      628.498    107.624      126.13     -72.3756     
1 1 1 -2  10 1  o 0 667.1   18.5  ?     ?   553.787   76.1575      564.994    76.1575      53.8921    76.1575      
1 1 1 2   10 0  o 0 34      4.1   ?     ?   337.51    -14.0199     136.965    165.98       448.528    165.98       
1 1 1 2   10 1  o 0 482.6   10.9  ?     ?   778.359   136.252      202.72     136.252      515.849    -43.7483     
1 1 1 2   10 2  o 0 875.1   18.1  ?     ?   615.426   161.305      674.419    161.305      106.492    161.305      
1 1 1 2   10 3  o 0 458.4   10.3  ?     ?   289.019   143.853      579.428    143.853      312.952    143.853      
1 1 1 2   10 4  o 0 1271.5  24.7  ?     ?   983.33    28.9714      609.312    28.9714      296.055    -151.029     
1 1 1 2   10 5  o 0 979.8   19.1  ?     ?   643.447   34.7303      721.353    34.7303      130.06     34.7303      
1 1 1 2   10 6  o 0 216.7   7     ?     ?   303.165   -63.4226     285.148    -63.4226     0.258358   116.577      
1 1 1 2   10 7  o 0 726.6   18    ?     ?   364.391   143.529      784.635    143.529      446.709    143.529      
1 1 1 2   10 8  o 0 520     16.1  ?     ?   509.577   -139.885     483.538    -139.885     12.6443    -139.885     
1 1 1 2   10 9  o 0 73.8    7.8   ?     ?   162.399   148.729      64.4541    148.729      85.0047    -31.2713     
1 1 1 2   10 10 f 1 1482    29.3  ?     ?   818.145   31.7038      909.177    31.7038      171.534    31.7038      
1 1 1 2   10 11 o 0 14      6.7   ?     ?   99.3157   112.346      56.6272    -67.6544     145.256    -67.6544     
1 1 1 2   10 12 o 0 185.3   9.8   ?     ?   380.639   176.178      202.842    176.178      137.88     -3.8224      
1 1 1 2   10 13 o 0 48.3    8.4   ?     ?   146.271   -42.9195     43.5965    -42.9195     86.5316    137.08       
1 1 1 2   10 14 o 0 223.1   12    ?     ?   426.171   -170.266     256.049    -170.266     169.2      9.73389      
1 1 1 2   10 15 o 0 886.2   21.5  ?     ?   496.464   168.151      905.018    168.151      421.733    168.151      
1 1 1 2   10 16 o 0 -4.9    14.1  ?     ?   176.127   50.3339      92.6617    -129.666     259.974    -129.666     
1 1 1 2   10 17 o 0 198.8   15.9  ?     ?   475.141   87.4786      202.289    87.4786      234.306    -92.5214     
1 1 1 2   10 18 o 0 -2.3    15    ?     ?   45.7905   102.602      12.0695    -77.3976     53.9462    -77.3976     
1 1 1 2   10 19 o 0 31.8    14.3  ?     ?   177.298   -85.5868     44.2932    -85.5868     117.816    94.4132      
1 1 1 2   10 20 o 0 69.3    17    ?     ?   249.03    -76.8042     118.354    -76.8042     126.511    103.196      
1 1 1 2   10 21 o 0 8.1     17.6  ?     ?   92.1924   -167.059     15.8065    -167.059     74.6339    12.941       
1 1 1 2   10 22 f 1 51.6    21.3  ?     ?   80.398    18.7081      162.62     18.7081      88.3728    18.7081      
1 1 1 2   10 23 o 0 9.1     25.3  ?     ?   44.2383   114.586      46.6139    114.586      6.9229     114.586      
1 1 1 2   10 24 < 0 23.9    24.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  12 22 < 0 -6.9    21.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  12 21 o 0 35.5    18.7  ?     ?   98.831    42.0179      119.246    42.0179      33.1681    42.0179      
1 1 1 -2  12 20 o 0 35.5    16.7  ?     ?   252.944   48.6929      4.16288    48.6929      220.826    -131.307     
1 1 1 -2  12 19 o 0 72.2    17.4  ?     ?   168.713   58.3853      195.048    58.3853      40.2878    58.3853      
1 1 1 -2  12 18 o 0 74.5    18.2  ?     ?   207.244   114.335      163.529    114.335      35.0337    -65.6651     
1 1 1 -2  12 17 o 0 110.4   15.4  ?     ?   221       79.6406      244.27     79.6406      32.2389    79.6406      
1 1 1 -2  12 16 o 0 51.6    13.9  ?     ?   203.012   54.866       102.224    54.866       78.7116    -125.134     
1 1 1 -2  12 15 o 0 75.8    13.1  ?     ?   185.567   99.235       183.19     99.235       17.9371    99.235       
1 1 1 -2  12 14 o 0 15.8    11.7  ?     ?   172.577   131.053      26.2214    -48.9467     180.473    -48.9467     
1 1 1 -2  12 13 o 0 173.1   11.6  ?     ?   336.155   11.0584      264.935    11.0584      45.3485    -168.942     
1 1 1 -2  12 12 o 0 325.9   12.4  ?     ?   436.804   34.7878      404.56     34.7878      1.24628    -145.212     
1 1 1 -2  12 11 o 0 232.2   10.4  ?     ?   213.897   147.835      453.898    147.835      250.592    147.835      
1 1 1 -2  12 10 o 0 313.8   11.1  ?     ?   416.195   49.5333      388.111    49.5333      16.7203    -130.467     
1 1 1 -2  12 9  o 0 336.2   10.5  ?     ?   314.478   55.4228      508.661    55.4228      201.243    55.4228      
1 1 1 -2  12 8  o 0 87.7    6.9   ?     ?   161.369   135.141      191.871    135.141      33.4182    135.141      
1 1 1 -2  12 7  o 0 53.5    6.3   ?     ?   168.845   -88.7533     54.1531    -88.7533     93.2658    91.2467      
1 1 1 -2  12 6  o 0 517.4   12.3  ?     ?   440.444   -139.803     536.153    -139.803     150.274    -139.803     
1 1 1 -2  12 5  f 1 32.5    5.5   ?     ?   253.354   -55.832      52.6815    124.168      276.445    124.168      
1 1 1 -2  12 4  o 0 71.2    5.7   ?     ?   251.568   103.712      49.8778    103.712      169.786    -76.2882     
1 1 1 -2  12 3  o 0 46.3    5.8   ?     ?   416.144   34.2188      126.409    -145.781     490.478    -145.781     
1 1 1 -2  12 2  o 0 193.6   7.4   ?     ?   99.2529   -46.7581     275.573    -46.7581     188.615    -46.7581     
1 1 1 -2  12 1  o 0 98.3    7.4   ?     ?   161.333   -64.0323     139.04     -64.0323     2.4442     115.968      
1 1 1 2   12 0  o 0 1743.7  35    ?     ?   909.697   75.893       953.411    75.893       154.756    75.893       
1 1 1 2   12 1  o 0 361     16.1  ?     ?   333.314   12.032       455.698    12.032       163.163    12.032       
1 1 1 2   12 2  o 0 374.9   10.5  ?     ?   628.633   -50.4304     240.045    -50.4304     311.251    129.57       
1 1 1 2   12 3  o 0 316.5   9.2   ?     ?   271.714   -58.9361     443.647    -58.9361     205.657    -58.9361     
1 1 1 2   12 4  o 0 92.9    6.2   ?     ?   205.91    -27.7597     120.361    -27.7597     59.6801    152.24       
1 1 1 2   12 5  f 1 84.3    7.1   ?     ?   347.949   -8.10915     34.6708    -8.10915     273.12     171.891      
1 1 1 2   12 6  o 0 76      7.2   ?     ?   220.08    80.8897      97.098     80.8897      96.058     -99.1103     
1 1 1 2   12 7  o 0 4.4     6.6   ?     ?   62.3424   146.861      42.8378    -33.1392     97.3765    -33.1392     
1 1 1 2   12 8  o 0 457.3   12.1  ?     ?   350.082   -26.8048     624.794    -26.8048     280.291    -26.8048     
1 1 1 2   12 9  o 0 54.5    8.2   ?     ?   174.873   109.611      89.6004    109.611      81.7538    -70.3892     
1 1 1 2   12 10 o 0 16.4    7.7   ?     ?   166.548   -95.3524     66.4779    84.6476      228.898    84.6476      
1 1 1 2   12 11 o 0 39.7    7.7   ?     ?   130.368   67.3616      76.8667    67.3616      47.392     -112.638     
1 1 1 2   12 12 o 0 8.2     8.6   ?     ?   36.6917   86.2566      11.8425    -93.7434     46.0325    -93.7434     
1 1 1 2   12 13 o 0 92.7    10.7  ?     ?   94.7463   -92.1073     253.185    -92.1073     165.451    -92.1073     
1 1 1 2   12 14 o 0 0.6     11.5  ?     ?   53.9132   43.0721      19.5733    -136.928     67.9255    -136.928     
1 1 1 2   12 15 o 0 6.7     11.4  ?     ?   168.101   53.2138      58.3121    -126.786     208.55     -126.786     
1 1 1 2   12 16 o 0 109.7   15.4  ?     ?   208.048   118.296      248.146    118.296      62.0185    118.296      
1 1 1 2   12 17 o 0 -9.7    15.1  ?     ?   62.2629   175.341      19.9582    -4.65902     79.933     -4.65902     
1 1 1 2   12 18 o 0 44.4    16.1  ?     ?   113.078   -96.0273     133.661    -96.0273     24.8651    -96.0273     
1 1 1 2   12 19 o 0 111.8   21.8  ?     ?   115.411   160.464      323.2      160.464      216.869    160.464      
1 1 1 2   12 20 o 0 22.2    21.7  ?     ?   124.124   19.6555      54.7365    19.6555      56.1767    -160.345     
1 1 1 2   12 21 o 0 96.5    19.9  ?     ?   177.842   2.63417      249.971    2.63417      94.3346    2.63417      
1 1 1 2   12 22 < 0 62      22.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  14 19 < 0 161.5   21.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  14 18 o 0 192.1   23.9  ?     ?   267.566   4.35754      348        4.35754      121.112    4.35754      
1 1 1 -2  14 17 o 0 211.9   19.7  ?     ?   254.205   -26.0257     397.176    -26.0257     180.16     -26.0257     
1 1 1 -2  14 16 o 0 9.7     16.4  ?     ?   45.7959   -50.2826     22.9364    -50.2826     17.0153    129.717      
1 1 1 -2  14 15 o 0 97.6    17.5  ?     ?   224.287   105.059      209.497    105.059      8.04892    105.059      
1 1 1 -2  14 14 o 0 39.2    15    ?     ?   148.834   -171.993     92.0243    -171.993     47.3649    8.00675      
1 1 1 -2  14 13 o 0 298.9   17    ?     ?   376.207   157.441      412.375    157.441      60.1707    157.441      
1 1 1 -2  14 12 o 0 60.8    11.2  ?     ?   120.046   -43.0574     176.043    -43.0574     71.8239    -43.0574     
1 1 1 -2  14 11 o 0 429.3   17    ?     ?   470.998   13.8803      480.298    13.8803      68.8773    13.8803      
1 1 1 -2  14 10 f 1 147     12.5  ?     ?   172.824   23.4463      339.673    23.4463      188.4      23.4463      
1 1 1 -2  14 9  o 0 4.5     9.7   ?     ?   53.1216   -49.3636     17.5107    130.636      63.8349    130.636      
1 1 1 -2  14 8  o 0 -22.2   8.6   ?     ?   56.1038   -105.052     40.7838    74.9475      89.9372    74.9475      
1 1 1 -2  14 7  o 0 373.2   11.6  ?     ?   476.923   101.6        427.148    101.6        7.56395    101.6        
1 1 1 -2  14 6  o 0 282.2   10.2  ?     ?   314.128   94.8077      442.233    94.8077      157.773    94.8077      
1 1 1 -2  14 5  o 0 130.6   8     ?     ?   188.077   -0.0121118   298.405    -0.0121118   127.548    -0.0121118   
1 1 1 -2  14 4  o 0 479.3   13.1  ?     ?   471.02    -41.4188     540.1      -41.4188     111.051    -41.4188     
1 1 1 -2  14 3  o 0 50.2    6.5   ?     ?   109.907   -8.93751     113.068    -8.93751     11.0288    -8.93751     
1 1 1 -2  14 2  o 0 260.1   10.2  ?     ?   319.379   143.844      401.933    143.844      104.9      143.844      
1 1 1 -2  14 1  o 0 113.9   8.1   ?     ?   189.936   -101.581     252.819    -101.581     75.947     -101.581     
1 1 1 2   14 0  o 0 645     16.6  ?     ?   567.439   -37.977      605.635    -37.977      76.2391    -37.977      
1 1 1 2   14 1  o 0 154.3   7.9   ?     ?   174.85    -42.8006     342.482    -42.8006     179.46     -42.8006     
1 1 1 2   14 2  o 0 201.5   9     ?     ?   360.413   34.7983      280.213    34.7983      55.4505    -145.202     
1 1 1 2   14 3  o 0 103     10.4  ?     ?   208.03    -122.323     216.017    -122.323     22.5749    -122.323     
1 1 1 2   14 4  o 0 737.7   19.2  ?     ?   547.158   2.3436       711.018    2.3436       211.745    2.3436       
1 1 1 2   14 5  o 0 364.7   11.4  ?     ?   495.453   -11.0915     392.374    -11.0915     58.5848    168.908      
1 1 1 2   14 6  o 0 27.2    7.9   ?     ?   124.15    125.239      42.9901    125.239      69.6726    -54.7612     
1 1 1 2   14 7  o 0 77.8    8.2   ?     ?   148.67    -110.26      210.858    -110.26      79.7614    -110.26      
1 1 1 2   14 8  o 0 63.9    9     ?     ?   161.939   52.8628      164.939    52.8628      22.7086    52.8628      
1 1 1 2   14 9  o 0 36.8    10    ?     ?   157.537   28.3882      77.4346    28.3882      60.3125    -151.612     
1 1 1 2   14 10 f 1 205.1   11.6  ?     ?   353.253   35.5871      301.192    35.5871      8.89948    -144.413     
1 1 1 2   14 11 o 0 20.9    11    ?     ?   112.476   119.285      29.2162    119.285      69.3336    -60.7145     
1 1 1 2   14 12 o 0 14.2    9.6   ?     ?   96.8552   -166.384     2.70319    -166.384     81.6565    13.6163      
1 1 1 2   14 13 o 0 14.5    13.2  ?     ?   98.8861   -148.73      13.8103    -148.73      79.0855    31.2695      
1 1 1 2   14 14 o 0 46.2    15.1  ?     ?   189.726   -53.4751     87.8666    -53.4751     90.4666    126.525      
1 1 1 2   14 15 o 0 106.7   21.5  ?     ?   235.23    173.892      218.358    173.892      6.27212    173.892      
1 1 1 2   14 16 o 0 1.6     18.2  ?     ?   71.7937   111.711      14.8021    111.711      48.0815    -68.289      
1 1 1 2   14 17 o 0 97.2    23.4  ?     ?   152.607   -97.9463     256.448    -97.9463     125.618    -97.9463     
1 1 1 2   14 18 o 0 50.8    24.3  ?     ?   86.3761   -110.693     161.295    -110.693     87.7275    -110.693     
1 1 1 2   14 19 < 0 -11.3   25.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  16 15 < 0 54.3    20.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  16 14 < 0 96.7    19    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  16 13 o 0 16.3    16.7  ?     ?   114.386   -56.0138     46.0209    -56.0138     48.7815    123.986      
1 1 1 -2  16 12 o 0 23.2    14.1  ?     ?   124.262   -50.8005     55.0915    -50.8005     48.3666    129.2        
1 1 1 -2  16 11 o 0 -2.7    9.2   ?     ?   97.6212   -33.0344     35.9224    146.966      118.796    146.966      
1 1 1 -2  16 10 o 0 29.8    14    ?     ?   109.248   160.183      82.7056    160.183      10.5811    -19.8168     
1 1 1 -2  16 9  o 0 156.3   20.1  ?     ?   159.323   97.5143      368.751    97.5143      229.062    97.5143      
1 1 1 -2  16 8  o 0 246.3   13.7  ?     ?   303.294   -21.6398     401.028    -21.6398     133.81     -21.6398     
1 1 1 -2  16 7  f 1 26.5    11.2  ?     ?   103.72    55.6201      66.5612    55.6201      28.9096    -124.38      
1 1 1 -2  16 6  o 0 37.1    9.4   ?     ?   174.872   -170         75.5264    -170         85.2412    9.99996      
1 1 1 -2  16 5  o 0 50.3    10    ?     ?   105.46    122.214      156.536    122.214      59.9742    122.214      
1 1 1 -2  16 4  o 0 104.1   10.4  ?     ?   243.748   -37.081      204.387    -37.081      19.4551    142.919      
1 1 1 -2  16 3  o 0 133.3   10.9  ?     ?   175.719   -54.745      318.689    -54.745      156.92     -54.745      
1 1 1 -2  16 2  o 0 85.4    10.2  ?     ?   166.702   -47.6262     222.487    -47.6262     68.7101    -47.6262     
1 1 1 -2  16 1  o 0 54.3    9.4   ?     ?   258.462   -122.238     66.322     -122.238     172.469    57.7617      
1 1 1 2   16 0  o 0 135.1   9.4   ?     ?   225.785   -149.621     285.706    -149.621     76.5746    -149.621     
1 1 1 2   16 1  o 0 137     10.4  ?     ?   277.16    -52.8299     245.856    -52.8299     10.6222    127.17       
1 1 1 2   16 2  o 0 254.5   12.1  ?     ?   321.697   -39.4548     397.444    -39.4548     100.165    -39.4548     
1 1 1 2   16 3  o 0 307.5   12.6  ?     ?   312.345   50.8699      475.415    50.8699      187.31     50.8699      
1 1 1 2   16 4  o 0 89.1    10.7  ?     ?   206.866   28.069       200.049    28.069       9.67662    28.069       
1 1 1 2   16 5  o 0 11      10.7  ?     ?   101.035   153.851      5.09453    -26.1494     97.8157    -26.1494     
1 1 1 2   16 6  o 0 73.7    11.1  ?     ?   265.483   97.2397      113.383    97.2397      131.286    -82.7603     
1 1 1 2   16 7  f 1 32.6    10.9  ?     ?   140.733   -31.4367     75.4593    -31.4367     54.421     148.563      
1 1 1 2   16 8  o 0 91.6    13.3  ?     ?   267.018   -55.6639     160.573    -55.6639     75.3428    124.336      
1 1 1 2   16 9  o 0 58.7    15.8  ?     ?   149.483   -46.0337     163.621    -46.0337     32.1684    -46.0337     
1 1 1 2   16 10 o 0 21.2    11.3  ?     ?   116.174   156.292      46.393     156.292      53.1211    -23.7084     
1 1 1 2   16 11 o 0 207     19.8  ?     ?   290.457   150.715      350.498    150.715      103.097    150.715      
1 1 1 2   16 12 o 0 41.3    16.9  ?     ?   140.951   -158.907     108.567    -158.907     9.199      21.0928      
1 1 1 2   16 13 o 0 3.8     18.3  ?     ?   125.576   156.099      14.0568    156.099      90.4053    -23.9014     
1 1 1 2   16 14 < 0 145.8   20.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 2   16 15 < 0 56.2    22.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  18 7  < 0 14.5    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  18 6  < 0 25      15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  18 5  < 0 60.8    15.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  18 4  < 0 326.9   17.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -2  18 3  o 0 109.3   14.5  ?     ?   244.153   168.612      217.252    168.612      19.394     168.612      
1 1 1 -2  18 2  o 0 41.7    14.1  ?     ?   106.209   -170.333     137.182    -170.333     50.9171    -170.333     
1 1 1 -2  18 1  o 0 69      14.7  ?     ?   210.494   -82.5693     151.303    -82.5693     19.9733    97.4307      
1 1 1 2   18 0  o 0 47.4    14.3  ?     ?   144.824   -98.8616     137.415    -98.8616     19.2009    -98.8616     
1 1 1 2   18 1  o 0 1.3     14.3  ?     ?   53.5908   70.4337      18.5846    70.4337      25.1074    -109.566     
1 1 1 2   18 2  o 0 51.1    14.7  ?     ?   111.39    171.321      168.589    171.321      77.9234    171.321      
1 1 1 2   18 3  o 0 21.4    14.7  ?     ?   47.5294   -20.9938     67.9342    -20.9938     29.3291    -20.9938     
1 1 1 2   18 4  < 0 13.4    14    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 2   18 5  < 0 24.5    15.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 2   18 6  < 0 32.6    16.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 2   18 7  < 0 75.3    17.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  1  29 < 0 40.6    25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  1  28 o 0 -6.5    19.8  ?     ?   69.205    130.596      15.8291    130.596      49.6497    -49.404      
1 1 1 -3  1  27 o 0 29.8    24.4  ?     ?   159.1     -159.749     50.0054    -159.749     107.568    20.2505      
1 1 1 -3  1  26 o 0 45.3    17.6  ?     ?   78.0612   -121.378     152.535    -121.378     71.6314    -121.378     
1 1 1 -3  1  25 o 0 174.1   16.6  ?     ?   246.352   -95.5936     364.977    -95.5936     128.99     -95.5936     
1 1 1 -3  1  24 o 0 46      14.2  ?     ?   176.268   -169.947     106.72     -169.947     62.4221    10.0525      
1 1 1 -3  1  23 o 0 135.4   16.2  ?     ?   150.343   -6.63972     356.816    -6.63972     207.93     -6.63972     
1 1 1 -3  1  22 o 0 286.9   14.1  ?     ?   303.222   -111.717     493.546    -111.717     185.186    -111.717     
1 1 1 -3  1  21 o 0 139.4   11.9  ?     ?   384.145   -74.3515     151.489    -74.3515     249.83     105.649      
1 1 1 -3  1  20 o 0 134.3   11.9  ?     ?   332.6     -125.448     158.346    -125.448     152.156    54.5524      
1 1 1 -3  1  19 o 0 104.6   10.1  ?     ?   136.001   -96.8807     157.733    -96.8807     30.7901    -96.8807     
1 1 1 -3  1  18 o 0 988.7   22.6  ?     ?   795.836   -165.923     637.716    -165.923     127.126    14.0767      
1 1 1 -3  1  17 o 0 1181.7  24.4  ?     ?   658.373   140.762      904.438    140.762      266.782    140.762      
1 1 1 -3  1  16 o 0 1083    22.4  ?     ?   688.107   133.569      786.497    133.569      124.853    133.569      
1 1 1 -3  1  15 o 0 1837.3  33.3  ?     ?   1070.41   40.6472      872.266    40.6472      177.829    -139.353     
1 1 1 -3  1  14 o 0 4822.5  81.7  ?     ?   1390.85   -9.30841     1777.74    -9.30841     404.34     -9.30841     
1 1 1 -3  1  13 o 0 959.9   17.9  ?     ?   573.954   7.00551      864.968    7.00551      271.767    7.00551      
1 1 1 -3  1  12 o 0 668     13.2  ?     ?   635.01    173.814      560.553    173.814      99.5159    -6.18557     
1 1 1 -3  1  11 o 0 247.4   8.8   ?     ?   405.237   -93.1346     293.912    -93.1346     139.284    86.8654      
1 1 1 -3  1  10 o 0 635.2   12.2  ?     ?   499.958   79.3312      685.289    79.3312      152.85     79.3312      
1 1 1 -3  1  9  o 0 179.5   4.5   ?     ?   216.528   43.045       319.95     43.045       88.3169    43.045       
1 1 1 -3  1  8  f 1 489.7   13.3  ?     ?   772.685   -7.82802     236.174    -7.82802     534.415    172.172      
1 1 1 -3  1  7  o 0 2643.9  44.7  ?     ?   1072.33   42.1441      1273.99    42.1441      247.886    42.1441      
1 1 1 -3  1  6  o 0 1953.5  33.7  ?     ?   967.066   29.7044      1050.51    29.7044      122.082    29.7044      
1 1 1 -3  1  5  f 1 3670.6  72.4  ?     ?   1550.22   2.67827      1208.11    2.67827      258.552    -177.322     
1 1 1 -3  1  4  o 0 535.5   10.1  ?     ?   342.376   170.431      631.216    170.431      314.416    170.431      
1 1 1 -3  1  3  o 0 355.9   6.8   ?     ?   230.866   127.701      515.28     127.701      301.248    127.701      
1 1 1 -3  1  2  o 0 542.7   11.7  ?     ?   683.505   149.362      354.897    149.362      279.393    -30.6377     
1 1 1 -3  1  1  o 0 3005.1  91.2  ?     ?   992.01    117.204      1454.59    117.204      535.031    117.204      
1 1 1 3   1  1  o 0 1075.5  23.4  ?     ?   765.759   -90.8629     692.988    -90.8629     12.8209    89.1371      
1 1 1 3   1  3  o 0 2230.7  38.4  ?     ?   1164.01   152.1        969.914    152.1        111.049    -27.8996     
1 1 1 3   1  4  o 0 1782.1  30.9  ?     ?   1146.43   -159.167     765.574    -159.167     298.055    20.8329      
1 1 1 3   1  5  f 1 4968.1  84.4  ?     ?   1600.74   19.9065      1604.97    19.9065      85.7645    19.9065      
1 1 1 3   1  6  o 0 1840.3  32.2  ?     ?   1164.37   57.1186      808.766    57.1186      312.875    -122.881     
1 1 1 3   1  7  o 0 582.5   11.5  ?     ?   355.755   -171.38      689.807    -171.38      348.176    -171.38      
1 1 1 3   1  8  f 1 1713.3  30.5  ?     ?   826.447   173.657      1089.79    173.657      262.532    173.657      
1 1 1 3   1  9  o 0 750.8   14.1  ?     ?   616.468   120.431      686.604    120.431      24.5975    120.431      
1 1 1 3   1  10 o 0 989.1   21.2  ?     ?   692.253   118.3        810.892    118.3        70.7327    118.3        
1 1 1 3   1  11 o 0 1793.8  41.5  ?     ?   885.028   130.714      1148.43    130.714      198.44     130.714      
1 1 1 3   1  12 o 0 414     10.3  ?     ?   539.404   -175.47      387.65     -175.47      175.438    4.53021      
1 1 1 3   1  13 o 0 509.5   15.6  ?     ?   529.889   -85.7288     502.631    -85.7288     47.4602    94.2712      
1 1 1 3   1  14 o 0 2114.8  53.5  ?     ?   844.862   -103.157     1242.75    -103.157     404.639    -103.157     
1 1 1 3   1  15 o 0 172     10.8  ?     ?   254.264   164.421      252.052    164.421      1.41819    164.421      
1 1 1 3   1  16 o 0 153.8   12.5  ?     ?   499.455   -126.242     30.6725    -126.242     451.969    53.7582      
1 1 1 3   1  17 o 0 661.5   17.3  ?     ?   370.487   -45.8191     761.806    -45.8191     401.116    -45.8191     
1 1 1 3   1  18 o 0 779.8   23.9  ?     ?   536.086   0.931637     716.513    0.931637     198.527    0.931637     
1 1 1 3   1  19 o 0 318.6   13.5  ?     ?   309.754   -167.021     452.167    -167.021     161.423    -167.021     
1 1 1 3   1  20 o 0 432.8   17.1  ?     ?   350.038   166.755      561.691    166.755      233.004    166.755      
1 1 1 3   1  21 o 0 234.5   14.2  ?     ?   258.437   -136.165     442.877    -136.165     171.25     -136.165     
1 1 1 3   1  22 o 0 17.6    14    ?     ?   120.031   -105.031     15.0095    74.9691      137.843    74.9691      
1 1 1 3   1  23 o 0 78.1    22.1  ?     ?   137.826   73.3123      218.737    73.3123      81.3537    73.3123      
1 1 1 3   1  24 o 0 -1.2    14.6  ?     ?   87.0054   -16.2579     27.3014    163.742      111.358    163.742      
1 1 1 3   1  25 o 0 40.6    24.3  ?     ?   83.8914   -35.1339     107.545    -35.1339     26.6155    -35.1339     
1 1 1 3   1  26 o 0 79.2    20.9  ?     ?   207.651   10.9203      187.993    10.9203      28.7987    -169.08      
1 1 1 3   1  27 o 0 31.4    25    ?     ?   172.816   57.9943      46.8263    57.9943      125.635    -122.006     
1 1 1 3   1  28 o 0 214     27.8  ?     ?   292.128   24.3892      403.306    24.3892      124.721    24.3892      
1 1 1 3   1  29 < 0 16.9    28.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  3  28 o 0 24.2    23.5  ?     ?   93.5612   153.267      94.6791    153.267      7.01873    153.267      
1 1 1 -3  3  27 o 0 82.3    24.6  ?     ?   187.638   105.287      203.428    105.287      23.5851    105.287      
1 1 1 -3  3  26 o 0 29.1    23.1  ?     ?   203.006   158.367      14.5827    158.367      193.434    -21.6328     
1 1 1 -3  3  25 o 0 124.9   18.9  ?     ?   189.554   -163.301     320.311    -163.301     125.366    -163.301     
1 1 1 -3  3  24 o 0 172.2   15.6  ?     ?   250.618   160.618      358.079    160.618      120.156    160.618      
1 1 1 -3  3  23 o 0 110.3   15.2  ?     ?   223.42    93.5093      255.643    93.5093      42.1265    93.5093      
1 1 1 -3  3  22 o 0 391.8   16.5  ?     ?   444.504   58.7176      508.257    58.7176      68.2169    58.7176      
1 1 1 -3  3  21 o 0 363     15.7  ?     ?   375.62    -19.5081     531.21     -19.5081     149.375    -19.5081     
1 1 1 -3  3  20 o 0 34.1    12.7  ?     ?   121.035   -56.9704     0.186694   123.03       112.127    123.03       
1 1 1 -3  3  19 o 0 177.6   12.6  ?     ?   275.268   105.548      279.18     105.548      22.3214    105.548      
1 1 1 -3  3  18 o 0 915.3   23.2  ?     ?   576.795   -78.4059     792.259    -78.4059     254.151    -78.4059     
1 1 1 -3  3  17 o 0 4180    74.8  ?     ?   1518.2    -72.115      1465.86    -72.115      7.55651    -72.115      
1 1 1 -3  3  16 o 0 364     13.1  ?     ?   498.932   -90.0527     329.926    -90.0527     146.044    89.9473      
1 1 1 -3  3  15 o 0 1764.7  34.5  ?     ?   916.192   104.226      984.313    104.226      103.847    104.226      
1 1 1 -3  3  14 o 0 1604.3  29.9  ?     ?   892.112   57.2132      915.328    57.2132      40.634     57.2132      
1 1 1 -3  3  13 o 0 152.3   6.7   ?     ?   198.637   -103.417     239.377    -103.417     43.3375    -103.417     
1 1 1 -3  3  12 o 0 751.2   14.7  ?     ?   723.9     -144.254     545.173    -144.254     202.633    35.7459      
1 1 1 -3  3  11 o 0 33.6    4.1   ?     ?   323.996   159.529      138.133    -20.4709     474.767    -20.4709     
1 1 1 -3  3  10 o 0 351.9   8.8   ?     ?   242.459   25.3043      577.283    25.3043      318.19     25.3043      
1 1 1 -3  3  9  o 0 877.5   18.8  ?     ?   783.172   -50.1633     623.015    -50.1633     210.807    129.837      
1 1 1 -3  3  8  o 0 347.6   7.1   ?     ?   504.26    127.374      352.882    127.374      186.455    -52.6262     
1 1 1 -3  3  7  o 0 513.3   9.8   ?     ?   319.686   105.604      671.538    105.604      354.39     105.604      
1 1 1 -3  3  5  o 0 844.1   15.2  ?     ?   661.387   152.48       647.833    152.48       13.069     152.48       
1 1 1 -3  3  4  o 0 506     9.3   ?     ?   324.716   75.2437      640.188    75.2437      327.794    75.2437      
1 1 1 -3  3  3  o 0 713.5   13    ?     ?   744.586   -76.843      457.005    -76.843      244.295    103.157      
1 1 1 -3  3  2  o 0 1305.6  22.9  ?     ?   759.063   -101.562     862.654    -101.562     147.564    -101.562     
1 1 1 -3  3  1  o 0 558.3   10.9  ?     ?   338.761   7.36692      653.355    7.36692      340.774    7.36692      
1 1 1 3   3  0  o 0 2752.8  46.7  ?     ?   1184.36   28.2206      1163.23    28.2206      79.3422    28.2206      
1 1 1 3   3  1  o 0 464.8   8.8   ?     ?   601.281   4.75641      354.14     4.75641      209.074    -175.244     
1 1 1 3   3  2  o 0 517.6   9.6   ?     ?   396.885   44.7013      581.135    44.7013      208.369    44.7013      
1 1 1 3   3  3  o 0 3544.3  60.2  ?     ?   1185.37   57.8421      1507.25    57.8421      392.539    57.8421      
1 1 1 3   3  4  o 0 228.1   5.2   ?     ?   288.152   166.352      328.476    166.352      51.3502    166.352      
1 1 1 3   3  5  o 0 1912.9  33    ?     ?   1007.96   127.833      991.55     127.833      23.5315    127.833      
1 1 1 3   3  6  o 0 553.9   10.7  ?     ?   510.61    -177.836     553.533    -177.836     44.3845    -177.836     
1 1 1 3   3  7  o 0 1474    27.2  ?     ?   774.802   167.722      1000.88    167.722      230.661    167.722      
1 1 1 3   3  8  o 0 148.3   5     ?     ?   387.682   147.479      134.784    147.479      280.915    -32.5211     
1 1 1 3   3  9  o 0 121.3   4.6   ?     ?   299.579   -38.4792     146.829    -38.4792     173.063    141.521      
1 1 1 3   3  10 o 0 32      3.8   ?     ?   229.803   -53.7667     83.5028    126.233      329.881    126.233      
1 1 1 3   3  11 o 0 2337.7  42.2  ?     ?   1014.55   166.098      1276.78    166.098      218.845    166.098      
1 1 1 3   3  12 o 0 875.8   16.9  ?     ?   900.884   -177.897     475.937    -177.896     458.336    2.1035       
1 1 1 3   3  13 o 0 2035.8  36.8  ?     ?   1067.97   54.5262      986.888    54.5262      71.5327    -125.474     
1 1 1 3   3  14 o 0 1127    24.3  ?     ?   569.897   80.113       927.779    80.113       366.522    80.113       
1 1 1 3   3  15 o 0 346.6   11.7  ?     ?   286.04    53.1962      481.618    53.1962      205.439    53.1962      
1 1 1 3   3  16 o 0 87.7    10.1  ?     ?   314.134   27.33        37.2933    27.33        263.869    -152.67      
1 1 1 3   3  17 o 0 474.8   14.9  ?     ?   417.03    48.1417      537.735    48.1417      135.073    48.1417      
1 1 1 3   3  18 o 0 793     21.2  ?     ?   690.278   -22.6507     600.953    -22.6507     46.5418    157.349      
1 1 1 3   3  19 o 0 679.5   20.7  ?     ?   684.639   -102.742     506.914    -102.742     135.587    77.2579      
1 1 1 3   3  20 o 0 599.7   19.3  ?     ?   506.211   70.215       670.144    70.215       138.375    70.215       
1 1 1 3   3  21 o 0 -13.7   12.9  ?     ?   153.285   -169.217     112.453    10.7828      269.245    10.7828      
1 1 1 3   3  22 o 0 18.2    13.7  ?     ?   195.71    44.6633      38.7655    -135.337     233.767    -135.337     
1 1 1 3   3  23 o 0 44.9    15.2  ?     ?   127.311   -166.648     121.528    -166.648     0.961417   13.3523      
1 1 1 3   3  24 o 0 143.6   16.5  ?     ?   269.815   25.9822      288.318    25.9822      30.3692    25.9822      
1 1 1 3   3  25 o 0 193.3   19.4  ?     ?   364.929   26.5488      295.12     26.5488      82.9308    -153.451     
1 1 1 3   3  26 o 0 182.5   23.3  ?     ?   325.178   7.33932      304.127    7.33931      31.6088    -172.661     
1 1 1 3   3  27 o 0 -16     22.5  ?     ?   85.9576   -73.7656     0.726418   -73.7656     82.3107    106.234      
1 1 1 3   3  28 o 0 -6.5    24.2  ?     ?   60.7564   -176.704     41.6732    -176.704     15.7179    3.2956       
1 1 1 -3  5  28 < 0 20.5    18.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  5  27 o 0 -7.1    13.7  ?     ?   38.3057   119.626      1.8094     -60.3741     37.3264    -60.3741     
1 1 1 -3  5  26 f 1 4.6     15.1  ?     ?   38.7573   25.1289      11.1464    25.1289      25.8855    -154.871     
1 1 1 -3  5  25 o 0 51.6    15.9  ?     ?   98.4537   -21.0925     180.301    -21.0925     80.2498    -21.0925     
1 1 1 -3  5  24 o 0 285.4   20    ?     ?   345.651   -150.371     467.816    -150.371     127.351    -150.371     
1 1 1 -3  5  23 o 0 229.7   15.9  ?     ?   444.312   -174.655     282.933    -174.655     135.335    5.34516      
1 1 1 -3  5  22 o 0 18.4    12.6  ?     ?   205.622   -113.518     36.3808    66.4821      231.225    66.4821      
1 1 1 -3  5  21 f 1 175.6   14.9  ?     ?   315.841   117.444      302.268    117.444      9.32171    -62.5562     
1 1 1 -3  5  20 o 0 20.7    15    ?     ?   139.421   133.189      8.97601    -46.8111     149.479    -46.8111     
1 1 1 -3  5  19 o 0 237.3   11.2  ?     ?   77.3447   111.47       478.697    111.47       398.636    111.47       
1 1 1 -3  5  18 o 0 400.1   13.6  ?     ?   282.127   -97.6829     569.624    -97.6829     308.697    -97.6829     
1 1 1 -3  5  17 o 0 93.3    9.4   ?     ?   110.795   77.4033      121.811    77.4033      19.3759    77.4033      
1 1 1 -3  5  16 o 0 239.6   11.1  ?     ?   229.446   -118.953     371.211    -118.953     152.826    -118.953     
1 1 1 -3  5  15 o 0 212.3   9.4   ?     ?   71.696    83.1613      236.601    83.1613      167.009    83.1613      
1 1 1 -3  5  14 o 0 1130.3  23    ?     ?   809.445   136.334      699.774    136.334      70.7761    -43.6658     
1 1 1 -3  5  13 o 0 681.3   15    ?     ?   496.332   -24.7621     645.352    -24.7621     163.39     -24.7621     
1 1 1 -3  5  12 o 0 232     7.8   ?     ?   315.82    9.79053      306.874    9.79053      1.75039    -170.209     
1 1 1 -3  5  11 o 0 347.4   10.8  ?     ?   408.46    -104.972     410.971    -104.972     11.7535    75.028       
1 1 1 -3  5  10 o 0 998.8   22.4  ?     ?   697.076   174.523      770.586    174.523      53.8837    174.523      
1 1 1 -3  5  9  o 0 80.4    3.6   ?     ?   121.628   154.611      94.8057    154.611      30.8685    -25.3894     
1 1 1 -3  5  8  o 0 23.5    2.9   ?     ?   89.7182   -151.437     38.931     28.5626      132.048    28.5626      
1 1 1 -3  5  7  o 0 878.9   17.9  ?     ?   505.474   -168.341     896.087    -168.341     361.977    -168.341     
1 1 1 -3  5  6  o 0 799.6   15.1  ?     ?   678.524   -176.523     659.413    -176.523     59.9067    3.47653      
1 1 1 -3  5  5  o 0 247     5.6   ?     ?   237.141   104.099      427.128    104.099      175.073    104.099      
1 1 1 -3  5  3  o 0 1661.8  29.2  ?     ?   907.338   165.121      975.207    165.121      81.8138    165.121      
1 1 1 -3  5  2  o 0 1266.9  22.6  ?     ?   844.883   129.925      795.061    129.925      37.0143    -50.0752     
1 1 1 -3  5  1  o 0 488.9   9.8   ?     ?   358.961   172.559      610.306    172.559      256.988    172.559      
1 1 1 3   5  1  o 0 188     4.4   ?     ?   439.216   118.559      151.84     118.559      279.448    -61.4414     
1 1 1 3   5  2  o 0 254.8   7.7   ?     ?   319.971   -107.175     353.412    -107.175     38.8234    -107.175     
1 1 1 3   5  3  o 0 2644.5  45.8  ?     ?   1155.89   -26.8245     1228.97    -26.8245     91.9505    -26.8245     
1 1 1 3   5  4  o 0 1524.9  27.2  ?     ?   940.103   69.2815      863.032    69.2815      61.4194    -110.719     
1 1 1 3   5  5  o 0 129.3   3.1   ?     ?   217.572   -10.7021     212.546    -10.7021     18.8055    169.298      
1 1 1 3   5  6  o 0 393     8.1   ?     ?   469.089   -77.1388     442.888    -77.1388     54.9199    102.861      
1 1 1 3   5  7  o 0 80.2    3.5   ?     ?   313.153   -45.3472     30.0027    -45.3472     301.42     134.653      
1 1 1 3   5  8  o 0 341.4   8.7   ?     ?   618.288   -138.888     218.652    -138.888     424.408    41.1124      
1 1 1 3   5  9  o 0 64.6    3.5   ?     ?   177.07    31.2456      53.3578    31.2456      130.072    -148.754     
1 1 1 3   5  10 o 0 447.8   10.1  ?     ?   367.686   88.7955      579.047    88.7955      199.879    88.7955      
1 1 1 3   5  11 o 0 1432.5  28.7  ?     ?   875.111   -165.315     880.774    -165.315     27.9478    14.6846      
1 1 1 3   5  12 o 0 1795.5  33.3  ?     ?   1026.29   -115.901     892.349    -115.901     114.288    64.0986      
1 1 1 3   5  13 o 0 505.8   13.7  ?     ?   472.368   -19.5447     506.163    -19.5447     45.6108    -19.5447     
1 1 1 3   5  14 o 0 1436.8  29.1  ?     ?   773.549   -16.5075     927.53     -16.5075     187.931    -16.5075     
1 1 1 3   5  15 o 0 478.6   14.9  ?     ?   436.055   -155.1       519.492    -155.1       94.2559    -155.1       
1 1 1 3   5  16 o 0 676.2   19.1  ?     ?   600.834   66.9249      565.259    66.9249      9.45393    -113.075     
1 1 1 3   5  17 o 0 373.3   14.7  ?     ?   280.978   -51.7598     533.809    -51.7598     272.664    -51.7598     
1 1 1 3   5  18 o 0 57.5    12.5  ?     ?   145.399   77.3633      72.5747    77.3633      62.6441    -102.637     
1 1 1 3   5  19 o 0 0.4     11.8  ?     ?   219.215   99.1898      158.244    -80.8102     386.48     -80.8102     
1 1 1 3   5  20 o 0 24.8    15.1  ?     ?   192.921   105.328      20.8752    -74.6722     216.48     -74.6722     
1 1 1 3   5  21 f 1 143.1   14.5  ?     ?   381.561   147.172      180.526    147.172      198.305    -32.8278     
1 1 1 3   5  22 o 0 127.9   15.8  ?     ?   362.159   126.169      176.095    126.169      169.372    -53.8314     
1 1 1 3   5  23 o 0 143.7   18.2  ?     ?   251.627   79.2451      299.953    79.2451      61.4267    79.2451      
1 1 1 3   5  24 o 0 30      19.1  ?     ?   144.385   129.098      61.4921    129.098      86.8319    -50.9018     
1 1 1 3   5  25 o 0 9.7     24.5  ?     ?   136.014   -177.974     20.8918    -177.974     118.372    2.02581      
1 1 1 3   5  26 f 1 112.3   31.6  ?     ?   269.48    -108.788     203.593    -108.788     55.9104    71.212       
1 1 1 3   5  27 o 0 40.2    27.7  ?     ?   75.0832   -67.0108     135.931    -67.0108     65.7464    -67.0108     
1 1 1 -3  7  26 o 0 14.9    23.6  ?     ?   78.1943   -46.5601     77.1421    -46.5601     5.65794    -46.5601     
1 1 1 -3  7  25 o 0 50.3    19.5  ?     ?   135.976   110.505      146.928    110.505      19.7813    110.505      
1 1 1 -3  7  24 o 0 21.1    19.1  ?     ?   153.472   130.504      24.8191    130.504      128.58     -49.4958     
1 1 1 -3  7  23 o 0 64.4    19.1  ?     ?   168.598   -113.97      171.183    -113.97      2.07783    -113.97      
1 1 1 -3  7  22 o 0 27.6    15.7  ?     ?   188.022   -25.5167     20.42      -25.5167     155.155    154.483      
1 1 1 -3  7  21 o 0 699     22.1  ?     ?   564.584   58.5695      707.605    58.5695      181.612    58.5695      
1 1 1 -3  7  20 o 0 129.9   12.1  ?     ?   218.266   36.7138      291.774    36.7138      81.1847    36.7138      
1 1 1 -3  7  19 o 0 252.9   12.8  ?     ?   371.585   80.6318      369.594    80.6318      1.55053    80.6318      
1 1 1 -3  7  18 f 1 208.2   12.8  ?     ?   320.213   144.264      331.788    144.264      4.40528    144.264      
1 1 1 -3  7  17 o 0 41.5    9.1   ?     ?   67.3423   -118.148     22.2       -118.148     38.9874    61.8524      
1 1 1 -3  7  16 f 1 328.2   11.8  ?     ?   357.156   165.464      413.922    165.464      87.9296    165.464      
1 1 1 -3  7  15 o 0 332.6   11.9  ?     ?   446.207   124.518      354.227    124.518      54.1       -55.4817     
1 1 1 -3  7  14 o 0 1226.3  35.1  ?     ?   763.266   -84.025      812.806    -84.025      94.2712    -84.025      
1 1 1 -3  7  13 o 0 331.5   13.2  ?     ?   454.185   -94.135      336.159    -94.135      94.3348    85.865       
1 1 1 -3  7  12 f 1 21.1    6.6   ?     ?   114.684   -56.2508     56.6724    123.749      165.038    123.749      
1 1 1 -3  7  11 o 0 405.1   10.6  ?     ?   395.469   -66.4876     459.115    -66.4876     85.1569    -66.4876     
1 1 1 -3  7  10 o 0 277.1   7.5   ?     ?   386.519   -14.6173     311.528    -14.6173     60.7867    165.383      
1 1 1 -3  7  9  o 0 1038.7  21.3  ?     ?   836.398   -79.2385     606.104    -79.2385     203.481    100.761      
1 1 1 -3  7  8  o 0 443.8   11.1  ?     ?   351.424   -23.6899     570.327    -23.6899     210.652    -23.6899     
1 1 1 -3  7  7  o 0 488.1   12.1  ?     ?   410.624   -144.143     577.278    -144.143     160.471    -144.143     
1 1 1 -3  7  6  o 0 292     7.3   ?     ?   250.121   134.319      465.177    134.319      210.493    134.319      
1 1 1 -3  7  5  o 0 1281.5  22.7  ?     ?   683.09    44.3537      978.971    44.3537      281.673    44.3537      
1 1 1 -3  7  4  o 0 39.6    2.4   ?     ?   124.338   -106.338     9.34029    73.6622      136.501    73.6622      
1 1 1 -3  7  3  o 0 398.1   8.2   ?     ?   454.091   -56.0699     440.632    -56.0699     24.3368    123.93       
1 1 1 -3  7  2  o 0 79.2    3.2   ?     ?   90.7449   -159.156     78.4357    -159.156     14.5384    20.8443      
1 1 1 3   7  0  o 0 1161.8  21.9  ?     ?   770.372   145.543      831.775    145.543      25.893     145.543      
1 1 1 3   7  1  o 0 192.3   6.2   ?     ?   341.853   4.23253      251.099    4.23253      106.843    -175.767     
1 1 1 3   7  2  o 0 605.9   11.7  ?     ?   470.501   -74.4221     649.117    -74.4221     167.322    -74.4221     
1 1 1 3   7  3  o 0 452.6   9.3   ?     ?   358.872   -52.6156     587.775    -52.6156     220.336    -52.6156     
1 1 1 3   7  4  o 0 181.4   4.6   ?     ?   274.521   59.324       276.243    59.324       4.6215     -120.676     
1 1 1 3   7  5  o 0 204.2   5.8   ?     ?   358.586   -112.723     251.727    -112.723     114.636    67.2771      
1 1 1 3   7  6  o 0 345.1   7.9   ?     ?   361.111   41.7114      454.504    41.7114      86.3116    41.7114      
1 1 1 3   7  7  o 0 392.1   10    ?     ?   420.78    -143.693     460.215    -143.693     32.3329    -143.693     
1 1 1 3   7  8  o 0 597.7   13    ?     ?   389.171   -25.0693     700.12     -25.0693     300.924    -25.0693     
1 1 1 3   7  9  o 0 2248.2  40.8  ?     ?   802.3     17.5689      1320.39    17.5689      541.763    17.5689      
1 1 1 3   7  10 o 0 1573.2  30.6  ?     ?   723.943   -152.04      1041.39    -152.04      341.931    -152.04      
1 1 1 3   7  11 o 0 615.9   14.3  ?     ?   717.651   135.999      390.031    135.999      290.9      -44.0012     
1 1 1 3   7  12 f 1 1697.1  33.1  ?     ?   869.581   37.2298      969.144    37.2298      144.38     37.2298      
1 1 1 3   7  13 o 0 358.4   12    ?     ?   357.172   -159.643     448.163    -159.643     108.229    -159.643     
1 1 1 3   7  14 o 0 233.4   10    ?     ?   458.403   52.4094      200.244    52.4094      233.212    -127.591     
1 1 1 3   7  15 o 0 100     9.4   ?     ?   38.3366   28.997       59.7699    28.997       24.5207    28.997       
1 1 1 3   7  16 f 1 387.6   14    ?     ?   370.472   29.2842      475.312    29.2842      135.447    29.2842      
1 1 1 3   7  17 o 0 273.2   13.7  ?     ?   480.668   24.4737      252.011    24.4737      187.078    -155.526     
1 1 1 3   7  18 f 1 52.7    11.8  ?     ?   212.154   -86.9721     64.9424    -86.9721     153.195    93.0279      
1 1 1 3   7  19 o 0 60.7    12.7  ?     ?   37.9671   -158.556     86.4847    -158.556     48.6544    -158.556     
1 1 1 3   7  20 o 0 31.4    18.3  ?     ?   67.7585   -30.4827     52.6118    -30.4827     13.1743    149.517      
1 1 1 3   7  21 o 0 40.7    15.6  ?     ?   188.732   -85.4956     69.4195    -85.4956     107.569    94.5044      
1 1 1 3   7  22 o 0 79.3    17.9  ?     ?   313.406   -141.601     95.9244    -141.601     198.746    38.3991      
1 1 1 3   7  23 o 0 -3.9    18.8  ?     ?   15.4811   -98.7213     0.519946   -98.7213     15.1192    81.2787      
1 1 1 3   7  24 o 0 44.2    21.3  ?     ?   191.242   23.3253      72.6667    23.3253      119.914    -156.675     
1 1 1 3   7  25 o 0 55.5    23.8  ?     ?   101.61    -46.7262     174.655    -46.7262     78.903     -46.7262     
1 1 1 3   7  26 o 0 16.3    25.6  ?     ?   102.337   148.747      74.2961    148.747      20.0161    -31.2526     
1 1 1 -3  9  25 < 0 8.7     20.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  9  24 o 0 162.6   19.5  ?     ?   272.977   78.1437      318.05     78.1437      72.3012    78.1437      
1 1 1 -3  9  23 o 0 63      18.7  ?     ?   126.186   71.7213      190.321    71.7213      71.4484    71.7213      
1 1 1 -3  9  22 o 0 314.2   21.5  ?     ?   299.116   -166.594     520.18     -166.594     225.423    -166.594     
1 1 1 -3  9  21 o 0 3.6     15.1  ?     ?   84.898    -49.9734     6.46267    130.027      90.3664    130.027      
1 1 1 -3  9  20 o 0 29.8    14.2  ?     ?   76.7047   4.70962      60.4224    4.70962      9.49759    -175.29      
1 1 1 -3  9  19 o 0 22.4    12.7  ?     ?   131.55    75.6364      23.4127    75.6364      97.1969    -104.364     
1 1 1 -3  9  18 o 0 1.1     12.9  ?     ?   160.4     125.657      74.9731    -54.3427     227.17     -54.3427     
1 1 1 -3  9  17 o 0 25.5    11.5  ?     ?   186.778   -170.559     14.3019    9.44058      196.112    9.44058      
1 1 1 -3  9  16 f 1 18.2    9.9   ?     ?   126.672   34.2604      39.1945    -145.74      166.378    -145.74      
1 1 1 -3  9  15 o 0 330.3   13.1  ?     ?   436.927   37.7641      404.33     37.7641      35.5348    -142.236     
1 1 1 -3  9  14 f 1 71.7    9.2   ?     ?   73.6747   132.506      83.4284    132.506      16.9145    132.506      
1 1 1 -3  9  13 f 1 195.7   8.9   ?     ?   373.276   -126.725     217.012    -126.725     119.36     53.2753      
1 1 1 -3  9  12 o 0 84.7    6.8   ?     ?   50.8306   22.5441      57.7692    22.5441      11.9063    22.5441      
1 1 1 -3  9  11 o 0 3.8     6.9   ?     ?   12.5892   49.3669      9.95653    -130.633     21.6256    -130.633     
1 1 1 -3  9  10 o 0 27.8    5.7   ?     ?   204.612   -51.5933     80.009     128.407      270.689    128.407      
1 1 1 -3  9  9  o 0 332.3   10.1  ?     ?   191.615   23.0774      498.588    23.0774      316.978    23.0774      
1 1 1 -3  9  8  o 0 57.9    5.4   ?     ?   166.018   -112.669     21.9146    -112.67      131.964    67.3305      
1 1 1 -3  9  7  o 0 784     20.9  ?     ?   464.296   111.964      739.556    111.964      307.585    111.964      
1 1 1 -3  9  6  o 0 268.2   9     ?     ?   395.978   61.3052      286.437    61.3052      88.0328    -118.695     
1 1 1 -3  9  5  o 0 58.4    4.9   ?     ?   234.18    -70.5464     4.94052    -70.5464     217.106    109.454      
1 1 1 -3  9  4  f 1 330.6   10.3  ?     ?   307.292   -165.01      433.75     -165.01      140.272    -165.01      
1 1 1 -3  9  3  o 0 126.3   4.3   ?     ?   302.429   66.1062      129.903    66.1062      157.892    -113.894     
1 1 1 -3  9  2  o 0 912.2   25    ?     ?   695.691   -112.792     635.975    -112.792     26.7031    67.2078      
1 1 1 -3  9  1  f 1 305.3   9     ?     ?   190.425   -44.1446     465.68     -44.1446     283.274    -44.1446     
1 1 1 3   9  0  o 0 106.7   4.2   ?     ?   345.626   -125.531     58.9236    -125.531     270.345    54.4685      
1 1 1 3   9  1  f 1 180     5.7   ?     ?   136.962   -156.373     275.707    -156.373     144.51     -156.373     
1 1 1 3   9  2  o 0 2090.7  37.7  ?     ?   1022.91   82.9652      1017.52    82.9652      42.804     82.9652      
1 1 1 3   9  3  o 0 2055.3  36.9  ?     ?   757.61    -106.036     1245.19    -106.036     523.722    -106.036     
1 1 1 3   9  4  f 1 736.4   14.7  ?     ?   785.799   -51.6648     414.644    -51.6648     336.649    128.335      
1 1 1 3   9  5  o 0 621.4   12.6  ?     ?   750.133   -23.8104     353.283    -23.8104     359.026    156.19       
1 1 1 3   9  6  o 0 36.8    4.6   ?     ?   274.183   -103.395     86.5057    76.6051      346.274    76.6051      
1 1 1 3   9  7  o 0 772.4   15.3  ?     ?   704.342   69.4647      525.031    69.4647      131.726    -110.535     
1 1 1 3   9  8  o 0 569.4   12.6  ?     ?   525.884   98.4787      507.175    98.4787      18.4839    98.4787      
1 1 1 3   9  9  o 0 400.8   10.8  ?     ?   603.139   50.849       279.85     50.849       293.483    -129.151     
1 1 1 3   9  10 o 0 118.4   7.8   ?     ?   237.602   9.0513       151.649    9.0513       70.5065    -170.949     
1 1 1 3   9  11 o 0 86.3    7.3   ?     ?   190.557   16.0542      92.2242    16.0542      85.0505    -163.946     
1 1 1 3   9  12 o 0 278.8   11.5  ?     ?   415.774   -65.0957     307.169    -65.0957     69.4685    114.904      
1 1 1 3   9  13 f 1 106.5   10.1  ?     ?   192.765   46.3647      157.376    46.3647      17.0822    -133.635     
1 1 1 3   9  14 f 1 646.8   20.9  ?     ?   527.502   168.738      592.665    168.738      114.22     168.738      
1 1 1 3   9  15 o 0 561     16.5  ?     ?   423.731   162.949      685.316    162.949      256.617    162.949      
1 1 1 3   9  16 f 1 13.4    10.7  ?     ?   173.493   72.3897      83.5092    -107.61      258.623    -107.61      
1 1 1 3   9  17 o 0 214.4   13.2  ?     ?   293.455   12.2379      373.88     12.2379      86.6342    12.2379      
1 1 1 3   9  18 o 0 14      12.3  ?     ?   159.212   -129.586     35.2962    50.4139      187.256    50.4139      
1 1 1 3   9  19 o 0 61.9    15.4  ?     ?   144.975   -162.353     172.288    -162.353     38.5458    -162.353     
1 1 1 3   9  20 o 0 133     15.5  ?     ?   299.049   126.483      231.996    126.483      42.3743    -53.5173     
1 1 1 3   9  21 o 0 69.9    18.3  ?     ?   238.662   112.903      130.094    112.903      107.378    -67.0965     
1 1 1 3   9  22 o 0 214.7   29.1  ?     ?   197.832   126.721      459.545    126.721      263.21     126.721      
1 1 1 3   9  23 o 0 27.6    21.6  ?     ?   104.773   -161.689     71.985     -161.689     27.4468    18.3108      
1 1 1 3   9  24 o 0 22.5    24.6  ?     ?   85.0341   97.4804      82.3014    97.4804      5.15783    97.4804      
1 1 1 3   9  25 < 0 59.5    27.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  11 23 < 0 75.1    22.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  11 22 o 0 18.9    17.6  ?     ?   42.8544   -97.5693     51.5613    -97.5693     13.8301    -97.5693     
1 1 1 -3  11 21 f 1 335.8   22.4  ?     ?   349.161   -5.41024     500.577    -5.41024     184.175    -5.41024     
1 1 1 -3  11 20 o 0 276.1   23.4  ?     ?   369.002   -16.7677     388.683    -16.7677     33.5114    -16.7677     
1 1 1 -3  11 19 o 0 202.3   18.6  ?     ?   257.269   -58.2837     387.34     -58.2837     139.163    -58.2837     
1 1 1 -3  11 18 o 0 32      15.7  ?     ?   107.042   -107.421     74.6557    -107.421     21.3517    72.5791      
1 1 1 -3  11 17 o 0 91.5    13.9  ?     ?   156.806   -154.699     241.804    -154.699     101.149    -154.699     
1 1 1 -3  11 16 o 0 226     12.7  ?     ?   328.881   110.379      366.988    110.379      70.6237    110.379      
1 1 1 -3  11 15 o 0 126     10.6  ?     ?   234.124   124.293      262.12     124.293      44.0417    124.293      
1 1 1 -3  11 14 o 0 85.1    10.4  ?     ?   145.858   19.3825      212.691    19.3825      73.491     19.3825      
1 1 1 -3  11 13 o 0 52.1    7.6   ?     ?   155.686   126.529      114.131    126.529      35.4852    -53.4709     
1 1 1 -3  11 12 o 0 177.2   9     ?     ?   196.32    53.4455      364.78     53.4455      171.516    53.4455      
1 1 1 -3  11 11 o 0 304.4   10.4  ?     ?   379.501   -7.54286     415.965    -7.54286     40.1342    -7.54286     
1 1 1 -3  11 10 o 0 452.9   12.4  ?     ?   261.409   46.9594      611.373    46.9594      380.837    46.9594      
1 1 1 -3  11 9  o 0 40.1    6.3   ?     ?   231.13    -58.32       12.5054    121.68       217.351    121.68       
1 1 1 -3  11 8  o 0 115.7   6.4   ?     ?   363.113   -110.48      83.2456    -110.48      237.2      69.52        
1 1 1 -3  11 7  o 0 150.6   6.4   ?     ?   283.275   -78.3898     202.674    -78.3898     48.2944    101.61       
1 1 1 -3  11 6  o 0 1042.7  21.2  ?     ?   662.749   1.33589      770.722    1.33589      181.564    1.33589      
1 1 1 -3  11 5  f 1 45.6    5.2   ?     ?   484.509   -105.986     201.573    74.0139      644.975    74.0139      
1 1 1 -3  11 4  o 0 71.5    5.3   ?     ?   220.507   -11.3707     46.0614    -11.3707     155.176    168.629      
1 1 1 -3  11 3  o 0 68.4    5.8   ?     ?   217.062   130.037      39.1509    130.037      159.306    -49.9631     
1 1 1 -3  11 2  o 0 4515.4  89    ?     ?   1146.8    -144.904     1841.66    -144.904     791.768    -144.904     
1 1 1 -3  11 1  o 0 704.2   17.8  ?     ?   705.162   56.9916      474.639    56.9916      171.485    -123.008     
1 1 1 3   11 0  o 0 53.6    5     ?     ?   86.2041   103.698      17.1973    103.698      61.8614    -76.3024     
1 1 1 3   11 1  o 0 1324    26.7  ?     ?   598.399   -138.1       995.209    -138.1       446.459    -138.1       
1 1 1 3   11 2  o 0 369.7   11    ?     ?   451.672   -78.5233     371.578    -78.5233     42.3916    101.477      
1 1 1 3   11 3  o 0 367.5   10.2  ?     ?   290.133   141.912      487.447    141.912      221.804    141.912      
1 1 1 3   11 4  o 0 736.3   18.9  ?     ?   463.291   159.723      704.009    159.723      280.468    159.723      
1 1 1 3   11 5  f 1 537.6   14.3  ?     ?   648.909   36.4931      373.489    36.4931      221.59     -143.507     
1 1 1 3   11 6  o 0 1153.1  26.5  ?     ?   826.241   158.038      704.176    158.038      32.0715    -21.9622     
1 1 1 3   11 7  o 0 65.2    6.5   ?     ?   296.223   23.8435      10.19      23.8435      252.961    -156.157     
1 1 1 3   11 8  o 0 533.7   13.3  ?     ?   573.762   -45.16       448.072    -45.16       59.8068    134.84       
1 1 1 3   11 9  o 0 119.8   7.5   ?     ?   180.371   28.8833      212.187    28.8833      51.7907    28.8833      
1 1 1 3   11 10 o 0 53      7.7   ?     ?   432.93    -18.4239     111.161    161.576      494.369    161.576      
1 1 1 3   11 11 o 0 284.5   10.3  ?     ?   484.649   -167.231     292.988    -167.231     188.894    12.7692      
1 1 1 3   11 12 o 0 298.4   12.8  ?     ?   539.455   159.289      258.756    159.289      274.594    -20.7109     
1 1 1 3   11 13 o 0 144.1   11.3  ?     ?   345.738   32.9951      199.707    32.9951      134.09     -147.005     
1 1 1 3   11 14 o 0 90      9.2   ?     ?   186.966   154.835      205.742    154.835      26.4282    154.835      
1 1 1 3   11 15 o 0 60.4    12.8  ?     ?   113.456   -81.3959     166.73     -81.3959     60.4949    -81.3959     
1 1 1 3   11 16 o 0 138.4   13.7  ?     ?   264.704   79.6845      270.077    79.6845      30.2202    79.6845      
1 1 1 3   11 17 o 0 133.4   16.2  ?     ?   174.489   143.115      322.973    143.115      165.541    143.115      
1 1 1 3   11 18 o 0 67.1    17.3  ?     ?   152.844   -174.849     179.967    -174.849     42.0351    -174.849     
1 1 1 3   11 19 o 0 36.8    15.6  ?     ?   155.598   75.1248      77.52      75.1248      73.5488    -104.875     
1 1 1 3   11 20 o 0 5.8     21.5  ?     ?   62.9431   -58.7319     26.0752    -58.7319     32.8648    121.268      
1 1 1 3   11 21 f 1 39.6    21.2  ?     ?   17.0584   131.678      48.2535    131.678      32.6863    131.678      
1 1 1 3   11 22 o 0 92.5    22.2  ?     ?   118.188   148.699      279.791    148.699      174.966    148.699      
1 1 1 3   11 23 < 0 5.6     23.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  13 21 < 0 53.1    25.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  13 20 f 1 103.9   22.7  ?     ?   277.203   84.9134      176.277    84.9134      61.9672    -95.0866     
1 1 1 -3  13 19 o 0 28.5    23.6  ?     ?   161.132   68.6003      54.2507    68.6003      84.5793    -111.4       
1 1 1 -3  13 18 o 0 -8.6    18.6  ?     ?   38.5019   135.772      3.65603    135.772      30.2726    -44.2283     
1 1 1 -3  13 17 o 0 -24.2   17.1  ?     ?   16.2702   -106.67      4.891      73.3298      19.6657    73.3298      
1 1 1 -3  13 16 o 0 66.1    15.3  ?     ?   151.798   14.7655      184.497    14.7655      40.6325    14.7655      
1 1 1 -3  13 15 o 0 182.9   15.4  ?     ?   332.5     171.21       284.458    171.21       30.8384    -8.78983     
1 1 1 -3  13 14 f 1 96      13.1  ?     ?   210.577   -164.859     212.653    -164.859     26.3565    -164.859     
1 1 1 -3  13 13 o 0 30.7    11.2  ?     ?   46.367    165.534      48.4169    165.534      7.67337    165.534      
1 1 1 -3  13 12 o 0 75.2    9.9   ?     ?   184.435   -58.0731     182.49     -58.0731     19.9642    -58.0731     
1 1 1 -3  13 11 o 0 -5.2    9.3   ?     ?   127.807   -94.5565     74.3054    85.4435      187.62     85.4435      
1 1 1 -3  13 10 f 1 124.5   10.7  ?     ?   172.763   25.0572      296.521    25.0572      137.742    25.0572      
1 1 1 -3  13 9  o 0 108.5   8.4   ?     ?   400.52    153.472      84.5202    153.472      283.574    -26.5278     
1 1 1 -3  13 8  o 0 431.8   12.3  ?     ?   370.412   -144.143     574.824    -144.143     227.018    -144.143     
1 1 1 -3  13 7  f 1 23.5    6.8   ?     ?   70.3914   -164.742     16.8948    -164.742     49.8139    15.2583      
1 1 1 -3  13 6  o 0 154.3   7.2   ?     ?   306.236   80.2094      235.101    80.2094      59.8217    -99.7906     
1 1 1 -3  13 5  o 0 49      6.1   ?     ?   177.53    -169.615     69.2897    -169.615     102.214    10.3847      
1 1 1 -3  13 4  o 0 324.9   10.9  ?     ?   303.744   153.117      498.454    153.117      204.255    153.117      
1 1 1 -3  13 3  o 0 62.6    5.8   ?     ?   327.722   -1.67382     8.53649    -1.67382     309.561    178.326      
1 1 1 -3  13 2  o 0 33.6    7     ?     ?   200.17    -12.068      0.106266   -12.068      194.505    167.932      
1 1 1 -3  13 1  o 0 61.5    6.2   ?     ?   162.814   135.848      116.295    135.848      42.1829    -44.1524     
1 1 1 3   13 0  o 0 210.5   8.2   ?     ?   177.503   -43.943      380.712    -43.943      226.904    -43.943      
1 1 1 3   13 1  o 0 705.9   17.4  ?     ?   421.584   8.75774      796.755    8.75774      385.78     8.75774      
1 1 1 3   13 2  o 0 200.3   8.1   ?     ?   348.657   75.1181      282.598    75.1181      56.9802    -104.882     
1 1 1 3   13 3  o 0 170.1   7.8   ?     ?   245.154   -76.0279     314.748    -76.0279     76.3027    -76.0279     
1 1 1 3   13 4  o 0 18.4    5.7   ?     ?   26.1853   88.4886      4.64715    -91.5114     30.0691    -91.5114     
1 1 1 3   13 5  o 0 274.1   9.1   ?     ?   334.455   -7.11433     404.657    -7.11433     80.7066    -7.11433     
1 1 1 3   13 6  o 0 77.9    7     ?     ?   80.8353   146.173      147.551    146.173      69.4753    146.173      
1 1 1 3   13 7  f 1 192.4   8.8   ?     ?   288.97    -1.26422     329.094    -1.26422     54.3621    -1.26422     
1 1 1 3   13 8  o 0 40.9    7.7   ?     ?   113.479   -45.0789     82.4684    -45.0789     24.459     134.921      
1 1 1 3   13 9  o 0 36.3    8.2   ?     ?   172.85    -30.2213     61.4175    -30.2213     98.0429    149.779      
1 1 1 3   13 10 f 1 106.9   10.3  ?     ?   185.85    101.001      251.83     101.001      80.3232    101.001      
1 1 1 3   13 11 o 0 38.8    11.4  ?     ?   237.109   94.8994      34.3234    94.8994      176.822    -85.1006     
1 1 1 3   13 12 o 0 4       10.3  ?     ?   8.04755   -85.575      2.4837     94.425       9.60854    94.425       
1 1 1 3   13 13 o 0 263.4   15.9  ?     ?   333.085   -90.547      406.637    -90.547      112.489    -90.547      
1 1 1 3   13 14 f 1 75.8    15.6  ?     ?   196.417   16.8035      173.016    16.8035      1.67015    -163.197     
1 1 1 3   13 15 o 0 23.4    16    ?     ?   102.519   29.0259      50.189     29.0259      47.5673    -150.974     
1 1 1 3   13 16 o 0 -14.8   16.2  ?     ?   148.948   56.9296      63.784     -123.07      205.775    -123.07      
1 1 1 3   13 17 o 0 63.6    22    ?     ?   159.869   -46.2166     158.743    -46.2166     12.6748    -46.2166     
1 1 1 3   13 18 o 0 69.3    22.1  ?     ?   70.6294   25.308       213.84     25.308       151.198    25.308       
1 1 1 3   13 19 o 0 56.6    19.4  ?     ?   168.747   68.2196      140.432    68.2196      5.94087    -111.78      
1 1 1 3   13 20 < 1 2       17.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  15 17 < 0 83.9    23.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  15 16 o 0 41      19.4  ?     ?   150.509   101.116      100.007    101.116      25.7627    -78.8845     
1 1 1 -3  15 15 f 1 52.4    15    ?     ?   158.965   69.0836      143.202    69.0835      8.88815    69.0835      
1 1 1 -3  15 14 o 0 40.3    17.5  ?     ?   136.109   -65.1711     103.258    -65.1711     13.5642    114.829      
1 1 1 -3  15 13 o 0 132.4   18.4  ?     ?   206.589   -65.5612     287.343    -65.5612     104.936    -65.5612     
1 1 1 -3  15 12 o 0 47.5    14.7  ?     ?   145.019   -63.0447     124.798    -63.0447     4.1144     116.955      
1 1 1 -3  15 11 o 0 109.7   12.7  ?     ?   171.004   74.5702      274.648    74.5702      116.351    74.5702      
1 1 1 -3  15 10 o 0 122     12.9  ?     ?   319.743   -165.751     177.66     -165.751     117.824    14.2492      
1 1 1 -3  15 9  o 0 224.2   11.5  ?     ?   200.363   -165.001     457.67     -165.001     271.524    -165.001     
1 1 1 -3  15 8  f 1 265.1   11.4  ?     ?   309.207   87.2094      413.687    87.2094      146.413    87.2094      
1 1 1 -3  15 7  o 0 361.2   13.1  ?     ?   443.3     125.994      424.796    125.994      41.9225    125.994      
1 1 1 -3  15 6  o 0 26      8.6   ?     ?   122.949   124.335      44.6482    124.335      61.0239    -55.665      
1 1 1 -3  15 5  o 0 79.8    7.6   ?     ?   257.23    6.0158       139.585    6.0158       82.2399    -173.984     
1 1 1 -3  15 4  f 1 14      7.9   ?     ?   189.316   -15.6132     48.0586    164.387      212.628    164.387      
1 1 1 -3  15 3  f 1 81.5    8.2   ?     ?   349.889   -166.845     69.9206    -166.845     234.96     13.1554      
1 1 1 -3  15 2  o 0 14.7    8.2   ?     ?   142.418   108.821      19.3964    -71.1791     142.633    -71.1791     
1 1 1 -3  15 1  o 0 221.5   10.2  ?     ?   239.915   3.45647      415.946    3.45647      208.041    3.45647      
1 1 1 3   15 0  o 0 146.9   8.3   ?     ?   231.432   -61.1314     301.562    -61.1314     100.43     -61.1314     
1 1 1 3   15 1  o 0 22.7    8.3   ?     ?   15.0885   -45.7404     9.29475    -45.7404     3.80838    134.26       
1 1 1 3   15 2  o 0 89.7    8.1   ?     ?   224.347   -30.7156     188.787    -30.7156     5.80528    149.284      
1 1 1 3   15 3  f 1 44.6    7.9   ?     ?   308.127   128.615      0.118892   -51.385      269.318    -51.385      
1 1 1 3   15 4  f 1 8.6     8.1   ?     ?   122.421   -70.8842     37.5221    109.116      144.249    109.116      
1 1 1 3   15 5  o 0 3.3     7.5   ?     ?   80.4603   -100.989     35.9968    79.0114      105.602    79.0114      
1 1 1 3   15 6  o 0 17.5    9     ?     ?   161.851   101.89       13.1757    -78.1096     152.76     -78.1096     
1 1 1 3   15 7  o 0 18.1    9.8   ?     ?   82.5119   -4.74762     21.8337    -4.74762     49.6949    175.252      
1 1 1 3   15 8  f 1 51.9    10.6  ?     ?   73.9166   -50.3534     148.011    -50.3534     83.8639    -50.3534     
1 1 1 3   15 9  o 0 77.5    10.8  ?     ?   139.442   84.2662      222.826    84.2662      92.7282    84.2662      
1 1 1 3   15 10 o 0 24.6    12.3  ?     ?   160.342   28.6353      24.2892    28.6353      124.559    -151.365     
1 1 1 3   15 11 o 0 43.5    12.7  ?     ?   38.9473   158.081      108.753    158.081      72.5263    158.081      
1 1 1 3   15 12 o 0 11.9    15.1  ?     ?   46.2429   132.934      18.9948    132.934      22.3209    -47.0655     
1 1 1 3   15 13 o 0 44.6    15.7  ?     ?   155.894   106.914      103.589    106.914      34.7948    -73.0858     
1 1 1 3   15 14 o 0 88.4    16    ?     ?   226.354   99.7859      187.492    99.7859      7.88459    -80.2141     
1 1 1 3   15 15 f 1 177.6   21.9  ?     ?   283.66    129.845      312.673    129.845      71.5805    129.845      
1 1 1 3   15 16 o 0 37.9    18.5  ?     ?   179.691   -120.1       70.8373    -120.1       80.2495    59.9         
1 1 1 3   15 17 < 0 78.9    24.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  17 11 < 0 57.2    20    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -3  17 10 o 0 78.2    17.1  ?     ?   190.511   147.717      185.717    147.717      30.3906    147.717      
1 1 1 -3  17 9  o 0 12.9    14    ?     ?   60.0686   13.478       45.3798    13.478       3.8653     -166.522     
1 1 1 -3  17 8  o 0 78.8    14.7  ?     ?   154.486   25.737       215.491    25.737       88.4887    25.737       
1 1 1 -3  17 7  f 1 297     16.4  ?     ?   322.754   1.87908      447.394    1.87908      179.481    1.87908      
1 1 1 -3  17 6  o 0 55.6    12.3  ?     ?   138.165   147.317      162.769    147.317      46.6893    147.317      
1 1 1 -3  17 5  o 0 167.5   13.6  ?     ?   306.922   -13.0231     276.99     -13.0231     18.2022    -13.0231     
1 1 1 -3  17 4  o 0 648.6   20.2  ?     ?   551.802   25.5791      614.47     25.5791      147.754    25.5791      
1 1 1 -3  17 3  o 0 72.1    12.9  ?     ?   218.623   62.7103      146.79     62.7103      42.56      -117.29      
1 1 1 -3  17 2  o 0 45.5    12.7  ?     ?   109.283   -120.701     141.955    -120.701     47.0984    -120.701     
1 1 1 -3  17 1  o 0 129.3   12.9  ?     ?   229.846   -100.871     267.746    -100.871     67.8983    -100.871     
1 1 1 3   17 0  o 0 37.5    11.7  ?     ?   129.091   137.941      108.312    137.941      4.34878    -42.0588     
1 1 1 3   17 1  o 0 128.4   12.9  ?     ?   168.492   95.0218      312.503    95.0218      165.608    95.0218      
1 1 1 3   17 2  o 0 -5.6    11.2  ?     ?   120.905   18.1459      48.5818    -161.854     153.834    -161.854     
1 1 1 3   17 3  o 0 123.7   12.3  ?     ?   242.526   46.8912      245.067    46.8912      34.3481    46.8912      
1 1 1 3   17 4  o 0 27.6    12.3  ?     ?   143.936   -42.8232     58.0123    -42.8232     64.1455    137.177      
1 1 1 3   17 5  o 0 45.5    12.8  ?     ?   215.737   -161.571     79.0361    -161.571     103.535    18.4285      
1 1 1 3   17 6  o 0 112.8   14.2  ?     ?   205.992   -155.429     253.68     -155.429     79.9364    -155.429     
1 1 1 3   17 7  f 1 87.1    14.7  ?     ?   157.129   -96.2974     234.622    -96.2974     103.648    -96.2974     
1 1 1 3   17 8  o 0 184.7   14.3  ?     ?   345.225   -33.2845     276.486    -33.2845     8.57988    146.716      
1 1 1 3   17 9  o 0 68.2    16.6  ?     ?   235.363   -29.1668     128.687    -29.1668     65.1722    150.833      
1 1 1 3   17 10 < 0 18.5    21.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 3   17 11 < 0 12.6    15.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  0  28 o 0 40.7    30.2  ?     ?   165.462   180          113.222    180          43.524     1.82531e-14  
1 1 1 -4  0  27 o 0 67.8    28.4  ?     ?   308.192   180          168.128    180          137.443    8.58324e-15  
1 1 1 -4  0  26 o 0 -4.4    24.6  ?     ?   54.784    0            20.6469    0            36.1876    180          
1 1 1 -4  0  25 o 0 21.8    21.3  ?     ?   54.9326   0            31.8191    0            20.8473    180          
1 1 1 -4  0  24 o 0 34.6    20.6  ?     ?   202.626   180          106.074    180          88.5011    8.40996e-15  
1 1 1 -4  0  23 o 0 179.7   22.9  ?     ?   579.537   180          324.869    180          249.385    9.1405e-15   
1 1 1 -4  0  22 o 0 101.3   17.1  ?     ?   302.937   180          244.928    180          63.2793    2.71588e-14  
1 1 1 -4  0  21 o 0 24.4    14.7  ?     ?   207.521   0            67.9078    0            148.955    180          
1 1 1 -4  0  20 o 0 138.3   15.7  ?     ?   277.646   0            256.915    0            2.32061    180          
1 1 1 -4  0  19 f 1 15.1    13.1  ?     ?   420.569   180          46.3561    180          348.21     9.34112e-16  
1 1 1 -4  0  18 o 0 613.9   24.7  ?     ?   707.027   180          563.461    180          115.894    3.41142e-14  
1 1 1 -4  0  17 o 0 234     19.8  ?     ?   259.831   180          336.741    180          82.1381    180          
1 1 1 -4  0  16 o 0 1589.4  41.8  ?     ?   863.116   0            896.368    0            66.9355    0            
1 1 1 -4  0  15 o 0 303.7   13.9  ?     ?   482.777   0            394.209    0            79.0194    180          
1 1 1 -4  0  14 o 0 1222.9  34.1  ?     ?   611.008   0            796.613    0            193.911    0            
1 1 1 -4  0  13 o 0 153.5   8.4   ?     ?   69.7443   180          130.846    180          58.8594    180          
1 1 1 -4  0  12 o 0 1116.4  28.5  ?     ?   441.779   180          810.462    180          352.007    180          
1 1 1 -4  0  11 o 0 1028.7  26.9  ?     ?   637.201   0            799.733    0            119.939    0            
1 1 1 -4  0  10 o 0 1628.6  40.5  ?     ?   838.849   0            1010.61    0            119.435    0            
1 1 1 -4  0  9  o 0 1358.2  35.1  ?     ?   821.113   0            855.94     0            46.9578    0            
1 1 1 -4  0  8  o 0 2953.9  71.6  ?     ?   1311.14   0            1266.34    0            29.9042    180          
1 1 1 -4  0  7  o 0 4649.9  111.2 ?     ?   1635.02   0            1530.69    0            27.0132    180          
1 1 1 -4  0  6  o 0 1240.9  31.9  ?     ?   910.327   180          793.017    180          76.2034    7.302e-14    
1 1 1 -4  0  5  o 0 407.6   15.6  ?     ?   427.64    180          444.774    180          45.0122    180          
1 1 1 -4  0  4  o 0 1147.2  29.2  ?     ?   723.467   0            732.368    0            68.9178    0            
1 1 1 -4  0  3  o 0 4158.5  198.3 ?     ?   1598.65   0            1389.52    0            74.694     180          
1 1 1 -4  0  2  o 0 955.8   23.8  ?     ?   477.767   0            665.088    0            229.217    0            
1 1 1 4   0  1  o 0 7.1     0.8   ?     ?   151.149   0            11.9781    0            126.044    180          
1 1 1 4   0  3  o 0 655.2   16.9  ?     ?   569.613   180          557.401    180          31.3772    180          
1 1 1 4   0  4  o 0 240.8   7     ?     ?   247.525   0            326.75     0            98.1027    0            
1 1 1 4   0  5  o 0 79.7    3.3   ?     ?   332.787   0            181.814    0            131.338    180          
1 1 1 4   0  6  o 0 17.9    2.5   ?     ?   50.9549   0            10.7646    0            38.1903    180          
1 1 1 4   0  7  o 0 2883.9  70.1  ?     ?   1153.36   180          1212.99    180          107.671    180          
1 1 1 4   0  8  o 0 467.9   13.6  ?     ?   652.541   0            507.124    0            141.733    180          
1 1 1 4   0  9  o 0 228.5   8     ?     ?   376.415   180          380.463    180          23.3254    1.14451e-13  
1 1 1 4   0  11 o 0 617.4   26    ?     ?   889.597   180          622.811    180          331.769    1.31721e-14  
1 1 1 4   0  12 o 0 528     18.3  ?     ?   648.459   180          560.569    180          116.356    3.38045e-14  
1 1 1 4   0  13 o 0 19.4    9     ?     ?   225.71    180          41.7192    180          192.662    1.51941e-15  
1 1 1 4   0  14 o 0 114.8   12    ?     ?   218.104   180          205.81     180          10.6716    1.35323e-13  
1 1 1 4   0  15 o 0 565.7   22    ?     ?   463.464   180          541.708    180          84.4896    180          
1 1 1 4   0  16 o 0 128.7   17    ?     ?   56.1789   180          78.2035    180          23.8583    180          
1 1 1 4   0  17 o 0 47.4    13.8  ?     ?   152.969   180          71.2882    180          77.828     6.4271e-15   
1 1 1 4   0  18 o 0 107.2   21    ?     ?   415.687   180          226.665    180          175.6      9.05722e-15  
1 1 1 4   0  19 f 1 75.5    20.9  ?     ?   458.951   180          185.117    180          248.64     5.22407e-15  
1 1 1 4   0  20 o 0 106.4   15.4  ?     ?   234.416   180          216.392    180          4.1585     3.65123e-13  
1 1 1 4   0  21 o 0 65      22.9  ?     ?   58.2356   180          72.2475    180          10.9059    180          
1 1 1 4   0  22 o 0 -12.6   18.2  ?     ?   33.1134   0            3.9069     0            30.0609    180          
1 1 1 4   0  23 o 0 39.2    20.2  ?     ?   238.792   0            122.931    0            115.715    180          
1 1 1 4   0  24 o 0 35.3    32.3  ?     ?   83.4787   0            63.043     0            17.8333    180          
1 1 1 4   0  25 o 0 -3      27    ?     ?   49.0532   0            16.4451    0            31.0197    180          
1 1 1 4   0  26 o 0 156.4   40.3  ?     ?   363.228   0            294.215    0            86.2286    180          
1 1 1 4   0  27 o 0 28.8    35.4  ?     ?   150.076   0            90.5893    0            59.695     180          
1 1 1 -4  2  28 o 0 25.5    21.2  ?     ?   74.4442   170.521      106.499    170.521      36.38      170.521      
1 1 1 -4  2  27 o 0 93.6    19.9  ?     ?   107.082   57.5616      307.366    57.5616      204.201    57.5616      
1 1 1 -4  2  26 o 0 129     21.5  ?     ?   142.997   -18.5912     364.159    -18.5912     216.891    -18.5912     
1 1 1 -4  2  25 o 0 41.9    16.3  ?     ?   121.105   -108.299     120.173    -108.299     0.708168   71.7007      
1 1 1 -4  2  24 o 0 48.3    14.3  ?     ?   173.386   104.718      116.293    104.718      49.1026    -75.2819     
1 1 1 -4  2  23 f 1 204.2   14.8  ?     ?   397.821   24.8483      290.252    24.8483      93.6807    -155.152     
1 1 1 -4  2  22 o 0 145.3   11.3  ?     ?   342.893   -48          214.197    -48          132.593    132          
1 1 1 -4  2  21 o 0 223.4   11.8  ?     ?   532.775   -90.3756     162.842    -90.3756     390.813    89.6244      
1 1 1 -4  2  20 o 0 92.3    8.9   ?     ?   202.005   -161.264     151.81     -161.264     35.817     18.7363      
1 1 1 -4  2  19 o 0 162.8   9.5   ?     ?   253.218   -95.8596     252.15     -95.8596     16.945     -95.8596     
1 1 1 -4  2  18 o 0 1055.3  22.5  ?     ?   661.223   -131.272     804.882    -131.272     172.36     -131.272     
1 1 1 -4  2  17 o 0 838.3   19.7  ?     ?   633.655   -107.693     675.136    -107.693     64.1335    -107.693     
1 1 1 -4  2  16 o 0 404.5   13.2  ?     ?   355.073   176.075      495.808    176.075      155.823    176.075      
1 1 1 -4  2  15 o 0 842.9   19.4  ?     ?   616.458   19.4632      673.029    19.4632      70.6684    19.4632      
1 1 1 -4  2  14 o 0 4929    83.9  ?     ?   1391.24   -17.5042     1805.27    -17.5042     436.595    -17.5042     
1 1 1 -4  2  13 o 0 2106.1  37    ?     ?   1030.41   -160.188     1127.1     -160.188     65.8376    -160.188     
1 1 1 -4  2  12 o 0 653     16.4  ?     ?   666.31    153.279      513.784    153.279      176.599    -26.721      
1 1 1 -4  2  11 o 0 716.2   15.8  ?     ?   457.146   -37.278      777.539    -37.278      301.224    -37.278      
1 1 1 -4  2  10 o 0 835     15.9  ?     ?   607.602   -22.5114     762.867    -22.5114     117.498    -22.5114     
1 1 1 -4  2  9  o 0 152.1   4.5   ?     ?   347.167   118.288      176.936    118.288      193.584    -61.7117     
1 1 1 -4  2  8  o 0 2288.2  40.3  ?     ?   1014.49   73.6461      1206.98    73.6461      202.448    73.6461      
1 1 1 -4  2  7  o 0 330.9   7.1   ?     ?   471.813   -45.2813     335.777    -45.2813     133.287    134.719      
1 1 1 -4  2  6  o 0 558.8   10.7  ?     ?   618.652   33.4583      440.918    33.4583      152.203    -146.542     
1 1 1 -4  2  5  o 0 1759.4  30.9  ?     ?   921.181   54.4499      993.263    54.4499      107.306    54.4499      
1 1 1 -4  2  4  o 0 4894.9  88    ?     ?   1528.42   -104.123     1654.2     -104.123     213.414    -104.123     
1 1 1 -4  2  3  o 0 5308.4  125.7 ?     ?   1806.76   -90.5597     1493.89    -90.5597     179.306    89.4403      
1 1 1 -4  2  2  o 0 2660.8  57.4  ?     ?   1061.57   -106.406     1250.6     -106.406     266.911    -106.406     
1 1 1 -4  2  1  o 0 375.6   8.5   ?     ?   92.3848   -93.9787     490.771    -93.9787     405.256    -93.9787     
1 1 1 4   2  0  o 0 1063.3  20.1  ?     ?   848.781   129.54       605.758    129.54       169.79     -50.4598     
1 1 1 4   2  1  o 0 5485.3  181.4 ?     ?   1416.88   99.0015      1886.59    99.0015      584.484    99.0015      
1 1 1 4   2  2  o 0 1947.3  33.8  ?     ?   1018.3    -134.657     961.013    -134.657     21.0272    -134.657     
1 1 1 4   2  3  o 0 163.1   3.5   ?     ?   353.353   85.6262      168.237    85.6262      158.626    -94.3738     
1 1 1 4   2  4  o 0 2531    43.7  ?     ?   1277.16   175.738      1016.81    175.738      188.042    -4.26198     
1 1 1 4   2  5  o 0 726     13.1  ?     ?   614.624   137.88       597.189    137.88       4.86691    137.88       
1 1 1 4   2  6  o 0 627.3   11.8  ?     ?   516.946   117.356      596.786    117.356      99.7332    117.356      
1 1 1 4   2  7  o 0 396.8   8.1   ?     ?   498.056   140.702      394.917    140.702      101.992    -39.2977     
1 1 1 4   2  8  o 0 965.7   26.1  ?     ?   720.475   129.128      709.437    129.128      6.85137    -50.8722     
1 1 1 4   2  9  o 0 33.7    3.5   ?     ?   47.0445   -103.929     8.31201    76.0709      58.7444    76.0709      
1 1 1 4   2  10 o 0 5       2.8   ?     ?   117.404   64.7799      110.223    -115.22      235.524    -115.22      
1 1 1 4   2  11 o 0 975.5   20.3  ?     ?   604.803   -142.934     858.295    -142.934     224.897    -142.934     
1 1 1 4   2  12 o 0 549.7   11.9  ?     ?   394.102   56.5966      673.272    56.5966      262.71     56.5966      
1 1 1 4   2  13 o 0 2913.8  54.2  ?     ?   1169.16   -11.2428     1383.67    -11.2428     172.585    -11.2428     
1 1 1 4   2  14 o 0 172.7   9.3   ?     ?   349.654   138.697      188.474    138.697      157.584    -41.3032     
1 1 1 4   2  15 o 0 836.1   18    ?     ?   629.757   -9.55106     659.685    -9.55106     40.4335    -9.55106     
1 1 1 4   2  16 o 0 1064    29.2  ?     ?   678.309   -90.0524     783.902    -90.0524     130.109    -90.0524     
1 1 1 4   2  17 o 0 415.4   16.7  ?     ?   290.605   10.3814      572.329    10.3814      290.171    10.3814      
1 1 1 4   2  18 o 0 142     12.1  ?     ?   240.488   45.866       203.592    45.866       28.1225    -134.134     
1 1 1 4   2  19 o 0 166.8   10.8  ?     ?   125.746   -93.1327     275.121    -93.1327     157.439    -93.1327     
1 1 1 4   2  20 o 0 214.7   12.3  ?     ?   344.926   108.977      287.408    108.977      35.4909    -71.0234     
1 1 1 4   2  21 o 0 60.9    12.6  ?     ?   164.93    -107.005     120.359    -107.005     52.4409    72.9953      
1 1 1 4   2  22 o 0 61.6    13.8  ?     ?   314.868   109.747      30.0634    109.747      291.101    -70.2534     
1 1 1 4   2  23 f 1 256.1   16.7  ?     ?   369.037   84.4014      403.085    84.4014      43.7679    84.4014      
1 1 1 4   2  24 o 0 413.9   22.8  ?     ?   403.576   54.5956      577.331    54.5956      188.798    54.5956      
1 1 1 4   2  25 o 0 84      18.3  ?     ?   233.51    5.74377      187.147    5.74377      48.1705    -174.256     
1 1 1 4   2  26 o 0 -40.3   21.8  ?     ?   80.3964   -117.538     30.1021    62.4617      113.725    62.4617      
1 1 1 4   2  27 o 0 44.6    25.6  ?     ?   132.82    155.602      126.621    155.602      2.66639    -24.3979     
1 1 1 4   2  28 o 0 64.7    25.7  ?     ?   59.8403   -50.9034     228.252    -50.9034     171.283    -50.9034     
1 1 1 -4  4  28 < 0 32.5    23.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  4  27 o 0 69.3    20.7  ?     ?   152.234   71.3309      202.432    71.3309      59.9621    71.3309      
1 1 1 -4  4  26 o 0 84.4    20.5  ?     ?   158.481   -158.936     246.113    -158.936     90.8322    -158.936     
1 1 1 -4  4  25 o 0 243.7   20.9  ?     ?   291.376   -128.527     444.268    -128.527     147.688    -128.527     
1 1 1 -4  4  24 o 0 -7.3    15    ?     ?   137.698   -46.5191     56.521     133.481      187.059    133.481      
1 1 1 -4  4  23 o 0 17.9    17    ?     ?   61.7354   -101.766     21.4422    -101.766     36.9729    78.2341      
1 1 1 -4  4  22 o 0 128.3   14.5  ?     ?   290.372   64.089       231.673    64.089       52.9933    -115.911     
1 1 1 -4  4  21 o 0 98.4    11    ?     ?   295.254   98.7583      151.003    98.7583      146.281    -81.2417     
1 1 1 -4  4  20 o 0 108.7   12.4  ?     ?   250.933   149.028      198.637    149.028      60.9568    -30.9717     
1 1 1 -4  4  19 o 0 120.3   11.7  ?     ?   348.232   119.554      116.982    119.554      204.989    -60.4464     
1 1 1 -4  4  18 o 0 370.9   12.1  ?     ?   481.867   -26.4144     374.059    -26.4144     71.4581    153.586      
1 1 1 -4  4  17 o 0 1704.6  36.6  ?     ?   744.177   -49.1665     1122.38    -49.1665     413.847    -49.1665     
1 1 1 -4  4  16 o 0 806.3   18.2  ?     ?   430.34    -155.211     824.261    -155.211     411.279    -155.211     
1 1 1 -4  4  15 o 0 3100.5  59.8  ?     ?   1105.86   74.818       1408.47    74.818       354.711    74.818       
1 1 1 -4  4  14 o 0 104.2   8.2   ?     ?   120.485   53.9222      131.074    53.9222      13.92      53.9222      
1 1 1 -4  4  13 o 0 1308.8  24.7  ?     ?   734.757   -97.3959     887.42     -97.3959     168.168    -97.3959     
1 1 1 -4  4  12 o 0 589.5   14.6  ?     ?   457.51    -51.3375     638.087    -51.3375     163.59     -51.3375     
1 1 1 -4  4  11 o 0 573.7   12.2  ?     ?   640.502   174.755      459.233    174.755      201.004    -5.24526     
1 1 1 -4  4  10 o 0 924.4   17.8  ?     ?   608.867   116.91       805.401    116.91       174.333    116.91       
1 1 1 -4  4  9  o 0 67.7    3.6   ?     ?   156.569   150.994      67.3157    150.994      99.5251    -29.0065     
1 1 1 -4  4  8  f 1 81.7    4.4   ?     ?   173.198   -67.4668     102.872    -67.4668     81.8761    112.533      
1 1 1 -4  4  7  o 0 801.5   15.2  ?     ?   624.33    75.6137      719.123    75.6137      53.8671    75.6137      
1 1 1 -4  4  6  o 0 1266.5  22    ?     ?   726.175   -52.4459     910.026    -52.4459     192.788    -52.4459     
1 1 1 -4  4  5  o 0 1085.1  19.5  ?     ?   586.754   -85.684      919.734    -85.684      338.551    -85.684      
1 1 1 -4  4  4  o 0 1294.3  22.6  ?     ?   724.627   -165.231     934.216    -165.231     214.975    -165.231     
1 1 1 -4  4  3  o 0 512.6   9.6   ?     ?   453.631   -151.226     538.705    -151.226     105.544    -151.226     
1 1 1 4   4  0  o 0 1351.5  24.2  ?     ?   866.101   0.887855     798.023    0.887855     22.9044    -179.112     
1 1 1 4   4  1  o 0 546.3   10.9  ?     ?   531.357   67.8291      502.253    67.8291      2.70579    -112.171     
1 1 1 4   4  2  o 0 625.1   11.5  ?     ?   631.046   176.647      488.063    176.647      112.823    -3.35317     
1 1 1 4   4  3  o 0 196.2   4.9   ?     ?   488.751   17.6466      118.896    17.6466      346.987    -162.353     
1 1 1 4   4  4  o 0 371.1   7.4   ?     ?   523.411   118.009      339.063    118.009      180.18     -61.9915     
1 1 1 4   4  6  o 0 712.2   15    ?     ?   814.83    -118.76      411.787    -118.76      394.208    61.2396      
1 1 1 4   4  7  o 0 482.6   11.2  ?     ?   251.947   1.27383      738.405    1.27383      469.329    1.27383      
1 1 1 4   4  8  f 1 437.2   8.7   ?     ?   358.643   72.3761      598.166    72.3761      214.464    72.3761      
1 1 1 4   4  9  o 0 365     9.7   ?     ?   315.172   13.5407      542.084    13.5407      205.031    13.5407      
1 1 1 4   4  10 o 0 584.7   13.7  ?     ?   692.766   173.62       423.026    173.62       297.959    -6.38046     
1 1 1 4   4  11 o 0 915.8   17.8  ?     ?   507.831   170.892      895.031    170.892      369.143    170.892      
1 1 1 4   4  12 o 0 587.4   13.7  ?     ?   564.427   98.6551      537.681    98.6551      50.6591    -81.3449     
1 1 1 4   4  13 o 0 4107.6  71.6  ?     ?   1212.38   24.0028      1702.11    24.0028      508.826    24.0028      
1 1 1 4   4  14 o 0 2131.1  40.1  ?     ?   1011.29   107.035      1075.16    107.035      86.0683    107.035      
1 1 1 4   4  15 o 0 1795.2  35.3  ?     ?   530.141   102.004      1350.22    102.004      841.901    102.004      
1 1 1 4   4  16 o 0 1748.9  35.4  ?     ?   997.985   108.311      926.218    108.311      37.8407    -71.6886     
1 1 1 4   4  17 o 0 92.1    11.9  ?     ?   221.064   43.1276      100.814    43.1276      111.13     -136.872     
1 1 1 4   4  18 o 0 286.5   13.5  ?     ?   483.77    -97.7693     269.682    -97.7693     180.875    82.2307      
1 1 1 4   4  19 o 0 3.2     14    ?     ?   76.491    153.748      46.0652    -26.2523     117.332    -26.2523     
1 1 1 4   4  20 o 0 58      12.3  ?     ?   139.96    33.6354      117.15     33.6354      28.8064    -146.365     
1 1 1 4   4  21 o 0 148.4   14.7  ?     ?   304.398   93.4756      255.438    93.4756      53.6314    -86.5244     
1 1 1 4   4  22 o 0 44      14.7  ?     ?   152.476   -37.1751     98.3676    -37.1751     52.4249    142.825      
1 1 1 4   4  23 o 0 0.8     17.7  ?     ?   119.277   -54.1567     25.2911    125.843      139.615    125.843      
1 1 1 4   4  24 o 0 18.4    19.3  ?     ?   57.7259   37.2795      34.0157    37.2795      21.2303    -142.721     
1 1 1 4   4  25 o 0 42.1    23.4  ?     ?   154.098   139.466      95.9995    139.466      62.4063    -40.5344     
1 1 1 4   4  26 o 0 232     30.8  ?     ?   283.171   -88.3762     436.245    -88.3762     155.933    -88.3762     
1 1 1 4   4  27 o 0 17.8    28.8  ?     ?   163.25    -110.142     39.0284    -110.142     115.387    69.8582      
1 1 1 4   4  28 < 0 -36.7   30.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  6  27 o 0 62.7    25.8  ?     ?   134.929   -81.7557     178        -81.7557     54.4773    -81.7557     
1 1 1 -4  6  26 o 0 83.3    23.9  ?     ?   188.238   60.3707      211.841    60.3707      37.828     60.3707      
1 1 1 -4  6  25 o 0 180.7   30.7  ?     ?   132.638   66.626       459.253    66.626       330.891    66.626       
1 1 1 -4  6  24 f 1 279.4   20.3  ?     ?   276.4     -179.895     506.063    -179.895     226.775    -179.895     
1 1 1 -4  6  23 o 0 74.2    15.4  ?     ?   114.267   -33.7382     228.66     -33.7382     121.683    -33.7382     
1 1 1 -4  6  22 o 0 496.2   19.8  ?     ?   490.863   41.8919      577.216    41.8919      116.855    41.8919      
1 1 1 -4  6  21 o 0 611     20.2  ?     ?   529.714   68.5692      652.807    68.5692      140.08     68.5692      
1 1 1 -4  6  20 o 0 74.8    12    ?     ?   195.846   91.9779      165.168    91.9779      29.5017    -88.0221     
1 1 1 -4  6  19 o 0 562.8   17.9  ?     ?   518.682   96.7833      602.023    96.7833      72.3773    96.7833      
1 1 1 -4  6  18 o 0 55.8    9.9   ?     ?   312.864   130.215      13.7883    -49.7855     299.274    -49.7855     
1 1 1 -4  6  17 o 0 5.8     9.8   ?     ?   173.556   79.4396      121.245    -100.56      279.582    -100.56      
1 1 1 -4  6  16 o 0 1072.2  26.8  ?     ?   554.04    91.9269      911.251    91.9269      401.678    91.9269      
1 1 1 -4  6  15 o 0 86.1    9.3   ?     ?   172.182   171.998      95.4813    171.998      67.4996    -8.00209     
1 1 1 -4  6  14 o 0 333.3   12.3  ?     ?   341.496   109.675      425.776    109.675      96.2272    109.675      
1 1 1 -4  6  13 o 0 707.8   18.4  ?     ?   661.972   -77.0567     517.983    -77.0567     108.309    102.943      
1 1 1 -4  6  12 o 0 13      5     ?     ?   270.017   -21.434      189.798    158.566      450.291    158.566      
1 1 1 -4  6  11 o 0 498.1   13.7  ?     ?   541.312   -45.5557     435.232    -45.5557     90.0929    134.444      
1 1 1 -4  6  10 o 0 1837.7  48.3  ?     ?   731.005   -58.2162     1189.04    -58.2162     475.753    -58.2162     
1 1 1 -4  6  9  o 0 4052    79.2  ?     ?   1525.34   -66.142      1464.21    -66.142      91.7806    113.858      
1 1 1 -4  6  8  o 0 1186.1  21    ?     ?   770.869   -134.204     831.388    -134.204     41.5549    -134.204     
1 1 1 -4  6  7  o 0 187.1   4.6   ?     ?   130.544   -149.494     318.663    -149.494     184.393    -149.494     
1 1 1 -4  6  6  o 0 180.3   5     ?     ?   436.143   -38.7955     144.666    -38.7955     305.377    141.204      
1 1 1 -4  6  5  o 0 2634.5  45.4  ?     ?   1121.85   59.8522      1331.26    59.8522      144.02     59.8522      
1 1 1 -4  6  4  o 0 323     6.3   ?     ?   527.948   -42.7533     290.753    -42.7533     264.19     137.247      
1 1 1 -4  6  2  o 0 394     7.8   ?     ?   474.558   -133.424     435.526    -133.424     64.1298    46.5765      
1 1 1 -4  6  1  o 0 1272.6  23.1  ?     ?   825.458   83.0584      873.499    83.0584      4.53295    83.0584      
1 1 1 4   6  0  o 0 276     5.9   ?     ?   412.716   168.683      330.431    168.683      102.532    -11.3166     
1 1 1 4   6  1  o 0 152     4.1   ?     ?   461.748   51.312       72.7826    51.312       412.285    -128.688     
1 1 1 4   6  2  o 0 552.1   10.9  ?     ?   526.12    -4.67644     566.816    -4.67644     13.6449    -4.67644     
1 1 1 4   6  4  o 0 330.7   7     ?     ?   305.484   -178.201     500.177    -178.201     179.042    -178.201     
1 1 1 4   6  5  o 0 511.5   10.2  ?     ?   325.258   -117.688     703.192    -117.688     358.688    -117.688     
1 1 1 4   6  6  o 0 889.6   16.7  ?     ?   772.445   -139.917     613.963    -139.917     184.331    40.0825      
1 1 1 4   6  7  o 0 3209.9  54.7  ?     ?   1400.11   -154.529     1270.7     -154.529     172.565    25.4706      
1 1 1 4   6  8  o 0 49.9    4.6   ?     ?   98.7968   26.0327      18.9254    26.0327      82.5897    -153.967     
1 1 1 4   6  9  o 0 755.8   15.3  ?     ?   651.997   -5.58308     614.36     -5.58308     53.0171    174.417      
1 1 1 4   6  10 o 0 84.9    5.3   ?     ?   267.527   -52.8825     61.214     -52.8825     200.867    127.118      
1 1 1 4   6  11 o 0 1052.8  20.7  ?     ?   677.638   -74.4163     768.89     -74.4163     108.318    -74.4163     
1 1 1 4   6  12 o 0 703.4   17.6  ?     ?   551.303   -112.997     614.222    -112.997     79.7234    -112.997     
1 1 1 4   6  13 o 0 96.4    9.7   ?     ?   372.921   -11.6113     16.4448    -11.6113     338.288    168.389      
1 1 1 4   6  14 o 0 532.1   14.8  ?     ?   299.78    -20.2528     678.112    -20.2528     387.125    -20.2528     
1 1 1 4   6  15 o 0 554.4   15.2  ?     ?   479.206   -135.578     558.011    -135.578     101.563    -135.578     
1 1 1 4   6  16 o 0 645.6   18.9  ?     ?   409.814   9.04379      709.453    9.04379      330.009    9.04379      
1 1 1 4   6  17 o 0 9.9     11.1  ?     ?   141.311   130.95       80.5942    -49.0502     211.564    -49.0502     
1 1 1 4   6  18 o 0 27.4    12.2  ?     ?   289.048   -138.835     105.439    41.165       371.167    41.165       
1 1 1 4   6  19 o 0 198.1   15.3  ?     ?   306.638   101.366      331.012    101.366      15.4273    101.366      
1 1 1 4   6  20 o 0 307.4   19.6  ?     ?   257.226   -22.6867     553.67     -22.6867     295.877    -22.6867     
1 1 1 4   6  21 o 0 16.1    15.9  ?     ?   78.7433   -156.8       8.07992    -156.8       68.7975    23.1999      
1 1 1 4   6  22 o 0 -11.2   17.4  ?     ?   115.556   83.7776      44.8679    -96.2224     154.223    -96.2224     
1 1 1 4   6  23 o 0 360.4   20.9  ?     ?   385.12    51.0092      512.83     51.0092      148.881    51.0092      
1 1 1 4   6  24 f 1 55      25.1  ?     ?   133.51    171.242      149.071    171.242      12.8401    171.242      
1 1 1 4   6  25 o 0 98      32.9  ?     ?   130.425   -126.515     276.79     -126.515     149.278    -126.515     
1 1 1 4   6  26 o 0 33      24.7  ?     ?   152.838   -101.501     77.9345    -101.501     64.8555    78.4988      
1 1 1 4   6  27 o 0 20.8    20.9  ?     ?   100.536   -22.3553     78.3283    -22.3553     14.7259    157.645      
1 1 1 -4  8  26 < 0 8.4     23.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  8  25 o 0 67.6    20.9  ?     ?   125.743   120.648      208.507    120.648      94.6328    120.648      
1 1 1 -4  8  24 o 0 37.9    16.9  ?     ?   122.357   69.2251      111.482    69.2251      2.08863    -110.775     
1 1 1 -4  8  23 o 0 40.1    16.7  ?     ?   95.065    61.8305      126.147    61.8305      31.8476    61.8305      
1 1 1 -4  8  22 o 0 43.6    16.3  ?     ?   138.095   -165.997     118.123    -165.997     19.3061    14.0033      
1 1 1 -4  8  21 o 0 221.1   15.3  ?     ?   233.265   92.1141      441.885    92.1141      227.694    92.1141      
1 1 1 -4  8  20 o 0 411.6   17.6  ?     ?   397.259   107.648      562.774    107.648      195.745    107.648      
1 1 1 -4  8  19 o 0 46      11    ?     ?   196.959   68.7309      83.5782    68.7309      104.823    -111.269     
1 1 1 -4  8  18 o 0 118.6   12.3  ?     ?   181.565   86.3369      281.336    86.3369      103.096    86.3369      
1 1 1 -4  8  17 o 0 487.6   15.9  ?     ?   441.131   -72.6424     588.995    -72.6424     144.409    -72.6424     
1 1 1 -4  8  16 o 0 283     12.6  ?     ?   322.571   -34.933      387.199    -34.933      96.8909    -34.933      
1 1 1 -4  8  15 o 0 109.2   9.8   ?     ?   219.925   60.549       177.876    60.549       21.6029    -119.451     
1 1 1 -4  8  14 o 0 333.3   10.9  ?     ?   481.335   -78.5227     323.005    -78.5227     112.982    101.477      
1 1 1 -4  8  13 o 0 750.6   21.3  ?     ?   477.292   -126         717.102    -126         272.528    -126         
1 1 1 -4  8  12 o 0 558.7   15.3  ?     ?   608.569   60.2825      442.211    60.2825      128.287    -119.717     
1 1 1 -4  8  11 o 0 319.6   9.3   ?     ?   481.666   76.8754      291.184    76.8754      168.531    -103.125     
1 1 1 -4  8  10 f 1 288     8.8   ?     ?   429.959   0.120229     285.97     0.120229     117.85     -179.88      
1 1 1 -4  8  9  o 0 540.7   14.9  ?     ?   544.735   99.1467      469.422    99.1467      42.0749    -80.8533     
1 1 1 -4  8  8  o 0 41      6     ?     ?   177.509   -146.839     24.9492    33.1605      194.563    33.1605      
1 1 1 -4  8  7  o 0 622.4   18.2  ?     ?   498.641   -42.0249     584.171    -42.0249     105.9      -42.0249     
1 1 1 -4  8  6  o 0 9.2     2.7   ?     ?   280.486   -175.798     214.833    4.20176      484.726    4.20176      
1 1 1 -4  8  5  o 0 3767.9  83.8  ?     ?   1251.04   -50.3753     1590.05    -50.3753     319.342    -50.3753     
1 1 1 -4  8  4  f 1 817.9   19.4  ?     ?   478.019   -33.5608     815.862    -33.5608     332.672    -33.5608     
1 1 1 -4  8  3  o 0 537     11.2  ?     ?   515.715   -140.713     529.174    -140.713     9.80275    -140.713     
1 1 1 -4  8  2  o 0 1499.4  31.7  ?     ?   1011.69   -109.668     783.531    -109.668     236.209    70.3317      
1 1 1 -4  8  1  o 0 1577.5  30.9  ?     ?   877.073   -168.641     963.176    -168.641     78.8393    -168.641     
1 1 1 4   8  0  o 0 1043.9  20.2  ?     ?   630.225   168.081      852.026    168.081      217.373    168.081      
1 1 1 4   8  1  o 0 272.3   8.7   ?     ?   539.982   -17.8226     192.218    -17.8226     351.918    162.177      
1 1 1 4   8  2  o 0 2110.8  40    ?     ?   1068.75   1.75388      1067.32    1.75388      9.86514    -178.246     
1 1 1 4   8  3  o 0 407.8   8.7   ?     ?   490.284   -144.81      412.258    -144.81      81.7311    35.1904      
1 1 1 4   8  4  f 1 324.9   8.3   ?     ?   531.436   -25.4965     269.276    -25.4965     268.451    154.503      
1 1 1 4   8  5  o 0 967.2   19.5  ?     ?   918.004   -88.1524     503.377    -88.1524     430.526    91.8476      
1 1 1 4   8  6  o 0 1229.9  23.2  ?     ?   922.64    -3.98963     649.644    -3.98963     240.033    176.01       
1 1 1 4   8  7  o 0 1855.2  33.2  ?     ?   889.04    48.9095      1034.77    48.9095      179.776    48.9095      
1 1 1 4   8  8  o 0 2171.7  42.3  ?     ?   1077.75   10.242       1010.69    10.242       22.4196    -169.758     
1 1 1 4   8  9  o 0 200.3   6.7   ?     ?   373.149   -33.1578     210.139    -33.1578     141.542    146.842      
1 1 1 4   8  10 f 1 14.2    6.7   ?     ?   167.866   -3.42495     110.133    176.575      268.457    176.575      
1 1 1 4   8  11 o 0 1710.6  32.1  ?     ?   909.279   37.0018      959.362    37.0018      87.4481    37.0018      
1 1 1 4   8  12 o 0 595.7   20.6  ?     ?   741.217   0.98481      360.33     0.98481      338.102    -179.015     
1 1 1 4   8  13 o 0 309.3   12    ?     ?   230.949   104.275      460.038    104.275      243.713    104.275      
1 1 1 4   8  14 o 0 195.4   11    ?     ?   209.859   -144.955     321.793    -144.955     130.556    -144.955     
1 1 1 4   8  15 o 0 33.5    9.7   ?     ?   150.541   66.9248      3.89561    -113.075     141.326    -113.075     
1 1 1 4   8  16 o 0 308.2   12.2  ?     ?   213.692   -36.8417     494.31     -36.8417     300.664    -36.8417     
1 1 1 4   8  17 o 0 35.7    13.2  ?     ?   62.2031   108.366      27.3487    108.366      35.7999    -71.6336     
1 1 1 4   8  18 o 0 102.8   12.9  ?     ?   198.308   173.057      235.501    173.057      39.322     173.057      
1 1 1 4   8  19 o 0 39.5    17.8  ?     ?   202.687   116.717      44.2094    116.717      151.245    -63.2835     
1 1 1 4   8  20 o 0 32.7    13.5  ?     ?   220.505   90.1507      16.5846    90.1507      188.878    -89.8493     
1 1 1 4   8  21 o 0 14.5    16.6  ?     ?   116.188   102.498      7.19958    102.498      100.44     -77.5021     
1 1 1 4   8  22 o 0 86.8    19.9  ?     ?   159.464   -161.898     243.185    -161.898     83.01      -161.898     
1 1 1 4   8  23 o 0 158.2   23.2  ?     ?   271.687   12.7855      301.147    12.7855      29.0237    12.7855      
1 1 1 4   8  24 o 0 18.9    25.6  ?     ?   231.771   -12.4743     21.8803    167.526      239.189    167.526      
1 1 1 4   8  25 o 0 65      23    ?     ?   184.185   -106.316     155.382    -106.316     13.1787    73.6836      
1 1 1 4   8  26 < 0 18      28    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  10 24 < 0 55      23.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  10 23 o 0 19.2    19.8  ?     ?   189.181   -128.822     6.25828    -128.822     162.079    51.1782      
1 1 1 -4  10 22 o 0 28.1    17.3  ?     ?   171.154   -137.093     40.4621    -137.093     115.539    42.9068      
1 1 1 -4  10 21 o 0 357.4   21.5  ?     ?   276.426   -16.0237     589.951    -16.0237     320.853    -16.0237     
1 1 1 -4  10 20 o 0 36.5    13.8  ?     ?   154.313   -82.2308     80.3125    -82.2308     70.3036    97.7692      
1 1 1 -4  10 19 o 0 127.7   16.3  ?     ?   190.983   -114.476     302.156    -114.476     128.769    -114.476     
1 1 1 -4  10 18 o 0 607.3   23.5  ?     ?   419.765   -159.808     728.843    -159.808     347.557    -159.808     
1 1 1 -4  10 17 o 0 7.4     11.7  ?     ?   8.41794   -177.239     1.21516    2.76129      8.90003    2.76129      
1 1 1 -4  10 16 o 0 99.9    10.9  ?     ?   366.981   52.6834      95.9719    52.6834      250.484    -127.317     
1 1 1 -4  10 15 o 0 5.1     9     ?     ?   77.9761   -6.56169     41.7349    173.438      117.194    173.438      
1 1 1 -4  10 14 o 0 221.9   9.8   ?     ?   223.933   108.301      424.959    108.301      202.76     108.301      
1 1 1 -4  10 13 o 0 136.3   8.5   ?     ?   269.892   -164.608     197.753    -164.608     41.084     15.3922      
1 1 1 -4  10 12 o 0 25.6    7.8   ?     ?   117.231   59.8882      19.8878    -120.112     124.302    -120.112     
1 1 1 -4  10 11 o 0 2.2     7.3   ?     ?   219.741   -101.727     165.804    78.2733      360.984    78.2733      
1 1 1 -4  10 10 o 0 363.5   10.3  ?     ?   335.817   177.982      465.288    177.982      165.371    177.982      
1 1 1 -4  10 9  f 1 101.6   5.9   ?     ?   329.424   -56.8908     61.2703    -56.8908     242.239    123.109      
1 1 1 -4  10 8  o 0 275.3   10    ?     ?   448.268   121.688      260.722    121.688      151.988    -58.3118     
1 1 1 -4  10 7  o 0 219.7   6.7   ?     ?   119.045   116.84       316.739    116.84       206.711    116.84       
1 1 1 -4  10 6  o 0 541.7   12.1  ?     ?   592.408   129.368      428.829    129.368      127.196    -50.6324     
1 1 1 -4  10 5  o 0 203.4   6.3   ?     ?   497.459   -69.158      111.148    -69.158      344.768    110.842      
1 1 1 -4  10 4  o 0 445     12.2  ?     ?   574.18    76.2206      341.423    76.2206      186.002    -103.779     
1 1 1 -4  10 3  f 1 1287.9  31.7  ?     ?   991.209   -143.786     606.901    -143.786     309.866    36.2137      
1 1 1 -4  10 2  o 0 956.3   37.1  ?     ?   736.37    -142.753     624.814    -142.753     53.5949    37.2468      
1 1 1 -4  10 1  o 0 1132.1  38.9  ?     ?   662.257   -154.398     807.812    -154.398     197.243    -154.398     
1 1 1 4   10 0  o 0 997     28.1  ?     ?   556.313   -64.9291     810.53     -64.9291     297.415    -64.9291     
1 1 1 4   10 1  o 0 2634.9  55.9  ?     ?   899.908   -115.833     1361.35    -115.833     531.185    -115.833     
1 1 1 4   10 2  o 0 571.4   14.2  ?     ?   407.955   -56.5413     601.385    -56.5413     225.159    -56.5413     
1 1 1 4   10 3  f 1 1887.2  37.1  ?     ?   835.569   4.3311       1073.75    4.3311       299.805    4.3311       
1 1 1 4   10 4  o 0 359.4   10.1  ?     ?   341.746   -120.284     436.373    -120.284     121.856    -120.284     
1 1 1 4   10 5  o 0 1441    26.9  ?     ?   1076.41   15.2892      623.294    15.2892      365.556    -164.711     
1 1 1 4   10 6  o 0 433     10.3  ?     ?   552.961   0.136949     355.671    0.136949     164.797    -179.863     
1 1 1 4   10 7  o 0 345.2   9.8   ?     ?   486.694   -131.454     318.706    -131.454     132.606    48.5457      
1 1 1 4   10 8  o 0 691.3   15.6  ?     ?   638.355   -63.3423     526.509    -63.3423     63.413     116.658      
1 1 1 4   10 9  f 1 21.6    7.1   ?     ?   244.683   37.5697      125.983    -142.43      352.365    -142.43      
1 1 1 4   10 10 o 0 124.4   10.1  ?     ?   184.586   -149.33      196.159    -149.33      30.5386    -149.33      
1 1 1 4   10 11 o 0 404.6   15.9  ?     ?   423.225   164.957      444.432    164.957      66.595     164.957      
1 1 1 4   10 12 o 0 582.6   18.2  ?     ?   563.895   111.142      504.412    111.142      0.613057   -68.8576     
1 1 1 4   10 13 o 0 45.3    9     ?     ?   105.681   41.8357      36.2128    41.8357      57.8652    -138.164     
1 1 1 4   10 14 o 0 772.2   19.9  ?     ?   568.161   -157.67      735.629    -157.67      168.267    -157.67      
1 1 1 4   10 15 o 0 131.7   12    ?     ?   256.582   149.765      252.294    149.765      2.30563    149.765      
1 1 1 4   10 16 o 0 382.4   16.9  ?     ?   352.05    15.0399      559.722    15.0399      224.963    15.0399      
1 1 1 4   10 17 o 0 63.4    13.8  ?     ?   126.803   39.7978      185.201    39.7978      68.5578    39.7978      
1 1 1 4   10 18 o 0 48.6    14.1  ?     ?   126.716   -121.383     136.176    -121.383     20.1508    -121.383     
1 1 1 4   10 19 o 0 29.6    17.7  ?     ?   87.124    -153.194     69.2997    -153.194     10.4651    26.806       
1 1 1 4   10 20 o 0 -0.6    15    ?     ?   189.313   171.032      78.3065    -8.96845     264.718    -8.96845     
1 1 1 4   10 21 o 0 93.5    24    ?     ?   268.228   132.768      155.721    132.768      107.813    -47.2322     
1 1 1 4   10 22 o 0 46.1    20.9  ?     ?   197.3     79.7756      81.5854    79.7756      99.9848    -100.224     
1 1 1 4   10 23 o 0 -6.3    24    ?     ?   104.006   175.216      19.5153    175.216      73.9632    -4.78436     
1 1 1 4   10 24 < 0 12.6    24.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  12 22 < 0 22.8    26.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  12 21 o 0 91.6    19.7  ?     ?   264.836   48.1069      166.757    48.1069      63.1795    -131.893     
1 1 1 -4  12 20 o 0 74.1    17.1  ?     ?   168.944   29.7604      197.885    29.7604      48.0721    29.7604      
1 1 1 -4  12 19 o 0 70.6    21.7  ?     ?   73.5119   -178.113     225.833    -178.113     158.6      -178.113     
1 1 1 -4  12 18 o 0 24.2    15.9  ?     ?   51.9982   -162.074     55.5301    -162.074     5.85281    -162.074     
1 1 1 -4  12 17 o 0 62.9    15.1  ?     ?   185.176   -60.659      151.048    -60.659      26.1193    119.341      
1 1 1 -4  12 16 o 0 -10.3   13    ?     ?   79.9073   53.3414      35.3537    -126.659     106.38     -126.659     
1 1 1 -4  12 15 o 0 332.5   14.9  ?     ?   323.018   160.311      508.023    160.311      221.11     160.311      
1 1 1 -4  12 14 o 0 132.7   11.6  ?     ?   250.345   -119.947     266.552    -119.947     43.3479    -119.947     
1 1 1 -4  12 13 o 0 23.7    9.7   ?     ?   33.7794   -120.606     16.5192    -120.606     14.5856    59.3936      
1 1 1 -4  12 12 o 0 172.8   9.6   ?     ?   230.925   -168.332     352.268    -168.332     138.226    -168.332     
1 1 1 -4  12 11 o 0 38.7    7.5   ?     ?   149.351   -128.819     67.209     -128.819     74.4329    51.1806      
1 1 1 -4  12 10 o 0 400.4   12.4  ?     ?   412.383   49.6606      497.23     49.6606      96.9555    49.6606      
1 1 1 -4  12 9  o 0 440.7   12.1  ?     ?   352.517   144.907      598.966    144.907      255.059    144.907      
1 1 1 -4  12 8  o 0 453.8   12.1  ?     ?   434.525   -146.209     542.789    -146.209     116.937    -146.209     
1 1 1 -4  12 7  o 0 580.9   14.3  ?     ?   469.886   -95.489      566.267    -95.489      156.756    -95.489      
1 1 1 -4  12 6  o 0 43.3    5.8   ?     ?   126.925   170.776      30.9395    170.776      80.0701    -9.22363     
1 1 1 -4  12 5  o 0 292.2   8.5   ?     ?   319.08    -8.10173     391.951    -8.10173     112.034    -8.10173     
1 1 1 -4  12 4  o 0 111.2   6.2   ?     ?   376.906   -123.167     63.3785    -123.167     265.226    56.8335      
1 1 1 -4  12 3  f 1 403.8   10.9  ?     ?   660.602   -53.6606     240.801    -53.6606     339.281    126.339      
1 1 1 -4  12 2  o 0 14      4.8   ?     ?   48.0668   -49.1838     26.4382    130.816      68.495     130.816      
1 1 1 -4  12 1  o 0 203     7.8   ?     ?   224.376   154.103      315.824    154.103      119.294    154.103      
1 1 1 4   12 0  o 0 404.4   11.2  ?     ?   478.807   -117.742     393.719    -117.742     26.4248    62.2578      
1 1 1 4   12 1  o 0 169     7.2   ?     ?   168.733   -142.301     274.371    -142.301     126.345    -142.301     
1 1 1 4   12 2  o 0 235.9   9.4   ?     ?   248.696   -179.05      352.62     -179.05      134.594    -179.05      
1 1 1 4   12 3  f 1 621.3   16.5  ?     ?   510.954   -137.243     569.143    -137.243     119.418    -137.243     
1 1 1 4   12 4  o 0 49      6.9   ?     ?   133.115   -113.669     22.095     -113.669     94.2791    66.3305      
1 1 1 4   12 5  o 0 98.5    6.4   ?     ?   317.063   22.8984      90.1864    22.8984      188.834    -157.102     
1 1 1 4   12 6  o 0 250.5   8.9   ?     ?   377.248   166.044      295.134    166.044      35.979     -13.9556     
1 1 1 4   12 7  o 0 142.9   8.8   ?     ?   287.729   -56.5862     195.705    -56.5862     56.0461    123.414      
1 1 1 4   12 8  o 0 -1.1    7.4   ?     ?   90.4522   2.57283      70.9875    -177.427     160.022    -177.427     
1 1 1 4   12 9  o 0 233.3   9.6   ?     ?   287.679   -148.308     388.612    -148.308     106.618    -148.308     
1 1 1 4   12 10 o 0 68.6    9     ?     ?   217.799   -20.0547     128.074    -20.0547     80.7169    159.945      
1 1 1 4   12 11 o 0 74      9.3   ?     ?   181.957   -59.06       165.782    -59.06       7.74904    120.94       
1 1 1 4   12 12 o 0 103.8   13.8  ?     ?   283.263   -159.571     173.826    -159.571     90.3051    20.4294      
1 1 1 4   12 13 o 0 -1.4    10.7  ?     ?   38.9859   170.003      19.5442    -9.99731     55.6733    -9.99731     
1 1 1 4   12 14 o 0 375.3   16.3  ?     ?   325.953   70.665       565.264    70.665       272.67     70.665       
1 1 1 4   12 15 o 0 40.2    13.6  ?     ?   144.897   96.3103      91.5818    96.3103      38.0482    -83.6897     
1 1 1 4   12 16 o 0 68.2    15.3  ?     ?   150.224   104.247      185.923    104.247      51.3772    104.247      
1 1 1 4   12 17 o 0 82.1    16.2  ?     ?   185.706   -153.041     204.609    -153.041     25.5104    -153.041     
1 1 1 4   12 18 o 0 -12.5   19.9  ?     ?   81.4409   110.816      9.56015    -69.1843     88.0209    -69.1843     
1 1 1 4   12 19 o 0 40.1    20.4  ?     ?   151.434   62.656       94.3578    62.656       45.3617    -117.344     
1 1 1 4   12 20 o 0 52.8    21.6  ?     ?   144.578   -138.4       136.819    -138.4       7.43104    -138.4       
1 1 1 4   12 21 o 0 25.2    23.3  ?     ?   95.071    120.853      89.9842    120.853      6.64775    120.853      
1 1 1 4   12 22 < 0 21.5    21.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  14 19 < 0 23.7    21.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  14 18 o 0 65.3    22.5  ?     ?   175.024   -90.1619     152.137    -90.1619     4.15903    -90.1619     
1 1 1 -4  14 17 o 0 -17     19.9  ?     ?   47.0412   47.7675      4.22143    47.7675      35.8231    -132.232     
1 1 1 -4  14 16 o 0 29.1    16    ?     ?   158.57    166.467      53.1868    166.467      84.7642    -13.533      
1 1 1 -4  14 15 o 0 120.4   17.9  ?     ?   98.5126   -171.99      342.126    -171.99      253.881    -171.99      
1 1 1 -4  14 14 f 1 316     17.7  ?     ?   386.389   -87.7721     418.035    -87.7721     55.2449    -87.7721     
1 1 1 -4  14 13 o 0 368.3   16.6  ?     ?   362.858   -68.9696     509.961    -68.9696     171.101    -68.9696     
1 1 1 -4  14 12 o 0 182.7   13.7  ?     ?   291.265   -32.1488     325.62     -32.1488     61.1531    -32.1488     
1 1 1 -4  14 11 o 0 9.1     8.7   ?     ?   59.7998   -63.775      7.76245    116.225      59.8773    116.225      
1 1 1 -4  14 10 o 0 120.4   9.9   ?     ?   213.969   -151.596     261.937    -151.596     76.0211    -151.596     
1 1 1 -4  14 9  o 0 128.9   9     ?     ?   232.119   -167.417     267.398    -167.417     64.6505    -167.417     
1 1 1 -4  14 8  o 0 190.4   10.2  ?     ?   304.113   124.231      321.639    124.231      55.7438    124.231      
1 1 1 -4  14 7  o 0 108.7   9.5   ?     ?   295.823   100.231      179.069    100.231      80.6818    -79.7688     
1 1 1 -4  14 6  o 0 78.2    7.6   ?     ?   264.449   -94.6463     124.746    -94.6463     114.283    85.3537      
1 1 1 -4  14 5  f 1 239     10.6  ?     ?   435.374   -104.43      277.835    -104.43      119.011    75.5703      
1 1 1 -4  14 4  o 0 392.9   11.9  ?     ?   356.497   123.398      544.706    123.398      220.517    123.398      
1 1 1 -4  14 3  o 0 548.3   14.5  ?     ?   463.854   100.287      615.315    100.287      192.526    100.287      
1 1 1 -4  14 2  o 0 222.3   9.2   ?     ?   386.414   78.677       289.423    78.677       69.4214    -101.323     
1 1 1 -4  14 1  o 0 179.4   8.7   ?     ?   85.0556   40.7991      397.772    40.7991      318.677    40.7991      
1 1 1 4   14 0  o 0 94.5    7.6   ?     ?   200.851   113.311      202.593    113.311      15.2561    113.311      
1 1 1 4   14 1  o 0 69.6    6.9   ?     ?   226.424   102.249      121.679    102.249      89.391     -77.7512     
1 1 1 4   14 2  o 0 206.5   9.2   ?     ?   509.326   70.5659      157.383    70.5659      316.923    -109.434     
1 1 1 4   14 3  o 0 137.5   7.9   ?     ?   308.059   -141.432     221.997    -141.432     59.6722    38.5676      
1 1 1 4   14 4  o 0 16.8    6.7   ?     ?   62.6602   -17.7009     3.44695    -17.7009     53.7343    162.299      
1 1 1 4   14 5  f 1 136     8.8   ?     ?   138.731   168.873      337.075    168.873      210.13     168.873      
1 1 1 4   14 6  o 0 180.3   9.5   ?     ?   393.602   140.844      224.697    140.844      132.581    -39.1565     
1 1 1 4   14 7  o 0 15.4    8.5   ?     ?   40.0155   59.6477      4.63391    59.6477      30.6645    -120.352     
1 1 1 4   14 8  o 0 204.5   10.5  ?     ?   329.138   105.988      325.464    105.988      36.2504    105.988      
1 1 1 4   14 9  o 0 37.6    8.7   ?     ?   170.915   -166.091     75.4632    -166.091     74.6274    13.9087      
1 1 1 4   14 10 o 0 30.1    9.5   ?     ?   142.004   154.57       59.3188    154.57       64.7774    -25.4301     
1 1 1 4   14 11 o 0 13.1    11.6  ?     ?   130.195   127.216      9.12084    -52.7843     123.281    -52.7843     
1 1 1 4   14 12 o 0 5.3     9.9   ?     ?   84.1159   156.296      23.0262    -23.7039     99.901     -23.7039     
1 1 1 4   14 13 o 0 274.4   18    ?     ?   242.989   -7.73291     497.571    -7.73291     269.086    -7.73291     
1 1 1 4   14 14 f 1 169.9   16.8  ?     ?   321.658   13.5512      264.125    13.5512      40.0889    -166.449     
1 1 1 4   14 15 o 0 91      23    ?     ?   133.348   118.659      257.168    118.659      136.803    118.659      
1 1 1 4   14 16 o 0 42.1    20.2  ?     ?   195.552   47.3277      68.2649    47.3277      103.231    -132.672     
1 1 1 4   14 17 o 0 101     22.5  ?     ?   208.662   136.925      226.288    136.925      47.1614    136.925      
1 1 1 4   14 18 o 0 12.7    26.8  ?     ?   176.991   123.633      15.7379    123.633      135.224    -56.3672     
1 1 1 4   14 19 < 0 3.2     28.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  16 14 < 0 29.1    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  16 13 o 0 6.3     12.8  ?     ?   115.582   -29.2727     7.99997    -29.2727     87.5445    150.727      
1 1 1 -4  16 12 o 0 162.9   19.3  ?     ?   277.746   106.887      290.788    106.887      60.1227    106.887      
1 1 1 -4  16 11 o 0 10.1    12.1  ?     ?   224.574   138.325      65.7829    -41.675      255.968    -41.675      
1 1 1 -4  16 10 o 0 147.6   15.2  ?     ?   370.34    -158.112     192.606    -158.112     122.89     21.8883      
1 1 1 -4  16 9  o 0 64.9    13.5  ?     ?   189.683   -19.2943     153.967    -19.2943     11.9677    160.706      
1 1 1 -4  16 8  o 0 52.4    11.9  ?     ?   234.577   18.448       82.9183    18.448       123.309    -161.552     
1 1 1 -4  16 7  o 0 67.8    10.9  ?     ?   131.905   -161.711     199.086    -161.711     78.5436    -161.711     
1 1 1 -4  16 6  o 0 314.7   13.7  ?     ?   287.415   159.593      499.08     159.593      235.372    159.593      
1 1 1 -4  16 5  o 0 -0.3    9.6   ?     ?   160.309   31.0348      78.1999    -148.965     224.704    -148.965     
1 1 1 -4  16 4  o 0 127.5   10.1  ?     ?   224.322   16.9487      268.633    16.9487      63.0049    16.9487      
1 1 1 -4  16 3  f 1 114.5   11.2  ?     ?   213.55    109.99       250.187    109.99       52.9217    109.99       
1 1 1 -4  16 2  o 0 318.2   13.3  ?     ?   336.527   118.636      467.057    118.636      157.135    118.636      
1 1 1 -4  16 1  f 1 45.8    8.9   ?     ?   105.681   -163.287     143.46     -163.287     45.4735    -163.287     
1 1 1 4   16 0  o 0 138.8   10.7  ?     ?   317.619   121.053      214.554    121.053      79.629     -58.9472     
1 1 1 4   16 1  f 1 94.7    9.4   ?     ?   240.968   85.1667      186.815    85.1667      37.3285    -94.8333     
1 1 1 4   16 2  o 0 96      9.3   ?     ?   207.7     125.312      217.518    125.312      25.5594    125.312      
1 1 1 4   16 3  f 1 44.5    10.5  ?     ?   36.5808   111.094      97.2656    111.094      63.3431    111.094      
1 1 1 4   16 4  o 0 70.6    10.9  ?     ?   203.432   -106.167     155.93     -106.167     31.336     73.8333      
1 1 1 4   16 5  o 0 63.8    10.7  ?     ?   153.162   -143.647     173.42     -143.647     32.8083    -143.647     
1 1 1 4   16 6  o 0 43.6    11.4  ?     ?   104.482   106.075      139.479    106.075      43.1442    106.075      
1 1 1 4   16 7  o 0 186     17.9  ?     ?   363.854   -104.542     248.335    -104.542     85.925     75.4577      
1 1 1 4   16 8  o 0 46.1    12.8  ?     ?   121.914   -89.2534     139.933    -89.2534     32.1504    -89.2534     
1 1 1 4   16 9  o 0 21.4    15.3  ?     ?   108.219   -24.3221     48.5654    -24.3221     46.6697    155.678      
1 1 1 4   16 10 o 0 11.5    12    ?     ?   77.0598   -177.643     19.6247    -177.643     46.4386    2.35708      
1 1 1 4   16 11 o 0 29      17.9  ?     ?   44.7134   149.661      66.4542    149.661      28.3344    149.661      
1 1 1 4   16 12 o 0 7.6     16    ?     ?   92.6695   5.505        23.2533    5.505        54.2506    -174.495     
1 1 1 4   16 13 o 0 12.6    19.1  ?     ?   129.172   60.6892      32.8811    60.6892      74.6899    -119.311     
1 1 1 4   16 14 < 0 58.8    19.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  18 7  < 0 52.9    16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  18 6  < 0 207.9   17.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  18 5  < 0 42.5    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  18 4  < 0 128.9   13.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -4  18 3  o 0 287.3   17.4  ?     ?   298.279   173.617      445.98     173.617      204.714    173.617      
1 1 1 -4  18 2  o 0 160     16.2  ?     ?   259.556   19.3353      296.732    19.3353      86.2958    19.3353      
1 1 1 -4  18 1  o 0 100.7   14.5  ?     ?   220.608   49.5797      217.76     49.5797      38.5639    49.5797      
1 1 1 4   18 0  o 0 203.9   16.3  ?     ?   261.139   131.466      366.81     131.466      153.617    131.466      
1 1 1 4   18 1  o 0 59.7    15.4  ?     ?   214.963   27.2614      122.086    27.2614      53.2128    -152.739     
1 1 1 4   18 2  o 0 134.9   16.4  ?     ?   164.842   29.3238      324.301    29.3238      190.085    29.3238      
1 1 1 4   18 3  o 0 70      13.2  ?     ?   152.828   73.8257      197.17     73.8257      72.9876    73.8257      
1 1 1 4   18 4  < 0 -5.1    14.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 4   18 5  < 0 71.9    15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 4   18 6  < 0 25.1    16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 4   18 7  < 0 70.1    17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  1  29 < 0 46.8    24.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  1  28 o 0 96.9    18.8  ?     ?   182.101   -100.156     267.946    -100.156     96.2703    -100.156     
1 1 1 -5  1  27 o 0 13.1    19.8  ?     ?   114.298   -7.20229     26.6802    -7.20229     86.1224    172.798      
1 1 1 -5  1  26 o 0 34.2    16.4  ?     ?   229.078   -18.1954     10.614     -18.1954     225.99     161.805      
1 1 1 -5  1  25 o 0 35.3    17.5  ?     ?   85.4903   -68.673      91.6386    -68.673      10.0194    -68.673      
1 1 1 -5  1  24 o 0 62.2    12.7  ?     ?   274.094   -136.218     86.3537    -136.218     175.799    43.7824      
1 1 1 -5  1  23 f 1 131.1   14.7  ?     ?   361.73    -143.116     173.172    -143.116     185.74     36.884       
1 1 1 -5  1  22 o 0 230.7   13.1  ?     ?   415.552   -126.173     301.364    -126.173     119.906    53.8268      
1 1 1 -5  1  21 o 0 30.4    11.4  ?     ?   177.523   -17.983      8.59991    162.017      193.49     162.017      
1 1 1 -5  1  20 o 0 11.6    9.2   ?     ?   194.044   -165.691     113.5      14.3094      294.106    14.3094      
1 1 1 -5  1  19 o 0 411.1   14.2  ?     ?   377.424   -177.273     507.405    -177.273     156.162    -177.273     
1 1 1 -5  1  18 o 0 89.6    9.3   ?     ?   122.058   -31.8423     98.1651    -31.8423     18.7975    148.158      
1 1 1 -5  1  17 o 0 9       10.1  ?     ?   315.382   -18.1184     235.059    161.882      539.639    161.882      
1 1 1 -5  1  16 o 0 1904.5  35.2  ?     ?   1050.78   -36.7215     929.425    -36.7215     78.0741    143.278      
1 1 1 -5  1  15 o 0 2801.9  49.7  ?     ?   1410.54   -58.7385     996.627    -58.7385     383.243    121.261      
1 1 1 -5  1  14 o 0 870.6   17.9  ?     ?   853.934   -82.4434     476.008    -82.4434     364.847    97.5566      
1 1 1 -5  1  13 o 0 1402.8  25.3  ?     ?   754.284   -98.6411     997.979    -98.6411     220.587    -98.6411     
1 1 1 -5  1  12 o 0 1907.4  39.7  ?     ?   899.267   137.162      1159.17    137.162      227.06     137.162      
1 1 1 -5  1  11 o 0 91      4.9   ?     ?   270.173   52.0746      87.7791    52.0746      193.742    -127.925     
1 1 1 -5  1  10 o 0 447.3   9.6   ?     ?   452.551   85.2444      525.206    85.2444      44.6691    85.2444      
1 1 1 -5  1  9  o 0 921.8   16.7  ?     ?   544.319   -62.5816     902.524    -62.5816     322.007    -62.5816     
1 1 1 -5  1  8  o 0 3141.7  54    ?     ?   1200.04   20.7025      1408.12    20.7025      221.282    20.7025      
1 1 1 -5  1  7  o 0 1613.3  28.4  ?     ?   837.381   -96.5346     982.314    -96.5346     183.812    -96.5346     
1 1 1 -5  1  6  o 0 733.6   13.4  ?     ?   686.244   132.137      534.178    132.137      122.113    -47.8629     
1 1 1 -5  1  5  o 0 819     15    ?     ?   780.949   164.787      506.235    164.787      225.595    -15.2131     
1 1 1 -5  1  4  o 0 6438.3  176.5 ?     ?   1833.85   -86.1452     1776.62    -86.1452     88.725     -86.1452     
1 1 1 -5  1  3  f 1 497.2   11    ?     ?   603.378   -33.6056     375.821    -33.6056     182.741    146.394      
1 1 1 -5  1  2  o 0 782.7   14.9  ?     ?   744.443   39.953       501.675    39.953       183.462    -140.047     
1 1 1 -5  1  1  f 1 4621.4  215.1 ?     ?   1158.25   160.403      1848.24    160.403      779.093    160.403      
1 1 1 5   1  0  o 0 150.6   5.2   ?     ?   115.672   -41.6642     208.695    -41.6642     103.996    -41.6642     
1 1 1 5   1  1  f 1 1623.8  36.4  ?     ?   908.977   -172.921     878.808    -172.921     44.5233    -172.921     
1 1 1 5   1  2  o 0 4589.5  153.9 ?     ?   1128.28   -99.7438     1878.67    -99.7438     840.594    -99.7438     
1 1 1 5   1  3  f 1 2228.7  38.4  ?     ?   1050.66   91.0255      1061.4     91.0255      86.1563    91.0255      
1 1 1 5   1  4  o 0 5248.2  88.4  ?     ?   1706.53   -134.869     1567.19    -134.869     10.1406    45.1306      
1 1 1 5   1  5  o 0 264.4   5.7   ?     ?   302.594   -7.98401     364.028    -7.98401     79.0445    -7.98401     
1 1 1 5   1  6  o 0 125     4.3   ?     ?   351.013   -104.952     103.539    -104.952     233.994    75.0479      
1 1 1 5   1  7  o 0 3963.3  67.3  ?     ?   1331.71   95.568       1616.18    95.568       286.916    95.568       
1 1 1 5   1  8  o 0 962     17.3  ?     ?   645.12    -38.8881     779.017    -38.8881     137.117    -38.8881     
1 1 1 5   1  9  o 0 343.6   7.6   ?     ?   357.776   -125.042     485.013    -125.042     101.029    -125.042     
1 1 1 5   1  10 o 0 74.7    5.6   ?     ?   129.975   -65.5837     83.5166    -65.5837     55.4044    114.416      
1 1 1 5   1  11 o 0 2617.3  46.1  ?     ?   1023.11   -87.7911     1413.18    -87.7911     339.819    -87.7911     
1 1 1 5   1  12 o 0 1362.6  25.3  ?     ?   731.714   -78.1603     1006.97    -78.1603     243.145    -78.1603     
1 1 1 5   1  13 o 0 652.9   31    ?     ?   440.69    -30.3911     730.582    -30.3911     273.039    -30.3911     
1 1 1 5   1  14 o 0 180.7   8.6   ?     ?   431.718   -99.5476     134.95     -99.5476     293.419    80.4524      
1 1 1 5   1  15 o 0 30.9    9.5   ?     ?   173.261   40.8875      56.7837    -139.112     227.631    -139.112     
1 1 1 5   1  16 o 0 1570    31.6  ?     ?   541.227   -71.939      1227.36    -71.939      704.117    -71.939      
1 1 1 5   1  17 o 0 477.9   16.6  ?     ?   451.148   62.1593      516.923    62.1593      77.462     62.1593      
1 1 1 5   1  18 o 0 272.7   12.8  ?     ?   259.291   37.1482      410.516    37.1482      159.817    37.1482      
1 1 1 5   1  19 o 0 71.2    13.8  ?     ?   155.856   138.071      81.0886    138.071      65.3121    -41.9288     
1 1 1 5   1  20 o 0 166.7   13.4  ?     ?   357.279   19.2033      199.563    19.2033      136.207    -160.797     
1 1 1 5   1  21 o 0 39.5    17    ?     ?   157.493   -101.752     35.7255    -101.752     129.962    78.2478      
1 1 1 5   1  22 o 0 291.6   15.9  ?     ?   343.828   83.1489      466.209    83.1489      113.987    83.1489      
1 1 1 5   1  23 f 1 243.9   17.9  ?     ?   396.98    37.9142      359.611    37.9142      28.6683    -142.086     
1 1 1 5   1  24 o 0 205.3   18.8  ?     ?   151.93    110.558      496.883    110.558      349.922    110.558      
1 1 1 5   1  25 o 0 -25.2   24.8  ?     ?   21.956    -175.884     2.81126    4.1163       24.0205    4.1163       
1 1 1 5   1  26 o 0 35.9    18.4  ?     ?   160.392   47.6427      75.8955    47.6427      91.7963    -132.357     
1 1 1 5   1  27 o 0 59.4    23.5  ?     ?   180.81    92.6471      141.192    92.6471      35.7558    -87.3529     
1 1 1 5   1  28 o 0 80.4    29.4  ?     ?   126.854   50.7749      237.57     50.7749      116.398    50.7749      
1 1 1 -5  3  28 o 0 10.3    20.5  ?     ?   97.3316   127.954      53.1965    127.954      37.6592    -52.0463     
1 1 1 -5  3  27 o 0 115.3   20.5  ?     ?   173.747   32.6291      311.704    32.6291      145.776    32.6291      
1 1 1 -5  3  26 o 0 -32     19.7  ?     ?   65.5317   -118.028     24.095     61.9724      91.0076    61.9724      
1 1 1 -5  3  25 o 0 77.4    20.8  ?     ?   63.7906   -11.4889     245.484    -11.4889     180.105    -11.4889     
1 1 1 -5  3  24 o 0 87.9    18.3  ?     ?   192.228   35.0811      218.79     35.0811      36.9115    35.0811      
1 1 1 -5  3  23 o 0 84.2    15.1  ?     ?   283.43    22.3057      140.62     22.3057      129.358    -157.694     
1 1 1 -5  3  22 o 0 52.1    14    ?     ?   223.786   -85.8204     86.2684    -85.8204     134.56     94.1796      
1 1 1 -5  3  21 o 0 190.5   13    ?     ?   204.58    -55.5677     419.252    -55.5677     211.94     -55.5677     
1 1 1 -5  3  20 o 0 21      10.1  ?     ?   150.231   63.9088      39.0085    -116.091     195.406    -116.091     
1 1 1 -5  3  19 o 0 105.6   9.8   ?     ?   139.018   51.8323      194.84     51.8323      65.5089    51.8323      
1 1 1 -5  3  18 o 0 659.7   17.3  ?     ?   510.874   -72.909      641.205    -72.909      166.002    -72.909      
1 1 1 -5  3  17 o 0 780.4   20.2  ?     ?   596.23    172.752      657.82     172.752      86.7715    172.752      
1 1 1 -5  3  16 o 0 1295.5  26.1  ?     ?   816.767   122.999      798.08     122.999      21.1187    122.999      
1 1 1 -5  3  15 o 0 2766.7  50.6  ?     ?   1057.02   -5.51083     1324.6     -5.51083     311.645    -5.51083     
1 1 1 -5  3  14 o 0 2915.1  51.8  ?     ?   1384.84   -94.6475     1068.8     -94.6475     285.248    85.3525      
1 1 1 -5  3  13 f 1 2593.6  45.4  ?     ?   1271.01   -160.479     1041.09    -160.479     216.3      19.5213      
1 1 1 -5  3  12 f 1 449.1   12.5  ?     ?   533.118   -168.717     426.656    -168.717     125.396    11.2825      
1 1 1 -5  3  11 f 1 591     11.7  ?     ?   537.923   51.3273      575.789    51.3273      15.5303    51.3273      
1 1 1 -5  3  10 o 0 549.4   12.9  ?     ?   610.656   83.4489      468.341    83.4489      167.831    -96.5511     
1 1 1 -5  3  9  o 0 1066.1  21.9  ?     ?   808.92    173.202      746.574    173.202      112.309    -6.79758     
1 1 1 -5  3  8  o 0 370.1   7.4   ?     ?   397.074   47.5059      482.622    47.5059      59.1024    47.5059      
1 1 1 -5  3  7  o 0 1828.2  31.7  ?     ?   1163.52   11.2573      824.625    11.2573      326.397    -168.743     
1 1 1 -5  3  6  o 0 151.2   3.9   ?     ?   163.418   36.2958      251.639    36.2958      89.3932    36.2958      
1 1 1 -5  3  5  o 0 828.5   15.1  ?     ?   599.522   85.5582      689.493    85.5582      115.831    85.5582      
1 1 1 -5  3  4  o 0 1868.9  32.1  ?     ?   961.091   5.76763      1011.3     5.76763      89.5335    5.76763      
1 1 1 -5  3  3  f 1 1528.7  26.6  ?     ?   947.949   -54.2754     814.775    -54.2754     79.8669    125.725      
1 1 1 -5  3  2  o 0 1271.2  22.6  ?     ?   708.59    49.7099      884.248    49.7099      218.697    49.7099      
1 1 1 -5  3  1  o 0 203.2   4.4   ?     ?   565.876   -54.3179     61.9763    -54.3179     469.094    125.682      
1 1 1 5   3  0  o 0 2305.4  40.1  ?     ?   1197.44   90.1747      973.619    90.1747      138.54     -89.8253     
1 1 1 5   3  1  o 0 4856.3  93.7  ?     ?   1807.13   161.112      1365.7     161.112      319.021    -18.8878     
1 1 1 5   3  2  o 0 1584.6  27.5  ?     ?   864.564   -174.769     923.025    -174.769     114.532    -174.769     
1 1 1 5   3  3  f 1 1392.9  24.5  ?     ?   756.323   -132.399     909.317    -132.399     197.097    -132.399     
1 1 1 5   3  4  o 0 1430.4  25.4  ?     ?   723.175   -149.617     987.145    -149.617     293.782    -149.617     
1 1 1 5   3  5  o 0 516.2   10    ?     ?   573.888   -172.476     439.144    -172.476     110.655    7.52387      
1 1 1 5   3  6  o 0 287.6   6.6   ?     ?   426.578   -77.8005     317.845    -77.8005     106.702    102.199      
1 1 1 5   3  7  o 0 1431.9  26.2  ?     ?   843.631   8.83393      907.625    8.83393      70.204     8.83393      
1 1 1 5   3  8  o 0 708.2   13.8  ?     ?   636.525   81.0095      624.729    81.0095      57.0567    -98.9905     
1 1 1 5   3  9  o 0 450.7   11.5  ?     ?   545.789   157.288      441.638    157.288      140.703    -22.7118     
1 1 1 5   3  10 o 0 51      3.8   ?     ?   152.699   179.932      18.018     179.932      141.936    -0.0678022   
1 1 1 5   3  11 f 1 855.4   17.3  ?     ?   806.384   131.482      552.806    131.482      292.12     -48.518      
1 1 1 5   3  12 f 1 2224.6  39.1  ?     ?   728.839   47.5846      1496.34    47.5846      736.699    47.5846      
1 1 1 5   3  13 f 1 3544.2  62.4  ?     ?   1192.94   8.48394      1518.61    8.48394      330.219    8.48394      
1 1 1 5   3  14 o 0 1818.4  34.5  ?     ?   793.555   88.308       1131.3     88.308       349.64     88.308       
1 1 1 5   3  15 o 0 140.6   10.1  ?     ?   204.301   4.24355      208.264    4.24355      10.9436    4.24355      
1 1 1 5   3  16 o 0 56.9    10.4  ?     ?   140.212   -104.612     23.9846    -104.612     114.125    75.3884      
1 1 1 5   3  17 o 0 1093.3  25.5  ?     ?   746.547   -168.674     760.871    -168.674     39.6443    -168.674     
1 1 1 5   3  18 o 0 291.4   12.9  ?     ?   345.198   -107.883     390.779    -107.883     66.7604    -107.883     
1 1 1 5   3  19 o 0 213.6   14.1  ?     ?   345.985   112.238      285.722    112.238      39.2211    -67.7624     
1 1 1 5   3  20 o 0 130.7   13.2  ?     ?   440.656   73.2502      78.6028    73.2502      384.711    -106.75      
1 1 1 5   3  21 o 0 41.3    14    ?     ?   138.642   145.846      78.5865    145.846      63.3681    -34.1536     
1 1 1 5   3  22 o 0 20.9    14.8  ?     ?   179.704   93.2055      15.1722    -86.7945     194.422    -86.7945     
1 1 1 5   3  23 o 0 37      16.5  ?     ?   164.074   146.718      70.8063    146.718      87.2442    -33.2823     
1 1 1 5   3  24 o 0 205.6   16.8  ?     ?   326.609   115.276      354.091    115.276      41.4388    115.276      
1 1 1 5   3  25 o 0 203.2   18.9  ?     ?   244.907   156.659      429.482    156.659      175.411    156.659      
1 1 1 5   3  26 o 0 260     25.6  ?     ?   432.699   -173.083     341.195    -173.083     91.1649    6.91705      
1 1 1 5   3  27 o 0 195.1   25.2  ?     ?   323.086   158.482      340.719    158.482      28.103     158.482      
1 1 1 5   3  28 o 0 30.3    24    ?     ?   80.589    141.983      118.098    141.983      41.8413    141.983      
1 1 1 -5  5  28 < 0 41.7    25.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  5  27 o 0 8       18.5  ?     ?   194.728   62.2406      28.8735    -117.759     208.758    -117.759     
1 1 1 -5  5  26 o 0 19.4    18.8  ?     ?   93.3401   13.0941      59.6971    13.0941      28.7117    -166.906     
1 1 1 -5  5  25 o 0 112.9   19.7  ?     ?   185.273   -36.7206     289.586    -36.7206     101.969    -36.7206     
1 1 1 -5  5  24 o 0 29.8    17.3  ?     ?   66.5191   67.2435      77.9529    67.2435      10.3438    67.2435      
1 1 1 -5  5  23 o 0 228.5   17.1  ?     ?   249.364   16.0486      449.313    16.0486      215.351    16.0486      
1 1 1 -5  5  22 o 0 195.9   15.7  ?     ?   280.38    32.7045      375.089    32.7045      110.273    32.7045      
1 1 1 -5  5  21 o 0 128.6   13.1  ?     ?   312.372   120.782      213.37     120.782      92.2445    -59.2184     
1 1 1 -5  5  20 o 0 70.1    10.5  ?     ?   116.378   111.971      186.582    111.971      69.6663    111.971      
1 1 1 -5  5  19 o 0 99.1    11.3  ?     ?   188.479   105.86       218.103    105.86       23.5968    105.86       
1 1 1 -5  5  18 o 0 64.7    12.8  ?     ?   164.665   99.4473      89.8157    99.4473      62.0236    -80.5527     
1 1 1 -5  5  17 o 0 359.7   13.8  ?     ?   312.178   7.00348      492.529    7.00348      204.741    7.00348      
1 1 1 -5  5  16 o 0 209.9   9.6   ?     ?   348.273   -17.3627     252.513    -17.3627     78.0323    162.637      
1 1 1 -5  5  15 o 0 780.8   17.5  ?     ?   543.985   31.5262      697.138    31.5262      170.582    31.5262      
1 1 1 -5  5  14 o 0 94.8    8.4   ?     ?   213.636   -113.647     104.735    -113.647     98.0854    66.3527      
1 1 1 -5  5  13 f 1 1818.9  33.5  ?     ?   944.896   -39.3723     965.752    -39.3723     45.9351    -39.3723     
1 1 1 -5  5  12 o 0 450.6   14    ?     ?   255.68    -73.1777     618.513    -73.1777     369.305    -73.1777     
1 1 1 -5  5  11 f 1 491     11.7  ?     ?   352.229   -111.535     625.279    -111.535     259.803    -111.535     
1 1 1 -5  5  10 o 0 1607.4  30    ?     ?   581.607   -114.469     1287.81    -114.469     691.303    -114.469     
1 1 1 -5  5  9  o 0 475.4   14.1  ?     ?   531.284   -169.53      460.664    -169.53      86.969     10.4697      
1 1 1 -5  5  8  o 0 473.2   9.2   ?     ?   567.962   -141.816     425.266    -141.816     162.821    38.1837      
1 1 1 -5  5  7  o 0 95.2    2.8   ?     ?   305.522   37.5541      76.5743    37.5541      245.518    -142.446     
1 1 1 -5  5  6  o 0 930     16.8  ?     ?   583.132   -14.853      863.748    -14.853      246.917    -14.853      
1 1 1 -5  5  5  o 0 1282.1  22.6  ?     ?   610.902   -33.1138     1104.13    -33.1138     456.174    -33.1138     
1 1 1 -5  5  4  o 0 669     12.4  ?     ?   462.572   -11.9177     695.409    -11.9177     241.318    -11.9177     
1 1 1 -5  5  3  o 0 1446.5  25.4  ?     ?   898.887   -126.7       854.951    -126.7       28.5211    53.3         
1 1 1 -5  5  2  o 0 291.8   5.9   ?     ?   490.219   -74.9439     264.346    -74.9439     217.667    105.056      
1 1 1 -5  5  1  o 0 484.8   9.5   ?     ?   518.318   58.7914      468.347    58.7914      41.1269    -121.209     
1 1 1 5   5  0  o 0 797.5   14.9  ?     ?   742.114   15.4752      546.97     15.4752      178.382    -164.525     
1 1 1 5   5  1  o 0 1098.7  20.6  ?     ?   636.21    -91.2404     873.323    -91.2404     250.276    -91.2404     
1 1 1 5   5  2  o 0 309.4   6.5   ?     ?   394.934   66.6731      369.083    66.6731      18.2322    -113.327     
1 1 1 5   5  3  o 0 124.6   3.2   ?     ?   282.938   125.039      152.886    125.039      124.798    -54.9614     
1 1 1 5   5  4  o 0 1763.4  31.1  ?     ?   979.465   135.028      959.697    135.028      1.51953    -44.9721     
1 1 1 5   5  5  o 0 944.7   17.4  ?     ?   585.555   -155.6       876.388    -155.6       254.828    -155.6       
1 1 1 5   5  6  o 0 1377.7  24.9  ?     ?   729.771   168.452      1048.97    168.452      275.643    168.452      
1 1 1 5   5  7  o 0 348     7.1   ?     ?   465.07    134.891      383.597    134.891      112.31     -45.1093     
1 1 1 5   5  8  o 0 4919.2  84.2  ?     ?   1230.02   120.595      2108.57    120.595      830.447    120.595      
1 1 1 5   5  9  o 0 285     9.1   ?     ?   520.132   11.9521      234.772    11.9521      303.673    -168.048     
1 1 1 5   5  10 o 0 78.5    4.4   ?     ?   353.973   -77.635      7.60813    102.365      372.458    102.365      
1 1 1 5   5  11 f 1 184.8   7     ?     ?   368.411   -87.7762     202.431    -87.7762     181.986    92.2238      
1 1 1 5   5  12 o 0 201.3   8.5   ?     ?   414.95    88.4617      181.56     88.4617      225.399    -91.5383     
1 1 1 5   5  13 f 1 33.2    7     ?     ?   320.867   138.243      135.346    -41.7574     449.811    -41.7574     
1 1 1 5   5  14 o 0 139.3   10.4  ?     ?   201.82    112.438      204.168    112.438      11.1677    112.438      
1 1 1 5   5  15 o 0 1438.6  29.6  ?     ?   902.113   175.575      836.712    175.575      32.785     -4.4246      
1 1 1 5   5  16 o 0 735.8   20.6  ?     ?   675.98    119.096      548.725    119.096      98.1677    -60.9037     
1 1 1 5   5  17 o 0 883.4   22.8  ?     ?   727.296   -172.946     633.005    -172.946     43.3539    7.05403      
1 1 1 5   5  18 o 0 468     16.2  ?     ?   351.954   -179.365     592.506    -179.365     264.962    -179.365     
1 1 1 5   5  19 o 0 503.5   18.4  ?     ?   426.887   -27.5479     640.227    -27.5479     195.404    -27.5479     
1 1 1 5   5  20 o 0 39.4    13.5  ?     ?   86.5615   -47.7057     72.403     -47.7057     15.4455    132.294      
1 1 1 5   5  21 o 0 224.4   16.4  ?     ?   181.637   156.299      501.892    156.299      322.288    156.299      
1 1 1 5   5  22 o 0 177.2   17    ?     ?   269.16    -29.8884     354.537    -29.8884     97.4843    -29.8884     
1 1 1 5   5  23 o 0 210.7   17.8  ?     ?   321.091   7.52109      363.926    7.52109      59.1652    7.52109      
1 1 1 5   5  24 o 0 85.1    20.4  ?     ?   250.646   -93.1193     165.469    -93.1193     92.3697    86.8807      
1 1 1 5   5  25 o 0 180.6   25    ?     ?   386.841   -105.779     237.432    -105.779     159.24     74.2214      
1 1 1 5   5  26 o 0 79.7    28.3  ?     ?   232.056   -70.8467     150.01     -70.8467     72.667     109.153      
1 1 1 5   5  27 o 0 129.4   31.7  ?     ?   167.731   37.2308      331.883    37.2308      174.475    37.2308      
1 1 1 -5  7  27 < 0 21.8    26.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  7  26 o 0 44.5    22.6  ?     ?   84.2821   -82.8737     155.945    -82.8737     79.1792    -82.8737     
1 1 1 -5  7  25 f 1 49.3    19.4  ?     ?   106.767   -102.719     158.23     -102.719     58.2421    -102.719     
1 1 1 -5  7  24 o 0 99.4    19.4  ?     ?   131.477   -7.22793     292.493    -7.22793     161.537    -7.22793     
1 1 1 -5  7  23 o 0 66      18.1  ?     ?   58.067    -171.548     201.353    -171.548     143.31     -171.548     
1 1 1 -5  7  22 o 0 384.8   17    ?     ?   384.378   92.5549      537.635    92.5549      179.896    92.5549      
1 1 1 -5  7  21 f 1 279.2   15.3  ?     ?   311.309   98.1848      470.211    98.1848      179.634    98.1848      
1 1 1 -5  7  20 o 0 71.9    11.6  ?     ?   203.056   133.097      161.972    133.097      33.3242    -46.9032     
1 1 1 -5  7  19 f 1 245.2   11.8  ?     ?   415.667   93.8267      314.387    93.8267      98.1633    -86.1733     
1 1 1 -5  7  18 o 0 12.2    9.7   ?     ?   90.8321   105.343      42.622     -74.6569     134.736    -74.6569     
1 1 1 -5  7  17 o 0 331.8   11.9  ?     ?   483.658   -67.7472     321.123    -67.7472     117.05     112.253      
1 1 1 -5  7  16 o 0 225.6   10.6  ?     ?   297.707   69.7839      319.536    69.7839      49.9608    69.7839      
1 1 1 -5  7  15 o 0 108.5   8.2   ?     ?   276.29    147.187      129.023    147.187      123.115    -32.8133     
1 1 1 -5  7  14 o 0 336.8   12.6  ?     ?   341.189   57.4384      427.914    57.4384      107.58     57.4384      
1 1 1 -5  7  13 f 1 795.4   18.8  ?     ?   564.079   90.7875      687.123    90.7875      151.112    90.7875      
1 1 1 -5  7  12 o 0 3449.6  71.4  ?     ?   1335.17   56.0891      1307.69    56.0891      55.702     56.0891      
1 1 1 -5  7  11 o 0 2917.4  67.4  ?     ?   1100.79   30.2659      1324.94    30.2659      286.557    30.2659      
1 1 1 -5  7  10 o 0 24.2    7.3   ?     ?   144.233   -2.18888     62.3298    177.811      200.937    177.811      
1 1 1 -5  7  9  o 0 810.1   23.5  ?     ?   768.067   10.0667      500.173    10.0667      241.598    -169.933     
1 1 1 -5  7  8  o 0 1827.9  46.2  ?     ?   806.085   151.614      1106.94    151.614      325.01     151.614      
1 1 1 -5  7  7  o 0 907.1   18    ?     ?   360.903   28.3413      999.378    28.3413      633.791    28.3413      
1 1 1 -5  7  6  o 0 280.6   6.4   ?     ?   229.997   18.1668      459.387    18.1668      225.647    18.1668      
1 1 1 -5  7  5  f 1 410.9   8.4   ?     ?   652.351   41.356       263.797    41.356       404.335    -138.644     
1 1 1 -5  7  4  o 0 438.8   9.1   ?     ?   491.52    -99.6128     452.608    -99.6128     49.2309    80.3872      
1 1 1 -5  7  3  o 0 219.4   6.2   ?     ?   352.836   135.765      281.77     135.765      78.9662    -44.2352     
1 1 1 -5  7  2  o 0 721.6   14    ?     ?   664.09    162.057      572.178    162.057      107.293    -17.9431     
1 1 1 -5  7  1  o 0 677.5   15    ?     ?   673.97    -152.915     522.685    -152.915     167.011    27.0849      
1 1 1 5   7  0  o 0 1082.5  23.7  ?     ?   419.517   79.9732      1088.61    79.9732      660.409    79.9732      
1 1 1 5   7  1  o 0 1902.8  48.9  ?     ?   961.972   33.4063      1076.64    33.4063      93.7449    33.4063      
1 1 1 5   7  2  o 0 1489.3  31.4  ?     ?   971.337   47.1809      828.505    47.1809      164.509    -132.819     
1 1 1 5   7  3  o 0 229.3   6     ?     ?   508.535   -131.068     159.407    -131.068     360.484    48.9318      
1 1 1 5   7  4  o 0 275.5   6.3   ?     ?   261.699   -87.3003     435.851    -87.3003     168.465    -87.3003     
1 1 1 5   7  5  f 1 1284.9  27.2  ?     ?   561.287   -78.626      1095.22    -78.626      519.49     -78.626      
1 1 1 5   7  6  o 0 1045.4  22.8  ?     ?   782.801   5.00062      714.329    5.00062      83.0244    -174.999     
1 1 1 5   7  7  o 0 2140.9  37.6  ?     ?   1043.31   -41.6387     1116.96    -41.6387     56.9136    -41.6387     
1 1 1 5   7  8  o 0 1905.4  33.8  ?     ?   967.974   -53.6095     998.822    -53.6095     56.3433    -53.6095     
1 1 1 5   7  9  o 0 1688.8  34.7  ?     ?   1035.49   -9.39193     816.399    -9.39193     188.063    170.608      
1 1 1 5   7  10 o 0 664.9   15.1  ?     ?   674.278   -62.5751     467.589    -62.5751     183.681    117.425      
1 1 1 5   7  11 o 0 1849.9  34.1  ?     ?   949.997   -43.9378     985.051    -43.9378     83.7982    -43.9378     
1 1 1 5   7  12 o 0 271     11    ?     ?   448.255   1.69224      252.971    1.69224      170.007    -178.308     
1 1 1 5   7  13 f 1 442.3   13.9  ?     ?   231.157   -158.313     624.23     -158.313     403.066    -158.313     
1 1 1 5   7  14 o 0 930.9   21.7  ?     ?   574.691   -51.6882     783.971    -51.6882     240.402    -51.6882     
1 1 1 5   7  15 o 0 79.5    10.1  ?     ?   146.248   -131.269     100.548    -131.269     33.9777    48.7309      
1 1 1 5   7  16 o 0 166.3   12    ?     ?   418.048   153.613      146.067    153.613      239.03     -26.3872     
1 1 1 5   7  17 o 0 381.5   14.8  ?     ?   351.26    140.134      490.079    140.134      168.992    140.134      
1 1 1 5   7  18 o 0 6.7     13    ?     ?   143.15    -152.144     79.8479    27.8557      226.397    27.8557      
1 1 1 5   7  19 f 1 102.5   15.8  ?     ?   221.851   129.006      217.423    129.006      4.96589    -50.9943     
1 1 1 5   7  20 o 0 33.1    15.2  ?     ?   216.557   43.1538      10.6465    43.1538      199.82     -136.846     
1 1 1 5   7  21 f 1 69.3    16.3  ?     ?   254.872   97.9114      118.797    97.9114      121.716    -82.0886     
1 1 1 5   7  22 o 0 96.4    22.6  ?     ?   299.109   74.2607      147.751    74.2607      133.826    -105.739     
1 1 1 5   7  23 o 0 212.9   25.8  ?     ?   336.055   15.1974      343.643    15.1974      3.69873    15.1974      
1 1 1 5   7  24 o 0 92      24.8  ?     ?   105.545   -152.742     285.559    -152.742     182.703    -152.742     
1 1 1 5   7  25 f 1 -18.8   28.8  ?     ?   178.8     -159.343     33.7557    20.6567      203.381    20.6567      
1 1 1 5   7  26 o 0 -19.1   29.9  ?     ?   66.3539   -102.991     41.7166    -102.991     19.5371    77.0088      
1 1 1 -5  9  25 < 0 40.5    20.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  9  24 o 0 26.3    18.3  ?     ?   113.027   170.312      77.0596    170.312      24.3308    -9.68805     
1 1 1 -5  9  23 o 0 9.7     14.9  ?     ?   105.471   -158.498     7.43702    -158.498     91.5761    21.5021      
1 1 1 -5  9  22 o 0 60.7    16    ?     ?   141.292   -83.0589     181.328    -83.0589     42.5655    -83.0589     
1 1 1 -5  9  21 o 0 160.5   16.7  ?     ?   180.882   64.6786      387.813    64.6786      209.638    64.6786      
1 1 1 -5  9  20 o 0 255.6   14.2  ?     ?   314.003   107.561      424.009    107.561      138.698    107.561      
1 1 1 -5  9  19 o 0 136.7   13    ?     ?   268.934   112.445      265.878    112.445      20.0789    112.445      
1 1 1 -5  9  18 o 0 113.8   11.8  ?     ?   161.394   45.5115      290.612    45.5115      137.937    45.5115      
1 1 1 -5  9  17 o 0 191.9   11.1  ?     ?   471.327   32.9078      174.421    32.9078      283.017    -147.092     
1 1 1 -5  9  16 o 0 248.2   11.6  ?     ?   339.706   4.94237      372.745    4.94237      34.3811    4.94237      
1 1 1 -5  9  15 o 0 145.3   10    ?     ?   126.662   16.2785      335.064    16.2785      207.903    16.2785      
1 1 1 -5  9  14 f 1 42.7    7     ?     ?   229.649   -81.6043     3.63075    98.3957      210.403    98.3957      
1 1 1 -5  9  13 o 0 318.8   10.7  ?     ?   195.065   -103.818     491.771    -103.818     317.344    -103.818     
1 1 1 -5  9  12 f 1 168.4   8.5   ?     ?   234.052   140.292      263.075    140.292      51.3424    140.292      
1 1 1 -5  9  11 o 0 102.5   6.6   ?     ?   296.748   96.6478      85.576     96.6478      188.82     -83.3522     
1 1 1 -5  9  10 o 0 500     12.3  ?     ?   349.963   -73.0627     594.732    -73.0627     269.352    -73.0627     
1 1 1 -5  9  9  o 0 615     13.5  ?     ?   409.768   43.187       654.898    43.187       267.385    43.187       
1 1 1 -5  9  8  o 0 190.4   7.6   ?     ?   112.881   -161.221     260.433    -161.221     156.028    -161.221     
1 1 1 -5  9  7  o 0 1       3.7   ?     ?   154.543   -97.4526     133.945    82.5474      277.44     82.5474      
1 1 1 -5  9  6  o 0 166.5   6.5   ?     ?   449.524   -97.964      92.9405    -97.964      325.837    82.036       
1 1 1 -5  9  5  f 1 2909.5  73.9  ?     ?   1297.53   -52.5516     1106.41    -52.5516     128.026    127.448      
1 1 1 -5  9  4  o 0 248.2   9.4   ?     ?   334.698   54.6825      307.284    54.6825      10.2059    -125.317     
1 1 1 -5  9  3  o 0 653.9   19.6  ?     ?   568.878   -93.5267     544.673    -93.5267     4.15455    -93.5267     
1 1 1 -5  9  2  o 0 586.7   26.6  ?     ?   438.696   134.718      598.063    134.718      180.775    134.718      
1 1 1 -5  9  1  f 1 858.1   25.3  ?     ?   483.769   172.359      781.432    172.359      318.631    172.359      
1 1 1 5   9  0  o 0 828.9   17.5  ?     ?   564.199   -133.798     691.252    -133.798     154.467    -133.798     
1 1 1 5   9  1  f 1 692.6   15.7  ?     ?   664.887   6.56734      489.591    6.56734      146.523    -173.433     
1 1 1 5   9  2  o 0 1005.9  22.4  ?     ?   725.866   -15.7858     674.722    -15.7858     16.168     164.214      
1 1 1 5   9  3  o 0 1257.7  29.1  ?     ?   943.545   176.92       638.662    176.92       258.959    -3.08029     
1 1 1 5   9  4  o 0 507.5   10.7  ?     ?   566.606   -28.667      413.245    -28.667      125.226    151.333      
1 1 1 5   9  5  f 1 4462.5  76.2  ?     ?   1633.39   14.1319      1356.46    14.1319      201.342    -165.868     
1 1 1 5   9  6  o 0 624.7   13.6  ?     ?   685.335   -61.7791     420.61     -61.7791     219.829    118.221      
1 1 1 5   9  7  o 0 444.6   10.5  ?     ?   575.596   138.963      344.832    138.963      191.605    -41.037      
1 1 1 5   9  8  o 0 992.8   20    ?     ?   371.197   162.331      965.405    162.331      620.589    162.331      
1 1 1 5   9  9  o 0 26.4    6.4   ?     ?   82.2032   -68.3741     30.9129    111.626      109.035    111.626      
1 1 1 5   9  10 o 0 261.6   8.5   ?     ?   250.825   -133.758     386.388    -133.758     151.893    -133.758     
1 1 1 5   9  11 o 0 1042.5  22.6  ?     ?   977.976   36.8481      490.332    36.8481      419.502    -143.152     
1 1 1 5   9  12 f 1 629.8   15.4  ?     ?   859.706   88.3205      294.576    88.3205      488.335    -91.6795     
1 1 1 5   9  13 o 0 602.1   16    ?     ?   479.147   127.231      596.676    127.231      165.128    127.231      
1 1 1 5   9  14 f 1 264.5   12    ?     ?   377.376   139.602      320.52     139.602      21.9002    -40.3979     
1 1 1 5   9  15 o 0 169.9   13.3  ?     ?   397.886   37.162       193.515    37.162       209.251    -142.838     
1 1 1 5   9  16 o 0 580.3   21.7  ?     ?   595.111   10.2427      550.54     10.2427      37.0053    -169.757     
1 1 1 5   9  17 o 0 -6.2    11.4  ?     ?   106.769   84.4034      70.9196    -95.5966     175.51     -95.5966     
1 1 1 5   9  18 o 0 52.5    12.7  ?     ?   230.967   150.069      79.8357    150.069      140.806    -29.9313     
1 1 1 5   9  19 o 0 9.8     13.8  ?     ?   148.813   132.669      31.2205    -47.331      168.64     -47.331      
1 1 1 5   9  20 o 0 26.5    15.6  ?     ?   100.723   116.151      58.0801    116.151      35.2443    -63.849      
1 1 1 5   9  21 o 0 -1.6    17.7  ?     ?   7.30687   -54.5818     0.332241   -54.5818     6.94708    125.418      
1 1 1 5   9  22 o 0 24.6    27.1  ?     ?   133.592   -106.318     60.8681    -106.318     71.8902    73.6821      
1 1 1 5   9  23 o 0 146.8   22.1  ?     ?   310.074   -75.2025     253.272    -75.2025     35.2761    104.798      
1 1 1 5   9  24 o 0 70.8    27    ?     ?   207.877   -76.0443     141.082    -76.0443     47.7992    103.956      
1 1 1 5   9  25 < 0 82.6    28.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  11 23 < 0 -7.2    23.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  11 22 o 0 64.9    18.3  ?     ?   140.981   159.541      195.583    159.541      71.884     159.541      
1 1 1 -5  11 21 o 0 32.3    20.1  ?     ?   74.7409   22.464       98.3818    22.464       31.2262    22.464       
1 1 1 -5  11 20 o 0 68.6    18.3  ?     ?   144.88    177.761      197.041    177.761      62.7264    177.761      
1 1 1 -5  11 19 o 0 231.7   18.5  ?     ?   332.338   149.355      366.087    149.355      46.5137    149.355      
1 1 1 -5  11 18 o 0 56.2    15.1  ?     ?   176.184   -160.637     133.691    -160.637     23.8432    19.3626      
1 1 1 -5  11 17 o 0 14.7    13.1  ?     ?   164.673   -0.560935    22.5285    179.439      169.797    179.439      
1 1 1 -5  11 16 o 0 429.5   15.5  ?     ?   419.585   30.9066      548.825    30.9066      171.825    30.9066      
1 1 1 -5  11 15 o 0 82.6    10.7  ?     ?   95.1819   -117.484     228.233    -117.484     139.825    -117.484     
1 1 1 -5  11 14 f 1 72.1    9.5   ?     ?   184.163   -112.531     171.566    -112.531     1.6691     67.4695      
1 1 1 -5  11 13 o 0 220.3   10.8  ?     ?   268.143   157.58       396.997    157.58       139.988    157.58       
1 1 1 -5  11 12 o 0 99.7    8     ?     ?   146.562   -56.6567     225.851    -56.6567     81.9377    -56.6567     
1 1 1 -5  11 11 o 0 85.3    7.5   ?     ?   168.532   147.904      183.98     147.904      17.4874    147.904      
1 1 1 -5  11 10 o 0 411.9   10.5  ?     ?   528.287   48.0878      363.357    48.0878      101.445    -131.912     
1 1 1 -5  11 9  o 0 110.4   7     ?     ?   101.459   160.454      180.235    160.454      90.5163    160.454      
1 1 1 -5  11 8  o 0 120.9   6.5   ?     ?   176.324   110.533      186.639    110.533      31.37      110.533      
1 1 1 -5  11 7  f 1 236.6   7.8   ?     ?   523.377   -153.191     156.175    -153.191     308.939    26.8093      
1 1 1 -5  11 6  o 0 41.5    5     ?     ?   330.224   115.505      83.7006    -64.4949     376.683    -64.4949     
1 1 1 -5  11 5  o 0 197.9   7.7   ?     ?   490.714   139.604      114.254    139.604      331.704    -40.3962     
1 1 1 -5  11 4  o 0 573.5   13.9  ?     ?   522.524   -92.482      515.581    -92.482      39.5504    -92.482      
1 1 1 -5  11 3  o 0 231.6   7.2   ?     ?   321.907   -71.0787     293.092    -71.0787     0.74143    108.921      
1 1 1 -5  11 2  o 0 443.9   14.3  ?     ?   579.711   -95.7771     344.416    -95.7771     185.498    84.2229      
1 1 1 -5  11 1  o 0 1098.5  21.9  ?     ?   577.26    70.0656      870.498    70.0656      342.323    70.0656      
1 1 1 5   11 0  o 0 74.6    5.1   ?     ?   265.446   -120.283     35.1199    -120.283     208.095    59.7171      
1 1 1 5   11 1  o 0 25.6    5.1   ?     ?   222.696   -39.7973     96.1155    140.203      300.16     140.203      
1 1 1 5   11 2  o 0 320.5   8.6   ?     ?   488.947   92.6946      283.505    92.6946      164.286    -87.3054     
1 1 1 5   11 3  o 0 12.1    4.9   ?     ?   57.9361   -170.718     38.4182    9.28232      91.4286    9.28232      
1 1 1 5   11 4  o 0 79.8    5.7   ?     ?   147.036   17.5531      77.9273    17.5531      56.4173    -162.447     
1 1 1 5   11 5  o 0 553.1   14.2  ?     ?   609.74    -1.43537     424.059    -1.43537     131.985    178.565      
1 1 1 5   11 6  o 0 890.5   21.6  ?     ?   632.611   -57.1936     692.025    -57.1936     128.515    -57.1936     
1 1 1 5   11 7  f 1 1477.2  42.7  ?     ?   924.479   -27.7618     803.868    -27.7618     21.4223    152.238      
1 1 1 5   11 8  o 0 660.2   18.5  ?     ?   609.554   -94.7656     529.037    -94.7656     10.4556    85.2344      
1 1 1 5   11 9  o 0 85.4    8.3   ?     ?   182.49    107.794      136.101    107.794      26.1783    -72.2055     
1 1 1 5   11 10 o 0 417.8   12.5  ?     ?   424.051   -123.87      456.725    -123.87      81.3385    -123.87      
1 1 1 5   11 11 o 0 171.5   9.8   ?     ?   380.249   -175.62      209.69     -175.62      168.47     4.38037      
1 1 1 5   11 12 o 0 18.4    9     ?     ?   123.771   99.6259      36.512     -80.3741     158.923    -80.3741     
1 1 1 5   11 13 o 0 156.9   11.1  ?     ?   268.16    -18.5186     290.621    -18.5186     31.6081    -18.5186     
1 1 1 5   11 14 f 1 60.5    10.7  ?     ?   114.141   -157.767     169.684    -157.767     61.4307    -157.767     
1 1 1 5   11 15 o 0 69.8    13.6  ?     ?   234.768   1.07604      127.299    1.07604      92.6737    -178.924     
1 1 1 5   11 16 o 0 35.7    15    ?     ?   152.598   71.005       69.3437    71.005       69.0387    -108.995     
1 1 1 5   11 17 o 0 63.6    13.4  ?     ?   127.288   150.267      183.133    150.267      68.1851    150.267      
1 1 1 5   11 18 o 0 37.6    15.3  ?     ?   52.4877   108.081      80.268     108.081      32.8537    108.081      
1 1 1 5   11 19 o 0 51.3    18.7  ?     ?   132.286   144.672      141.606    144.672      13.0283    144.672      
1 1 1 5   11 20 o 0 124     21.2  ?     ?   312.581   -129.731     193.88     -129.731     99.1776    50.2694      
1 1 1 5   11 21 o 0 24.9    20.9  ?     ?   84.5331   107.801      76.9698    107.801      0.119355   107.801      
1 1 1 5   11 22 o 0 74.9    24.5  ?     ?   238.524   24.4342      134.418    24.4342      77.4424    -155.566     
1 1 1 5   11 23 < 0 -26     25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  13 20 < 0 35.2    21.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  13 19 o 0 176.5   23.1  ?     ?   266.169   -78.5051     329.008    -78.5051     100.425    -78.5051     
1 1 1 -5  13 18 o 0 16.9    17.1  ?     ?   156.549   -70.8793     14.6386    -70.8793     122.879    109.121      
1 1 1 -5  13 17 o 0 -0.6    16.4  ?     ?   67.5986   70.6112      1.83796    70.6112      59.3584    -109.389     
1 1 1 -5  13 16 o 0 73.3    14.4  ?     ?   261.978   -163.278     115.526    -163.278     132.02     16.7225      
1 1 1 -5  13 15 o 0 376.9   17.7  ?     ?   364.375   179.426      524.913    179.426      180.389    179.426      
1 1 1 -5  13 14 o 0 132.4   13.6  ?     ?   249.953   -88.7826     258.676    -88.7826     39.2912    -88.7826     
1 1 1 -5  13 13 o 0 15.1    10.8  ?     ?   117.565   -5.39521     3.50117    174.605      106.528    174.605      
1 1 1 -5  13 12 o 0 9       8.8   ?     ?   65.4214   -85.7068     14.4545    94.2932      71.9536    94.2932      
1 1 1 -5  13 11 o 0 147.4   9.6   ?     ?   295.795   -39.9943     257.551    -39.9943     4.03945    140.006      
1 1 1 -5  13 10 o 0 37.7    8.5   ?     ?   178.108   71.8304      62.7637    71.8304      99.6944    -108.17      
1 1 1 -5  13 9  f 1 105.9   7.8   ?     ?   156.966   -136.735     267.709    -136.735     123.049    -136.735     
1 1 1 -5  13 8  o 0 103.5   7.5   ?     ?   326.269   -68.2412     127.292    -68.2412     178.377    111.759      
1 1 1 -5  13 7  f 1 252.4   9     ?     ?   72.6088   28.5483      506.976    28.5483      438.314    28.5483      
1 1 1 -5  13 6  o 0 370.8   10.8  ?     ?   415.226   -108.002     455.339    -108.002     56.2756    -108.002     
1 1 1 -5  13 5  o 0 140.5   7.4   ?     ?   343.449   -115.729     177.902    -115.729     153.237    64.2709      
1 1 1 -5  13 4  o 0 15.8    5.1   ?     ?   153.221   -150.389     57.5819    29.6106      205.711    29.6106      
1 1 1 -5  13 3  o 0 112.4   6.4   ?     ?   316.102   37.1199      143.769    37.1199      162.507    -142.88      
1 1 1 -5  13 2  f 1 27.8    5.4   ?     ?   86.8474   30.0664      12.0441    30.0664      72.6832    -149.934     
1 1 1 -5  13 1  o 0 194.5   9.1   ?     ?   206.848   49.9948      383.345    49.9948      182.325    49.9948      
1 1 1 5   13 0  o 0 59.4    6.6   ?     ?   202.969   -105.463     91.0629    -105.463     106.76     74.5368      
1 1 1 5   13 1  o 0 50.2    6.8   ?     ?   171.867   98.7803      76.2844    98.7803      91.1635    -81.2197     
1 1 1 5   13 2  f 1 288.1   9.5   ?     ?   304.873   -116.777     449.852    -116.777     151.532    -116.777     
1 1 1 5   13 3  o 0 243.1   9.1   ?     ?   229.056   -34.8471     445.394    -34.8471     222.692    -34.8471     
1 1 1 5   13 4  o 0 77.5    6.7   ?     ?   52.418    37.2712      111.357    37.2712      60.4825    37.2712      
1 1 1 5   13 5  o 0 121.6   7.7   ?     ?   197.089   13.2688      251.304    13.2688      60.4441    13.2688      
1 1 1 5   13 6  o 0 64.4    6.9   ?     ?   63.3286   170.644      131.361    170.644      71.2684    170.644      
1 1 1 5   13 7  f 1 9.8     7.3   ?     ?   134.605   130.228      62.6499    -49.772      190.622    -49.772      
1 1 1 5   13 8  o 0 188.7   9.7   ?     ?   279.312   178.539      330.63     178.539      67.4191    178.539      
1 1 1 5   13 9  f 1 46.6    8.6   ?     ?   156.22    -139.171     107.638    -139.171     37.2499    40.8288      
1 1 1 5   13 10 o 0 126.7   10.4  ?     ?   353.286   -51.9394     162.673    -51.9394     161.775    128.061      
1 1 1 5   13 11 o 0 21      10.2  ?     ?   221.271   65.8778      34.4962    -114.122     231.617    -114.122     
1 1 1 5   13 12 o 0 114.4   11.6  ?     ?   281.327   -105.934     203.197    -105.934     45.9992    74.0664      
1 1 1 5   13 13 o 0 84.8    12.4  ?     ?   160.575   -30.4253     220.826    -30.4253     78.9366    -30.4253     
1 1 1 5   13 14 o 0 35.1    12.9  ?     ?   72.9209   47.7496      86.6721    47.7496      22.1048    47.7496      
1 1 1 5   13 15 o 0 69.3    18.4  ?     ?   163       155.892      182.098    155.892      26.5435    155.892      
1 1 1 5   13 16 o 0 6.5     17.4  ?     ?   61.7345   118.93       15.9305    118.93       42.975     -61.0701     
1 1 1 5   13 17 o 0 188.5   25.6  ?     ?   214.055   -170.187     393.389    -170.187     197.612    -170.187     
1 1 1 5   13 18 o 0 51.4    19.4  ?     ?   147.964   146.209      135.445    146.209      4.06593    146.209      
1 1 1 5   13 19 o 0 28.4    21.4  ?     ?   114.515   -66.4871     82.7428    -66.4871     16.7113    113.513      
1 1 1 5   13 20 < 0 -30.4   19.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  15 17 < 0 42.1    17    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  15 16 o 0 10.8    17.5  ?     ?   83.1397   74.099       46.5951    74.099       22.6655    -105.901     
1 1 1 -5  15 15 o 0 54.7    15.9  ?     ?   222.382   -99.8181     103.351    -99.8181     83.0271    80.1819      
1 1 1 -5  15 14 o 0 132.1   15.6  ?     ?   287.569   -83.0974     230.821    -83.0974     15.2865    96.9026      
1 1 1 -5  15 13 o 0 -3.3    14.3  ?     ?   129.707   -47.7944     30.7712    132.206      142.593    132.206      
1 1 1 -5  15 12 o 0 33      13    ?     ?   172.209   88.0816      54.602     88.0816      98.0648    -91.9184     
1 1 1 -5  15 11 o 0 68.8    13.2  ?     ?   116.961   38.5556      210.529    38.5556      102.543    38.5556      
1 1 1 -5  15 10 o 0 61      13.6  ?     ?   238.857   -57.7318     98.9393    -57.7318     121.236    122.268      
1 1 1 -5  15 9  o 0 152.1   11.6  ?     ?   209.069   3.85055      330.496    3.85055      136.737    3.85055      
1 1 1 -5  15 8  o 0 112.1   9.8   ?     ?   56.7774   -59.3847     281.328    -59.3847     232.616    -59.3847     
1 1 1 -5  15 7  o 0 179     9.9   ?     ?   253.701   -96.175      334.182    -96.175      115.56     -96.175      
1 1 1 -5  15 6  o 0 69.3    8.8   ?     ?   126.057   -78.3105     192.708    -78.3105     84.6019    -78.3105     
1 1 1 -5  15 5  o 0 41      7.8   ?     ?   201.504   62.9441      67.609     62.9441      105.797    -117.056     
1 1 1 -5  15 4  o 0 261.6   10.5  ?     ?   307.926   88.2653      416.84     88.2653      151.068    88.2653      
1 1 1 -5  15 3  o 0 364.5   12.7  ?     ?   366.496   107.647      498.139    107.647      181.029    107.647      
1 1 1 -5  15 2  o 0 90      8.5   ?     ?   218.238   83.5803      192.816    83.5803      4.31668    83.5803      
1 1 1 -5  15 1  o 0 109     8.4   ?     ?   228.249   80.2688      228.248    80.2688      30.7966    80.2688      
1 1 1 5   15 0  o 0 560.9   15.1  ?     ?   455.132   136.225      631.894    136.225      236.507    136.225      
1 1 1 5   15 1  o 0 152.5   9.3   ?     ?   356.824   118.776      213.289    118.776      96.485     -61.2241     
1 1 1 5   15 2  o 0 28.7    7.9   ?     ?   172.212   158.146      37.9331    158.146      111.404    -21.854      
1 1 1 5   15 3  o 0 8       8.5   ?     ?   72.3193   -147.095     18.5147    32.9047      81.3648    32.9047      
1 1 1 5   15 4  o 0 94.9    9.4   ?     ?   206.983   5.94118      212.083    5.94118      32.5692    5.94118      
1 1 1 5   15 5  o 0 33.3    8.1   ?     ?   22.283    118.96       31.967     118.96       12.6898    118.96       
1 1 1 5   15 6  o 0 298     12.7  ?     ?   396.809   -168.587     391.943    -168.587     49.6864    -168.587     
1 1 1 5   15 7  o 0 361.8   14.8  ?     ?   449.888   -160.458     421.03     -160.458     30.9494    -160.458     
1 1 1 5   15 8  o 0 149.3   13    ?     ?   279.105   -177.352     263.023    -177.352     21.9781    -177.352     
1 1 1 5   15 9  o 0 120.7   13.4  ?     ?   246.54    -117.057     239.778    -117.057     9.66974    -117.057     
1 1 1 5   15 10 o 0 9.3     10.6  ?     ?   133.658   -139.216     26.8336    40.7841      150.97     40.7841      
1 1 1 5   15 11 o 0 36.1    13.3  ?     ?   224.08    148.01       24.8566    148.01       183.689    -31.9895     
1 1 1 5   15 12 o 0 -4      16.2  ?     ?   116.617   67.5676      23.0632    -112.432     127.324    -112.432     
1 1 1 5   15 13 o 0 74.5    17.1  ?     ?   170.092   -26.2778     194.138    -26.2778     46.1844    -26.2778     
1 1 1 5   15 14 o 0 62.4    14.8  ?     ?   213.519   -34.798      131.045    -34.798      53.4127    145.202      
1 1 1 5   15 15 o 0 -2.8    21.1  ?     ?   184.873   -159.565     31.635     20.435       188.111    20.435       
1 1 1 5   15 16 < 0 -19.5   22.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 5   15 17 < 0 40.2    19.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  17 11 < 0 114     22.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  17 10 < 0 34.8    16.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -5  17 9  o 0 40.5    14.1  ?     ?   161.693   -30.423      98.6523    -30.423      33.5667    149.577      
1 1 1 -5  17 8  o 0 62.7    14.1  ?     ?   240.69    54.9159      112.651    54.9159      84.7295    -125.084     
1 1 1 -5  17 7  o 0 78.9    13.3  ?     ?   210.103   -113.375     178.293    -113.375     5.19719    -113.375     
1 1 1 -5  17 6  o 0 23.5    12.4  ?     ?   64.3575   -103.59      60.2016    -103.59      6.25635    -103.59      
1 1 1 -5  17 5  o 0 82.8    13.1  ?     ?   175.702   62.3643      210.076    62.3643      62.2589    62.3643      
1 1 1 -5  17 4  o 0 159.6   13    ?     ?   294.352   104.972      274.461    104.972      26.0308    104.972      
1 1 1 -5  17 3  o 0 135.6   12.9  ?     ?   281.958   154.098      241.386    154.098      2.76606    154.098      
1 1 1 -5  17 2  o 0 80.9    12.3  ?     ?   252.1     53.7388      143.847    53.7388      74.5405    -126.261     
1 1 1 -5  17 1  o 0 67.6    11.9  ?     ?   171.576   41.1983      172.757    41.1983      23.8574    41.1983      
1 1 1 5   17 0  f 1 41.5    11.8  ?     ?   172.879   69.0974      93.5088    69.0974      58.1148    -110.903     
1 1 1 5   17 1  o 0 67.5    11.9  ?     ?   214.908   -24.0779     141.322    -24.0779     46.0202    155.922      
1 1 1 5   17 2  o 0 18.3    11.8  ?     ?   88.9037   -66.2807     33.7785    -66.2807     43.6132    113.719      
1 1 1 5   17 3  o 0 92.1    13.3  ?     ?   121.195   98.474       267.831    98.474       164.721    98.474       
1 1 1 5   17 4  o 0 55.6    12.6  ?     ?   132.957   -172.569     167.874    -172.569     55.019     -172.569     
1 1 1 5   17 5  o 0 50.6    11.8  ?     ?   188.994   176.542      116.003    176.542      43.9716    -3.45799     
1 1 1 5   17 6  o 0 59.4    13.5  ?     ?   134.273   -174.521     175.16     -174.521     61.8733    -174.521     
1 1 1 5   17 7  o 0 54.9    14.7  ?     ?   67.0566   -30.3779     186.538    -30.3779     130.907    -30.3779     
1 1 1 5   17 8  o 0 128.8   15.6  ?     ?   242.141   -6.10606     259.768    -6.10606     59.7282    -6.10606     
1 1 1 5   17 9  o 0 51.6    19.2  ?     ?   170.837   -145.917     118.226    -145.917     22.5649    34.0833      
1 1 1 5   17 10 < 0 9.2     18.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 5   17 11 < 0 82.5    24.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  0  29 < 0 131.5   28.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  0  28 o 0 2.7     32.8  ?     ?   27.2516   180          18.3863    180          7.33192    1.75958e-14  
1 1 1 -6  0  27 o 0 45.2    22.1  ?     ?   5.55678   180          9.52281    180          4.03371    180          
1 1 1 -6  0  26 o 0 6.4     24.4  ?     ?   156.448   0            58.4448    0            103.269    180          
1 1 1 -6  0  25 f 1 102.4   21.3  ?     ?   248.018   180          234.743    180          3.41715    4.82016e-13  
1 1 1 -6  0  24 o 0 98.1    17    ?     ?   485.461   180          234.951    180          229.6      7.18023e-15  
1 1 1 -6  0  23 f 1 352.2   24.3  ?     ?   329.539   180          456.419    180          129.325    180          
1 1 1 -6  0  22 o 0 45.2    16    ?     ?   361.754   0            151.54     0            215.274    180          
1 1 1 -6  0  21 o 0 583.9   21.7  ?     ?   505.891   0            600.961    0            74.0392    0            
1 1 1 -6  0  20 o 0 34.9    13.7  ?     ?   161.668   180          66.5026    180          83.9561    5.55802e-15  
1 1 1 -6  0  19 o 0 92.2    15.4  ?     ?   185.722   180          163.031    180          9.76317    1.17169e-13  
1 1 1 -6  0  18 f 1 473.6   17.4  ?     ?   715.391   0            493.481    0            195.265    180          
1 1 1 -6  0  17 o 0 1365.2  38.7  ?     ?   955.925   0            844.298    0            78.2943    180          
1 1 1 -6  0  16 o 0 157.8   13.5  ?     ?   66.808    0            111.258    0            47.2569    0            
1 1 1 -6  0  15 o 0 274.8   12.6  ?     ?   509.595   180          373.831    180          124.139    2.113e-14    
1 1 1 -6  0  14 o 0 410     20.1  ?     ?   744.174   180          459.542    180          272.244    1.18441e-14  
1 1 1 -6  0  13 o 0 85.8    7.3   ?     ?   117.836   0            118.164    0            3.08221    180          
1 1 1 -6  0  12 o 0 501.5   15.1  ?     ?   515.978   180          541.476    180          7.71038    180          
1 1 1 -6  0  11 o 0 496.4   20.3  ?     ?   490.608   0            541.087    0            31.0828    0            
1 1 1 -6  0  10 o 0 7.7     3     ?     ?   17.1908   180          1.46861    180          16.7337    6.15812e-16  
1 1 1 -6  0  9  o 0 432.8   16.6  ?     ?   679.996   180          521.171    180          201.601    1.81393e-14  
1 1 1 -6  0  8  o 0 947.5   24    ?     ?   590.736   180          714.854    180          132.982    180          
1 1 1 -6  0  7  f 1 42.1    3.6   ?     ?   32.8117   0            16.3428    0            14.9527    180          
1 1 1 -6  0  6  o 0 1996.2  48.9  ?     ?   1332.28   180          1001.28    180          265.241    2.64878e-14  
1 1 1 -6  0  5  o 0 284.2   8.4   ?     ?   465.969   0            369.562    0            63.8615    180          
1 1 1 -6  0  4  o 0 2903.2  80.8  ?     ?   983.401   0            1157.88    0            261.228    0            
1 1 1 -6  0  3  o 0 2544.5  86.1  ?     ?   1317.46   180          1081.59    180          117.225    6.47405e-14  
1 1 1 -6  0  2  o 0 2140.9  72.8  ?     ?   741.432   180          988.389    180          316.371    180          
1 1 1 6   0  1  o 0 819.4   20.5  ?     ?   162.274   0            604.419    0            457.006    0            
1 1 1 6   0  2  o 0 132.6   5.8   ?     ?   111.638   180          147.293    180          45.1318    180          
1 1 1 6   0  3  o 0 766.3   19.4  ?     ?   628.707   180          599.912    180          22.101     180          
1 1 1 6   0  4  o 0 6437.8  153.3 ?     ?   2069.29   180          1740.3     180          164.581    7.41959e-14  
1 1 1 6   0  5  o 0 808.4   21.3  ?     ?   796.363   180          629.269    180          118.241    3.73424e-14  
1 1 1 6   0  6  o 0 1581.8  54.9  ?     ?   980.912   0            898.717    0            41.9636    180          
1 1 1 6   0  7  f 1 2.6     3.4   ?     ?   192.371   0            4.49921    0            180.552    180          
1 1 1 6   0  8  o 0 156.8   9.8   ?     ?   260.782   0            275.099    0            16.0613    0            
1 1 1 6   0  9  o 0 146.3   7.4   ?     ?   29.5835   0            57.3077    0            25.5981    0            
1 1 1 6   0  10 o 0 246.9   14.1  ?     ?   389.878   0            393.974    0            22.3538    180          
1 1 1 6   0  11 o 0 1.4     5.6   ?     ?   207.2     180          6.04437    180          211.207    2.00806e-16  
1 1 1 6   0  12 o 0 1616.6  40.6  ?     ?   722.715   180          980.702    180          226.478    180          
1 1 1 6   0  14 o 0 240.6   14.7  ?     ?   528.571   180          355.012    180          169.604    1.46873e-14  
1 1 1 6   0  15 o 0 476.9   20.4  ?     ?   301.909   0            496.393    0            198.532    0            
1 1 1 6   0  16 o 0 3234.9  84.5  ?     ?   1108.72   0            1287.04    0            214.335    0            
1 1 1 6   0  17 o 0 1035.1  37.5  ?     ?   751.756   0            742.512    0            9.49222    0            
1 1 1 6   0  18 f 1 3095.2  80.2  ?     ?   994.131   0            1274.39    0            307.065    0            
1 1 1 6   0  19 o 0 1771.1  49.9  ?     ?   937.12    0            956.719    0            75.1663    0            
1 1 1 6   0  20 o 0 38.2    22.2  ?     ?   43.457    0            18.5245    0            22.3847    180          
1 1 1 6   0  21 o 0 -35.8   22.8  ?     ?   25.4065   0            2.00814    0            24.7708    180          
1 1 1 6   0  22 o 0 -3.8    18.3  ?     ?   27.7353   180          4.30983    180          24.1623    1.25157e-15  
1 1 1 6   0  23 f 1 550.9   36    ?     ?   389.374   0            577.551    0            195.831    0            
1 1 1 6   0  24 o 0 67.5    27.7  ?     ?   322.439   180          174.675    180          138.005    8.88114e-15  
1 1 1 6   0  25 f 1 -10.8   27.6  ?     ?   60.6085   180          17.5885    180          41.4202    2.97955e-15  
1 1 1 6   0  26 o 0 427.3   47.9  ?     ?   375.32    0            509.862    0            116.305    0            
1 1 1 6   0  27 o 0 17      36.8  ?     ?   142.566   0            80.5593    0            59.4015    180          
1 1 1 -6  2  29 < 0 94.3    20.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  2  28 o 0 80.7    20.7  ?     ?   92.2239   -81.3584     287.521    -81.3584     200.995    -81.3584     
1 1 1 -6  2  27 o 0 20.6    22.6  ?     ?   140.103   -5.84768     48.4932    -5.84768     85.9712    174.152      
1 1 1 -6  2  26 o 0 58.2    24.2  ?     ?   151.709   -41.1566     152.916    -41.1567     2.74206    138.843      
1 1 1 -6  2  25 o 0 69.2    17.7  ?     ?   147.742   1.61175      208.111    1.61175      61.179     1.61175      
1 1 1 -6  2  24 o 0 67.9    15.4  ?     ?   209.031   2.34979      153.578    2.34979      45.1081    -177.65      
1 1 1 -6  2  23 o 0 72.2    13.2  ?     ?   97.7118   -77.0211     223.815    -77.021      130.325    -77.021      
1 1 1 -6  2  22 o 0 247     13.5  ?     ?   365.41    -107.713     372.37     -107.713     4.07522    -107.713     
1 1 1 -6  2  21 o 0 59.5    10.6  ?     ?   184.973   -17.7825     106.046    -17.7825     85.5287    162.218      
1 1 1 -6  2  20 o 0 117.3   11.1  ?     ?   216.114   -5.87597     200.468    -5.87597     0.40026    -5.87597     
1 1 1 -6  2  19 o 0 699.7   17.1  ?     ?   496.825   -120.494     684.295    -120.494     224.317    -120.494     
1 1 1 -6  2  18 o 0 315.9   11.4  ?     ?   522.96    -100.203     275.695    -100.203     212.57     79.7971      
1 1 1 -6  2  17 f 1 8.6     9.7   ?     ?   31.0473   132.598      22.5936    -47.4023     52.5895    -47.4023     
1 1 1 -6  2  16 o 0 2178.5  40.6  ?     ?   935.788   20.3545      1167.7     20.3545      274.489    20.3545      
1 1 1 -6  2  15 f 1 1137.1  22.9  ?     ?   718.733   -65.2024     783.944    -65.2024     80.2332    -65.2024     
1 1 1 -6  2  14 o 0 637.5   14    ?     ?   504.461   -47.5419     605.898    -47.5419     111.158    -47.5419     
1 1 1 -6  2  13 o 0 367.7   13.1  ?     ?   429.208   170.194      419.768    170.194      26.2445    -9.80607     
1 1 1 -6  2  12 o 0 542.9   12.7  ?     ?   444.348   46.4298      615.303    46.4298      156.335    46.4298      
1 1 1 -6  2  11 o 0 266.3   6.6   ?     ?   258.684   -98.2001     431.28     -98.2001     162.598    -98.2001     
1 1 1 -6  2  10 o 0 79.5    3.2   ?     ?   314.002   128.571      27.3767    128.571      305.071    -51.4294     
1 1 1 -6  2  8  o 0 1676.6  33.8  ?     ?   957.907   -17.9415     936.848    -17.9415     8.38458    162.059      
1 1 1 -6  2  6  o 0 338.1   10.2  ?     ?   392.898   52.5484      396.989    52.5484      21.7906    52.5484      
1 1 1 -6  2  5  o 0 1071.8  19.4  ?     ?   712.941   72.5897      765.83     72.5897      83.1186    72.5897      
1 1 1 -6  2  4  o 0 9145    427.5 ?     ?   2248.41   -53.2091     2064.6     -53.2091     44.6845    126.791      
1 1 1 -6  2  3  f 1 3042.7  59.8  ?     ?   1203.41   49.4472      1264.4     49.4472      150.233    49.4472      
1 1 1 -6  2  1  o 0 448.5   16    ?     ?   194.398   123.485      626.872    123.485      447.939    123.485      
1 1 1 6   2  0  o 0 5513    192.8 ?     ?   1129.13   -130.176     2127.96    -130.176     1102.75    -130.176     
1 1 1 6   2  2  o 0 1903.6  33.1  ?     ?   1199.55   -142.125     770.179    -142.125     330.144    37.8748      
1 1 1 6   2  3  f 1 3721.9  63.2  ?     ?   1163.57   -31.6935     1583.78    -31.6935     486.386    -31.6935     
1 1 1 6   2  4  o 0 2150.5  36.7  ?     ?   975.054   144.76       1116.96    144.76       200.998    144.76       
1 1 1 6   2  5  o 0 4344.2  73.4  ?     ?   1564.23   -28.4383     1468.25    -28.4383     34.2922    151.562      
1 1 1 6   2  7  o 0 445.2   8.9   ?     ?   435.127   51.179       505.508    51.179       72.2265    51.179       
1 1 1 6   2  8  o 0 220.4   5.5   ?     ?   444.347   2.69057      202.374    2.69057      238.729    -177.309     
1 1 1 6   2  9  f 1 438.7   9.5   ?     ?   469.021   -110.483     501.3      -110.483     3.50025    69.5175      
1 1 1 6   2  10 o 0 223.4   5.8   ?     ?   417.37    66.2489      245.092    66.2489      203.839    -113.751     
1 1 1 6   2  11 o 0 220.6   6.4   ?     ?   333.071   44.8838      306.831    44.8838      41.7636    -135.116     
1 1 1 6   2  12 o 0 773     15.8  ?     ?   442.317   40.8549      841.632    40.8549      381.047    40.8549      
1 1 1 6   2  13 o 0 1438.6  27.4  ?     ?   599.086   5.91878      1169.89    5.91878      542.003    5.91878      
1 1 1 6   2  14 o 0 113.2   8     ?     ?   121.903   -179.703     152.398    -179.703     31.7631    -179.703     
1 1 1 6   2  15 f 1 609.8   16.9  ?     ?   456.688   -76.5692     625.721    -76.5692     180.215    -76.5692     
1 1 1 6   2  16 o 0 2479.1  47.8  ?     ?   944.02    -136.675     1311.89    -136.675     401.866    -136.675     
1 1 1 6   2  17 f 1 357.1   18.1  ?     ?   516.299   111.893      319.663    111.893      184.338    -68.1065     
1 1 1 6   2  18 o 0 30.1    11.8  ?     ?   243.691   73.1347      84.7045    -106.865     314.699    -106.865     
1 1 1 6   2  19 o 0 94.8    14.3  ?     ?   321.562   32.9888      70.13      32.9888      230.958    -147.011     
1 1 1 6   2  20 o 0 162.2   13    ?     ?   333.876   55.1293      209.46     55.1293      103.279    -124.871     
1 1 1 6   2  21 o 0 70.3    13.9  ?     ?   128.943   62.7565      157.51     62.7565      22.321     62.7565      
1 1 1 6   2  22 o 0 52.8    18    ?     ?   147.177   46.5516      133.102    46.5516      14.6291    -133.448     
1 1 1 6   2  23 o 0 44.3    16.5  ?     ?   140.218   -92.9004     113.516    -92.9004     22.434     87.0996      
1 1 1 6   2  24 o 0 89      20.7  ?     ?   127.633   178.463      262.342    178.463      139.343    178.463      
1 1 1 6   2  25 o 0 84.4    20.9  ?     ?   241.483   130.627      173.844    130.627      78.4091    -49.3735     
1 1 1 6   2  26 o 0 213.3   23    ?     ?   298.698   118.143      390.269    118.143      79.2028    118.143      
1 1 1 6   2  27 o 0 -33     27.1  ?     ?   152.914   78.5432      36.2767    -101.457     185.322    -101.457     
1 1 1 6   2  28 o 0 10.9    24.3  ?     ?   14.9367   89.9397      27.819     89.9397      13.5783    89.9397      
1 1 1 -6  4  28 < 0 52      23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  4  27 o 0 21.1    22.7  ?     ?   160.212   58.7144      38.3862    58.7144      110.965    -121.286     
1 1 1 -6  4  26 f 1 94.2    21.2  ?     ?   82.7141   -115.895     311.036    -115.895     229.886    -115.895     
1 1 1 -6  4  25 f 1 66.7    15.5  ?     ?   183.047   -16.6662     172.215    -16.6662     14.3609    163.334      
1 1 1 -6  4  24 o 0 -1.4    13.6  ?     ?   191.963   77.2735      86.4358    -102.726     267.753    -102.726     
1 1 1 -6  4  23 o 0 78.8    12.2  ?     ?   53.4063   -14.942      205.044    -14.942      154.5      -14.942      
1 1 1 -6  4  22 o 0 199.6   12.9  ?     ?   204.469   115.258      438.7      115.258      238.949    115.258      
1 1 1 -6  4  21 o 0 426.8   19.7  ?     ?   429.551   41.4764      551.282    41.4764      120.26     41.4764      
1 1 1 -6  4  20 o 0 92.8    12.1  ?     ?   240.568   51.386       166.392    51.386       81.6431    -128.614     
1 1 1 -6  4  19 o 0 2.6     10.1  ?     ?   207.445   6.13415      144.444    -173.866     335.612    -173.866     
1 1 1 -6  4  18 o 0 66.9    9.4   ?     ?   197.263   -161.287     62.0495    -161.287     119.742    18.7125      
1 1 1 -6  4  17 o 0 229.6   9.5   ?     ?   573.622   -132.143     96.5979    -132.143     447.814    47.8568      
1 1 1 -6  4  16 f 1 242.9   11.6  ?     ?   134.335   -121.906     376.663    -121.906     247.49     -121.906     
1 1 1 -6  4  15 o 0 687.6   22.1  ?     ?   353.941   49.2705      764.912    49.2705      428.685    49.2705      
1 1 1 -6  4  14 o 0 507.1   12.4  ?     ?   575.422   -100.571     418.396    -100.571     132.149    79.4289      
1 1 1 -6  4  13 o 0 3573.5  61.1  ?     ?   1200.67   -80.4815     1504.93    -80.4815     333.139    -80.4815     
1 1 1 -6  4  12 o 0 818.2   23.1  ?     ?   490.102   -115.615     771.746    -115.615     290.394    -115.615     
1 1 1 -6  4  11 o 0 952.6   25.3  ?     ?   467.729   -178.684     954.348    -178.684     473.638    -178.684     
1 1 1 -6  4  10 o 0 1313.8  23.6  ?     ?   755.167   -123.377     941.357    -123.377     160.968    -123.377     
1 1 1 -6  4  9  o 0 1852.3  32.8  ?     ?   972.92    103.472      1056.11    103.472      45.6276    103.472      
1 1 1 -6  4  8  o 0 267.9   6.5   ?     ?   284.157   171.031      428.014    171.031      127.349    171.031      
1 1 1 -6  4  7  o 0 383.2   7.8   ?     ?   360.111   87.4789      530.339    87.4789      147.761    87.4789      
1 1 1 -6  4  6  o 0 93.1    3.2   ?     ?   95.9738   -111.246     102.963    -111.246     8.45315    -111.246     
1 1 1 -6  4  5  o 0 647.5   12.9  ?     ?   581.473   140.929      572.701    140.929      1.53684    -39.0709     
1 1 1 -6  4  4  o 0 2894.8  48.9  ?     ?   1351.2    84.9765      1156.93    84.9765      180.281    -95.0235     
1 1 1 -6  4  2  o 0 770.1   14.8  ?     ?   894.324   29.3571      371.058    29.3571      480.831    -150.643     
1 1 1 6   4  1  o 0 1048.5  19.7  ?     ?   698.673   179.794      753.957    179.794      92.5496    179.794      
1 1 1 6   4  2  o 0 1950.3  34    ?     ?   987.341   -144.681     1017.64    -144.681     80.9226    -144.681     
1 1 1 6   4  3  o 0 386     7.7   ?     ?   277.718   -33.0843     536.563    -33.0843     272.722    -33.0843     
1 1 1 6   4  4  o 0 558.1   13.8  ?     ?   545.007   -161.103     521.931    -161.103     17.1416    18.8973      
1 1 1 6   4  5  o 0 76.8    2.8   ?     ?   269.97    -60.9373     46.3354    -60.9373     220.539    119.063      
1 1 1 6   4  7  o 0 1586.9  29.2  ?     ?   700.533   42.8424      1221.67    42.8424      474.836    42.8424      
1 1 1 6   4  8  o 0 1468.8  27.1  ?     ?   949.389   116.619      886.792    116.619      122.283    -63.3805     
1 1 1 6   4  9  o 0 99.5    4.3   ?     ?   377.292   76.4532      28.4081    76.4532      365.567    -103.547     
1 1 1 6   4  10 o 0 142.9   5.6   ?     ?   251.029   -85.1931     220.236    -85.1932     40.7836    94.8068      
1 1 1 6   4  11 o 0 55.3    5.4   ?     ?   227.245   156.192      5.77021    156.192      229.397    -23.8082     
1 1 1 6   4  12 o 0 397.8   11.1  ?     ?   492.129   -161.301     379.671    -161.301     107.334    18.6986      
1 1 1 6   4  13 o 0 1195.6  23    ?     ?   1015.31   -130.225     551.473    -130.225     447.543    49.7746      
1 1 1 6   4  14 o 0 692.6   17.5  ?     ?   377.432   -0.102783    763.277    -0.102783    398.987    -0.102783    
1 1 1 6   4  15 o 0 90.4    11.4  ?     ?   126.223   136.347      97.8007    136.347      23.2272    -43.6526     
1 1 1 6   4  16 f 1 786.6   24.3  ?     ?   527.543   142.686      727.247    142.686      214.942    142.686      
1 1 1 6   4  17 o 0 5.5     11.2  ?     ?   281.735   -100.414     213.449    79.5856      483.635    79.5856      
1 1 1 6   4  18 o 0 757     19.5  ?     ?   617.892   -84.0315     631.635    -84.0315     55.9333    -84.0315     
1 1 1 6   4  19 o 0 983.9   24.1  ?     ?   610.492   -0.90321     806.57     -0.90321     237.478    -0.90321     
1 1 1 6   4  20 o 0 445.4   16.3  ?     ?   370.971   141.708      628.273    141.708      241.161    141.708      
1 1 1 6   4  21 o 0 6.4     13.6  ?     ?   186.761   167.519      90.939     -12.4815     280.708    -12.4815     
1 1 1 6   4  22 o 0 145.4   16.9  ?     ?   236.979   -55.24       314.607    -55.24       80.0413    -55.24       
1 1 1 6   4  23 o 0 -14     18.5  ?     ?   95.1502   -144.605     34.8256    35.3954      126.114    35.3954      
1 1 1 6   4  24 o 0 73.7    21.6  ?     ?   271.522   -160.981     113.111    -160.981     147.027    19.0185      
1 1 1 6   4  25 f 1 335     27.2  ?     ?   363.881   -116.635     506.302    -116.635     127.051    -116.635     
1 1 1 6   4  26 f 1 -16.5   28.8  ?     ?   146.414   -121.379     10.4933    58.6214      156.365    58.6214      
1 1 1 6   4  27 o 0 50.2    27.5  ?     ?   150.561   102.767      128.265    102.767      14.3495    -77.2329     
1 1 1 6   4  28 < 0 -20.3   26.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  6  27 o 0 -1.6    17.4  ?     ?   102.091   2.67825      14.3649    2.67825      78.7239    -177.322     
1 1 1 -6  6  26 o 0 24      23.4  ?     ?   47.1189   -14.2097     75.6567    -14.2097     32.2682    -14.2097     
1 1 1 -6  6  25 o 0 347     23    ?     ?   279.883   -122.967     598.233    -122.967     328.401    -122.967     
1 1 1 -6  6  24 o 0 7.8     17.6  ?     ?   107.473   -166.446     3.7956     -166.446     103.843    13.5536      
1 1 1 -6  6  23 o 0 135.6   15.9  ?     ?   104.729   -38.4878     376.029    -38.4878     278.339    -38.4878     
1 1 1 -6  6  22 o 0 -4.6    12.8  ?     ?   142.573   75.5817      68.7051    -104.418     201.943    -104.418     
1 1 1 -6  6  21 o 0 204.6   14.5  ?     ?   201.74    -33.3642     443.08     -33.3642     248.488    -33.3642     
1 1 1 -6  6  20 o 0 105.4   11.4  ?     ?   168.737   -10.4101     261.189    -10.4101     94.0365    -10.4101     
1 1 1 -6  6  19 o 0 15      10.8  ?     ?   174.306   86.0021      77.6448    -93.9979     255.043    -93.9979     
1 1 1 -6  6  18 o 0 70.5    9.3   ?     ?   223.224   -90.4431     83.9923    -90.4431     119.035    89.5569      
1 1 1 -6  6  17 o 0 33.8    8.5   ?     ?   143.42    -74.8083     0.71795    105.192      132.287    105.192      
1 1 1 -6  6  16 o 0 82.5    9.7   ?     ?   265.255   -43.6525     74.6284    -43.6525     168.577    136.348      
1 1 1 -6  6  15 o 0 941.6   20.8  ?     ?   642.528   -8.81728     730.245    -8.81728     123.907    -8.81728     
1 1 1 -6  6  14 f 1 1474.1  33.7  ?     ?   820.136   33.2666      907.879    33.2666      114.745    33.2666      
1 1 1 -6  6  13 o 0 59.7    7     ?     ?   472.831   12.238       156.461    -167.762     602.498    -167.762     
1 1 1 -6  6  12 o 0 3127.2  70.7  ?     ?   1175.67   12.9079      1334.68    12.9079      203.723    12.9079      
1 1 1 -6  6  11 o 0 226.3   9.9   ?     ?   301.6     46.0936      305.412    46.0936      13.5389    46.0936      
1 1 1 -6  6  10 o 0 2899.7  70.5  ?     ?   1110.85   -95.6141     1319.26    -95.6141     238.29     -95.6141     
1 1 1 -6  6  9  o 0 1734.7  42.8  ?     ?   1044.52   97.443       897.049    97.443       165.614    -82.557      
1 1 1 -6  6  8  o 0 174.2   4.6   ?     ?   331.91    178.395      220.796    178.395      118.395    -1.60462     
1 1 1 -6  6  7  f 1 450.7   8.9   ?     ?   402.569   63.8147      547.325    63.8147      132.185    63.8147      
1 1 1 -6  6  6  o 0 1814.4  31.3  ?     ?   1004.81   -13.6769     993.427    -13.6769     40.8835    166.323      
1 1 1 -6  6  5  f 1 170.4   4.3   ?     ?   522.015   94.5256      45.6364    94.5256      508.357    -85.4744     
1 1 1 -6  6  4  o 0 1407.2  28.7  ?     ?   894.187   -51.6597     891.129    -51.6597     46.7167    128.34       
1 1 1 -6  6  3  o 0 428.4   8.5   ?     ?   688.736   -90.951      267.561    -90.951      455.766    89.049       
1 1 1 -6  6  2  o 0 822.5   15.2  ?     ?   641.08    -117.792     710.914    -117.792     37.1926    -117.792     
1 1 1 -6  6  1  f 1 1287    23.8  ?     ?   985.582   10.7592      713.145    10.7592      327.971    -169.241     
1 1 1 6   6  0  o 0 310.7   7.1   ?     ?   316.463   -45.798      461.581    -45.798      130.453    -45.798      
1 1 1 6   6  1  f 1 407     8.8   ?     ?   402.379   17.6463      513.917    17.6462      90.1069    17.6462      
1 1 1 6   6  2  o 0 399.4   8.1   ?     ?   539.238   11.8581      378.96     11.8581      186.659    -168.142     
1 1 1 6   6  3  o 0 118     3.2   ?     ?   295.39    150.837      139.667    150.837      170.305    -29.1629     
1 1 1 6   6  4  o 0 437.5   8.9   ?     ?   493.039   169.861      469.388    169.861      47.8689    -10.1389     
1 1 1 6   6  5  f 1 324.3   7.4   ?     ?   352.427   -137.071     448.978    -137.071     74.4527    -137.071     
1 1 1 6   6  6  o 0 566.9   11.4  ?     ?   535.629   95.3522      553.968    95.3522      1.28788    95.3522      
1 1 1 6   6  7  f 1 49.8    4.1   ?     ?   114.736   -17.3015     18.7016    -17.3015     100.018    162.698      
1 1 1 6   6  8  o 0 201.5   5.5   ?     ?   167.037   70.1674      355.641    70.1674      184.204    70.1674      
1 1 1 6   6  9  o 0 638     13.2  ?     ?   538.736   -53.5553     615.479    -53.5553     64.549     -53.5553     
1 1 1 6   6  10 o 0 440.9   12.5  ?     ?   433.223   -179.712     474.627    -179.712     50.5359    -179.712     
1 1 1 6   6  11 o 0 18.5    5.8   ?     ?   282.184   -16.1177     171.185    163.882      446.11     163.882      
1 1 1 6   6  12 o 0 619     16.9  ?     ?   625.923   125.193      478.93     125.193      119.781    -54.8075     
1 1 1 6   6  13 o 0 162.2   10.4  ?     ?   244.452   33.0847      231.399    33.0847      1.08004    -146.915     
1 1 1 6   6  14 f 1 1127.2  24.9  ?     ?   704.227   -54.5293     814.022    -54.5293     135.205    -54.5293     
1 1 1 6   6  15 o 0 129.4   10.5  ?     ?   469.081   138.916      15.5775    138.916      431.258    -41.0837     
1 1 1 6   6  16 o 0 19      10    ?     ?   139.898   102.842      68.0372    -77.1577     197.595    -77.1577     
1 1 1 6   6  17 o 0 345.9   15.4  ?     ?   286.966   -164.507     504.639    -164.507     238.582    -164.507     
1 1 1 6   6  18 o 0 76      12    ?     ?   257.359   -157.579     79.6106    -157.579     157.094    22.4207      
1 1 1 6   6  19 o 0 198.1   14.6  ?     ?   341.919   -80.5644     299.691    -80.5644     52.4103    99.4356      
1 1 1 6   6  20 o 0 156.4   15.5  ?     ?   183.423   153.563      364.834    153.563      180.877    153.563      
1 1 1 6   6  21 o 0 130.1   15.9  ?     ?   223.881   134.08       299.066    134.08       85.7572    134.08       
1 1 1 6   6  22 o 0 33      18.8  ?     ?   117.293   116.774      72.8912    116.774      38.2115    -63.2256     
1 1 1 6   6  23 o 0 50.8    18.2  ?     ?   179.807   53.7879      110.947    53.7879      59.1538    -126.212     
1 1 1 6   6  24 o 0 46.6    22.7  ?     ?   165.665   -89.8271     105.248    -89.8271     64.3863    90.1729      
1 1 1 6   6  25 o 0 54.7    26.4  ?     ?   110.889   -49.9445     169.521    -49.9445     60.9696    -49.9445     
1 1 1 6   6  26 o 0 63.8    30.3  ?     ?   211.191   -26.4446     113.324    -26.4446     84.2579    153.555      
1 1 1 6   6  27 < 0 70.9    27.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  8  26 < 0 107.3   25.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  8  25 o 0 19.1    19.8  ?     ?   128.899   60.6471      49.5247    60.6471      66.7558    -119.353     
1 1 1 -6  8  24 o 0 7.9     16.8  ?     ?   105.509   36.6178      16.7319    36.6178      80.8297    -143.382     
1 1 1 -6  8  23 o 0 33.5    14.6  ?     ?   119.732   -159.605     91.8904    -159.605     26.4393    20.3946      
1 1 1 -6  8  22 o 0 78      17.3  ?     ?   178.538   -46.1885     204.237    -46.1885     27.2012    -46.1885     
1 1 1 -6  8  21 o 0 33.3    13.6  ?     ?   104.223   -25.6599     77.5373    -25.6599     17.8264    154.34       
1 1 1 -6  8  20 o 0 102.2   11.7  ?     ?   88.0066   58.8778      292.351    58.8778      211.322    58.8778      
1 1 1 -6  8  19 o 0 46      10.9  ?     ?   144.766   28.5577      113.441    28.5577      24.569     -151.442     
1 1 1 -6  8  18 o 0 115.2   11.6  ?     ?   269.184   30.7103      207.532    30.7103      55.8551    -149.29      
1 1 1 -6  8  17 o 0 98.6    11.5  ?     ?   193.959   8.43122      207.845    8.43122      12.9925    8.43122      
1 1 1 -6  8  16 o 0 28.4    9     ?     ?   99.2395   -157.39      8.11009    22.6095      97.1451    22.6095      
1 1 1 -6  8  15 o 0 147.6   9     ?     ?   328.108   -160.812     181.688    -160.812     115.01     19.188       
1 1 1 -6  8  14 o 0 99.6    7.9   ?     ?   128.194   104.885      139.757    104.885      23.9849    104.885      
1 1 1 -6  8  13 o 0 1398.7  27.2  ?     ?   967.288   117.597      723.981    117.597      174.402    -62.4026     
1 1 1 -6  8  12 o 0 1344.8  26.2  ?     ?   975.905   71.4776      688.744    71.4776      223.548    -108.522     
1 1 1 -6  8  11 o 0 279.8   8.8   ?     ?   394.264   -7.4869      311.047    -7.4869      64.2267    172.513      
1 1 1 -6  8  10 o 0 33.5    4.8   ?     ?   138.265   -77.5602     35.0364    102.44       163.891    102.44       
1 1 1 -6  8  9  o 0 70.1    5.8   ?     ?   216.886   154.306      41.2008    154.306      161.934    -25.6936     
1 1 1 -6  8  8  o 0 4.6     3.3   ?     ?   54.1009   13.7796      45.7217    -166.22      97.2898    -166.22      
1 1 1 -6  8  7  o 0 237.7   7.4   ?     ?   478.266   -96.6538     178.514    -96.6538     279.138    83.3462      
1 1 1 -6  8  6  o 0 374.5   12.3  ?     ?   431.889   125.516      393.451    125.516      21.1981    -54.4839     
1 1 1 -6  8  5  f 1 303.3   9.7   ?     ?   264.803   -165.622     433.701    -165.622     177.461    -165.622     
1 1 1 -6  8  4  o 0 642.6   15.9  ?     ?   523.718   158.184      622.126    158.184      96.5022    158.184      
1 1 1 -6  8  3  o 0 2822.7  49.1  ?     ?   1012.35   90.7648      1457.68    90.7648      440.055    90.7648      
1 1 1 -6  8  2  o 0 263.8   6.3   ?     ?   138.425   120.535      440.979    120.535      301.694    120.535      
1 1 1 -6  8  1  o 0 594.9   13.2  ?     ?   488.019   103.725      611.676    103.725      120.396    103.725      
1 1 1 6   8  0  o 0 135.1   4.1   ?     ?   47.6534   171.925      109.795    171.925      61.8969    171.925      
1 1 1 6   8  1  o 0 3130.3  54.9  ?     ?   1260.6    76.8222      1345.62    76.8222      77.5823    76.8222      
1 1 1 6   8  2  o 0 1280.4  26.2  ?     ?   994.794   73.1843      660.63     73.1843      340.331    -106.816     
1 1 1 6   8  3  o 0 3492.1  69    ?     ?   1646.07   -176.849     1109.39    -176.849     546.543    3.15063      
1 1 1 6   8  4  o 0 336.4   8.9   ?     ?   550.163   -39.8767     268.931    -39.8767     284.112    140.123      
1 1 1 6   8  5  f 1 1908.3  34    ?     ?   804.915   -37.8333     1140.46    -37.8333     359.697    -37.8333     
1 1 1 6   8  6  o 0 675.4   13.3  ?     ?   698.172   93.9265      453.473    93.9265      218.997    -86.0735     
1 1 1 6   8  7  o 0 299.9   8.7   ?     ?   271.972   82.9362      424.84     82.9362      163.538    82.9362      
1 1 1 6   8  8  o 0 50.3    5.5   ?     ?   180.276   -87.2135     1.78824    -87.2135     170.878    92.7865      
1 1 1 6   8  9  o 0 523.7   12.5  ?     ?   529.248   31.3393      468.005    31.3393      30.4632    -148.661     
1 1 1 6   8  10 o 0 693.9   14.8  ?     ?   698.108   -63.6705     469.919    -63.6705     184.803    116.329      
1 1 1 6   8  11 o 0 489.5   13    ?     ?   534.836   -10.0278     437.19     -10.0278     75.4817    169.972      
1 1 1 6   8  12 o 0 34.1    9.2   ?     ?   207.429   84.7516      60.694     -95.2484     256.106    -95.2484     
1 1 1 6   8  13 o 0 116.1   9.3   ?     ?   229.76    165.505      149.911    165.505      65.2833    -14.4954     
1 1 1 6   8  14 o 0 47      9.3   ?     ?   234.168   28.5588      11.9884    -151.441     225.389    -151.441     
1 1 1 6   8  15 o 0 34.4    9.9   ?     ?   145.859   62.1963      0.411621   62.1963      132.769    -117.804     
1 1 1 6   8  16 o 0 218.7   13.1  ?     ?   348.84    92.6295      290.72     92.6295      26.5       -87.3705     
1 1 1 6   8  17 o 0 65.2    11    ?     ?   102.902   127.049      133.599    127.049      29.0871    127.049      
1 1 1 6   8  18 o 0 71.6    13.7  ?     ?   200.024   -63.0263     151.688    -63.0263     46.2989    116.974      
1 1 1 6   8  19 o 0 118.8   15.4  ?     ?   250.53    -170.124     240.54     -170.124     1.21485    9.87612      
1 1 1 6   8  20 o 0 3.3     20.1  ?     ?   99.8548   117.465      5.79024    -62.5347     98.907     -62.5347     
1 1 1 6   8  21 o 0 24.5    21.2  ?     ?   157.111   130.627      34.5343    130.627      112.427    -49.3726     
1 1 1 6   8  22 o 0 32.6    20.8  ?     ?   50.0592   -84.9495     75.3181    -84.9495     24.9841    -84.9495     
1 1 1 6   8  23 o 0 66.6    19.8  ?     ?   161.265   -67.2882     182.683    -67.2882     20.9753    -67.2882     
1 1 1 6   8  24 o 0 284.2   27    ?     ?   344.655   -160.475     451.356    -160.475     127.802    -160.475     
1 1 1 6   8  25 o 0 45.9    22.7  ?     ?   223.531   -137.627     63.1921    -137.627     141.657    42.3732      
1 1 1 -6  10 24 < 0 174.2   22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  10 23 o 0 128.4   21.3  ?     ?   157.743   173.998      335.441    173.998      195.606    173.998      
1 1 1 -6  10 22 o 0 73.9    17    ?     ?   219.75    -143.209     163.34     -143.209     36.221     36.7913      
1 1 1 -6  10 21 o 0 82      18.8  ?     ?   265.823   138.242      133.345    138.242      124.504    -41.7579     
1 1 1 -6  10 20 o 0 458.5   21.9  ?     ?   447.643   120.944      554.089    120.944      118.698    120.944      
1 1 1 -6  10 19 o 0 175.6   14.8  ?     ?   420.51    117.878      202.04     117.878      178.426    -62.1218     
1 1 1 -6  10 18 o 0 156.8   24.6  ?     ?   236.372   132.737      317.766    132.737      103.774    132.737      
1 1 1 -6  10 17 o 0 291.7   15    ?     ?   233.808   41.2394      541.974    41.2393      329.218    41.2393      
1 1 1 -6  10 16 f 1 269.3   13.8  ?     ?   275.707   -3.57699     471.901    -3.57699     211.1      -3.57699     
1 1 1 -6  10 15 f 1 0       7.9   ?     ?   144.27    -108.776     100.362    71.2245      240.262    71.2245      
1 1 1 -6  10 14 o 0 102.1   8.9   ?     ?   148.914   70.373       232.724    70.3729      85.4039    70.3729      
1 1 1 -6  10 13 o 0 12.6    7.2   ?     ?   121.86    -72.4338     60.1709    107.566      181.579    107.566      
1 1 1 -6  10 12 o 0 43.8    6.8   ?     ?   231.652   -38.857      0.28255    141.143      206.031    141.143      
1 1 1 -6  10 11 o 0 214.9   8.8   ?     ?   426.31    -23.8561     204.633    -23.8561     173.002    156.144      
1 1 1 -6  10 10 o 0 191.5   7.4   ?     ?   453.144   18.7271      149.371    18.7271      254.271    -161.273     
1 1 1 -6  10 9  o 0 412.7   10.7  ?     ?   552.827   -32.4393     334.625    -32.4393     170.828    147.561      
1 1 1 -6  10 8  o 0 163.8   6.3   ?     ?   300.084   -160.897     202.324    -160.897     73.2872    19.1031      
1 1 1 -6  10 7  o 0 650.7   15.1  ?     ?   758.932   -56.5378     385.511    -56.5378     314.311    123.462      
1 1 1 -6  10 6  o 0 614.5   13.8  ?     ?   570.801   16.9858      513.066    16.9858      21.4915    -163.014     
1 1 1 -6  10 5  o 0 483.4   10.7  ?     ?   340.575   -53.5351     564.636    -53.5351     253.161    -53.5351     
1 1 1 -6  10 4  o 0 476.3   11.7  ?     ?   465.287   -83.6657     462.732    -83.6657     36.1885    -83.6657     
1 1 1 -6  10 3  o 0 65.2    4     ?     ?   28.3041   -81.0458     13.4876    -81.0458     12.5077    98.9542      
1 1 1 -6  10 2  o 0 263.5   10.2  ?     ?   412.589   52.4744      264.944    52.4744      114.496    -127.526     
1 1 1 -6  10 1  o 0 1004.3  26.6  ?     ?   770.382   37.3242      627.856    37.3242      81.2207    -142.676     
1 1 1 6   10 0  o 0 1054.2  21.4  ?     ?   561.58    12.6603      843.722    12.6603      326.474    12.6603      
1 1 1 6   10 1  o 0 464.3   11.2  ?     ?   641.952   37.9855      303.717    37.9855      287.706    -142.015     
1 1 1 6   10 2  o 0 1078.5  23.9  ?     ?   704.276   87.4556      736.248    87.4556      87.5383    87.4556      
1 1 1 6   10 3  o 0 986.4   23.8  ?     ?   823.735   46.7407      568.483    46.7407      189.747    -133.259     
1 1 1 6   10 4  o 0 224.7   8.3   ?     ?   166.898   87.6766      340.51     87.6766      187.065    87.6766      
1 1 1 6   10 5  o 0 1065.9  20.6  ?     ?   879.008   -71.1489     571.221    -71.1489     235.564    108.851      
1 1 1 6   10 6  o 0 1617.9  30.3  ?     ?   808.786   -107.635     991.624    -107.635     240.054    -107.635     
1 1 1 6   10 7  o 0 1306.2  34.6  ?     ?   786.739   -137.641     828.729    -137.641     99.6637    -137.641     
1 1 1 6   10 8  o 0 1232.9  24.5  ?     ?   667.327   127.368      886.821    127.368      270.453    127.368      
1 1 1 6   10 9  o 0 480.4   12.3  ?     ?   383.379   152.964      544.218    152.964      191.472    152.964      
1 1 1 6   10 10 o 0 1.8     6.5   ?     ?   50.9773   -20.3125     39.3985    159.688      85.125     159.688      
1 1 1 6   10 11 o 0 262.2   10.6  ?     ?   346.368   83.8749      332.677    83.8749      23.5039    83.8749      
1 1 1 6   10 12 o 0 348.1   12    ?     ?   437.958   58.2717      374.135    58.2717      18.0869    -121.728     
1 1 1 6   10 13 o 0 163.2   13.3  ?     ?   315.255   -49.5705     253.674    -49.5705     63.2278    130.429      
1 1 1 6   10 14 o 0 177.6   13.2  ?     ?   350.059   59.3036      248.012    59.3036      101.628    -120.696     
1 1 1 6   10 15 f 1 337.7   15.7  ?     ?   489.616   29.2365      369.896    29.2365      109.749    -150.764     
1 1 1 6   10 16 f 1 131.8   12.7  ?     ?   250.049   17.4881      265.388    17.4881      26.2901    17.4881      
1 1 1 6   10 17 o 0 116     13.7  ?     ?   262.521   117.131      229.302    117.131      12.3211    -62.8695     
1 1 1 6   10 18 o 0 243     17.2  ?     ?   335.233   108.554      389.411    108.554      82.2537    108.554      
1 1 1 6   10 19 o 0 89.3    17.4  ?     ?   204.02    98.3145      207.686    98.3145      20.7511    98.3145      
1 1 1 6   10 20 o 0 -9.4    16.7  ?     ?   104.477   53.1054      33.1859    -126.895     136.155    -126.895     
1 1 1 6   10 21 o 0 149     24    ?     ?   282.603   -40.478      266.06     -40.478      11.8794    139.522      
1 1 1 6   10 22 o 0 191     25.5  ?     ?   355.429   -34.5574     290.081    -34.5574     37.3803    145.443      
1 1 1 6   10 23 o 0 120.3   24.6  ?     ?   332.2     -64.0047     175.036    -64.0047     123.909    115.995      
1 1 1 6   10 24 < 0 195.5   25.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  12 22 < 0 91.3    21    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  12 21 o 0 24.1    17.1  ?     ?   126.781   -149.183     64.8132    -149.183     44.8587    30.817       
1 1 1 -6  12 20 o 0 122.2   20    ?     ?   340.745   -120.467     168.206    -120.467     132.879    59.5328      
1 1 1 -6  12 19 f 1 135.7   18.6  ?     ?   173.125   -162.332     332.521    -162.332     173.922    -162.332     
1 1 1 -6  12 18 o 0 30.7    15.4  ?     ?   74.8001   155.643      86.8633    155.643      15.6433    155.643      
1 1 1 -6  12 17 o 0 43.7    14.4  ?     ?   41.1442   85           98.8212    85           59.586     85           
1 1 1 -6  12 16 o 0 175.3   12.8  ?     ?   321.824   144.759      281.053    144.759      4.08743    -35.2411     
1 1 1 -6  12 15 o 0 172.1   12.1  ?     ?   270.371   163.171      319.814    163.171      80.4119    163.171      
1 1 1 -6  12 14 o 0 275.7   12.6  ?     ?   364.037   -18.4856     404.072    -18.4856     80.4856    -18.4856     
1 1 1 -6  12 13 o 0 2.8     8.4   ?     ?   263.652   51.2482      162.482    -128.752     404.545    -128.752     
1 1 1 -6  12 12 o 0 51.5    7.6   ?     ?   156.6     -121.612     124.953    -121.612     19.7851    58.388       
1 1 1 -6  12 11 o 0 66.5    7.2   ?     ?   106.11    -19.4165     165.119    -19.4165     64.7637    -19.4165     
1 1 1 -6  12 10 o 0 62.6    7.2   ?     ?   267.488   157.915      72.5814    157.915      181.839    -22.0848     
1 1 1 -6  12 9  o 0 193.1   8     ?     ?   361.359   -148.004     259.328    -148.004     92.2997    31.9961      
1 1 1 -6  12 8  o 0 481.8   12.6  ?     ?   697.676   -70.4624     325.465    -70.4624     356.594    109.538      
1 1 1 -6  12 7  o 0 31.6    5.7   ?     ?   188.692   -82.8778     22.8002    97.1222      186.856    97.1222      
1 1 1 -6  12 6  o 0 280.1   8.5   ?     ?   327.448   21.3743      368.788    21.3743      83.0531    21.3743      
1 1 1 -6  12 5  o 0 68.5    5.1   ?     ?   40.409    56.1401      46.2305    56.1401      10.8585    56.1401      
1 1 1 -6  12 4  f 1 905.7   18.4  ?     ?   621.914   160.134      692.669    160.134      148.801    160.134      
1 1 1 -6  12 3  f 1 122.4   6     ?     ?   46.9272   61.804       92.1107    61.804       50.9851    61.804       
1 1 1 -6  12 2  o 0 140.6   6.8   ?     ?   140.716   62.6603      218.579    62.6603      95.6887    62.6603      
1 1 1 -6  12 1  o 0 135.8   6.6   ?     ?   277.798   45.4132      176.458    45.4132      66.4298    -134.587     
1 1 1 6   12 0  o 0 229.3   7.7   ?     ?   298.227   -53.8757     314.561    -53.8757     53.1476    -53.8757     
1 1 1 6   12 1  o 0 60.3    5.4   ?     ?   284.982   149.33       2.99193    149.33       246.774    -30.6704     
1 1 1 6   12 2  o 0 575.2   13.4  ?     ?   558.144   -29.9147     493.507    -29.9147     4.6262     -29.9147     
1 1 1 6   12 3  f 1 79.6    5.7   ?     ?   276.339   5.47895      57.7276    5.47895      185.305    -174.521     
1 1 1 6   12 4  f 1 81.8    6.3   ?     ?   288.619   48.2933      71.0215    48.2933      184.64     -131.707     
1 1 1 6   12 5  o 0 135.7   8.1   ?     ?   220.771   -139.739     224.122    -139.739     29.9553    -139.739     
1 1 1 6   12 6  o 0 68      8.3   ?     ?   231.622   152.737      70.6105    152.737      132.586    -27.2629     
1 1 1 6   12 7  o 0 661.4   16.4  ?     ?   584.516   37.9237      541.884    37.9237      30.6549    37.9237      
1 1 1 6   12 8  o 0 217.6   9     ?     ?   264.498   92.1058      384.203    92.1058      123.926    92.1058      
1 1 1 6   12 9  o 0 135.9   9.5   ?     ?   265.339   -70.472      236.074    -70.472      23.9752    109.528      
1 1 1 6   12 10 o 0 364.7   12    ?     ?   330.088   26.8369      543.623    26.8369      227.209    26.8369      
1 1 1 6   12 11 o 0 172.2   11.5  ?     ?   126.092   103.725      403.571    103.725      283.313    103.725      
1 1 1 6   12 12 o 0 126.9   11.5  ?     ?   222.429   -150.308     273.064    -150.308     65.6274    -150.308     
1 1 1 6   12 13 o 0 275.4   15.1  ?     ?   214.173   -58.6445     522.247    -58.6445     323.716    -58.6445     
1 1 1 6   12 14 o 0 37      12.4  ?     ?   249.241   -72.0578     13.4724    -72.0578     210.343    107.942      
1 1 1 6   12 15 o 0 131.2   14    ?     ?   211.012   -106.133     292.027    -106.133     103.158    -106.133     
1 1 1 6   12 16 o 0 24.4    14.7  ?     ?   176.388   -161.05      13.6327    -161.05      144.439    18.9501      
1 1 1 6   12 17 o 0 107.2   18    ?     ?   194.327   -127.488     257.48     -127.488     69.9363    -127.488     
1 1 1 6   12 18 o 0 29.4    17.9  ?     ?   154.193   179.237      50.8885    179.237      97.7819    -0.763276    
1 1 1 6   12 19 f 1 42.7    21.6  ?     ?   97.5383   -54.5215     123.023    -54.5215     32.4847    -54.5215     
1 1 1 6   12 20 o 0 100.4   23.3  ?     ?   217.555   -38.2857     223.817    -38.2857     31.4607    -38.2857     
1 1 1 6   12 21 o 0 176.3   26    ?     ?   299.831   16.1286      302.178    16.1286      39.0571    16.1286      
1 1 1 6   12 22 < 0 80.6    28.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  14 19 < 0 48.5    21.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  14 18 o 0 20.6    22.3  ?     ?   92.6586   76.918       76.2736    76.918       1.79568    -103.082     
1 1 1 -6  14 17 o 0 21.9    20    ?     ?   93.31     159.899      68.6588    159.899      10.5053    -20.1012     
1 1 1 -6  14 16 o 0 229.6   18.3  ?     ?   402.034   -148.336     300.478    -148.336     48.1342    31.6637      
1 1 1 -6  14 15 o 0 188.5   16.1  ?     ?   235.53    -132.346     374.998    -132.346     164.691    -132.346     
1 1 1 -6  14 14 o 0 47      14.7  ?     ?   161.026   -163.588     116.379    -163.588     33.5719    16.4123      
1 1 1 -6  14 13 o 0 27.1    11.7  ?     ?   136.849   -2.97653     49.9983    -2.97653     77.4147    177.023      
1 1 1 -6  14 12 f 1 204.5   13.2  ?     ?   239.883   59.9734      401.666    59.9734      183.374    59.9734      
1 1 1 -6  14 11 o 0 28.3    9.5   ?     ?   76.2327   -10.1544     64.4297    -10.1544     1.81808    169.846      
1 1 1 -6  14 10 o 0 76.6    8.8   ?     ?   209.658   37.815       166.599    37.815       15.0713    -142.185     
1 1 1 -6  14 9  o 0 107.9   8.9   ?     ?   177.428   13.2309      261.705    13.2309      107.14     13.2309      
1 1 1 -6  14 8  o 0 279.3   11.5  ?     ?   406.63    -81.4531     366.422    -81.4531     11.8041    -81.4531     
1 1 1 -6  14 7  f 1 841.9   19.2  ?     ?   509.663   -92.3739     825.451    -92.3739     376.747    -92.3739     
1 1 1 -6  14 6  o 0 356.6   11.2  ?     ?   316.407   -97.0226     531.533    -97.0226     246.222    -97.0226     
1 1 1 -6  14 5  o 0 23.9    6.5   ?     ?   114.76    -12.7644     31.0064    -12.7644     72.8242    167.236      
1 1 1 -6  14 4  o 0 213.4   10.6  ?     ?   126.663   132.173      474.457    132.173      359.527    132.173      
1 1 1 -6  14 3  o 0 180.4   8.6   ?     ?   149.357   -15.1096     412.674    -15.1096     276.826    -15.1096     
1 1 1 -6  14 2  o 0 198.9   9.5   ?     ?   270.503   -67.5183     348.713    -67.5183     98.0161    -67.5183     
1 1 1 -6  14 1  f 1 25      6.3   ?     ?   166.911   3.13248      1.14331    3.13248      154.567    -176.868     
1 1 1 6   14 0  o 0 266.5   9.3   ?     ?   196.114   163.96       506.95     163.96       324.173    163.96       
1 1 1 6   14 1  f 1 37.9    6.5   ?     ?   124.918   -31.1741     69.6393    -31.1741     47.3253    148.826      
1 1 1 6   14 2  o 0 39      7.1   ?     ?   111.554   148.14       74.7581    148.14       29.0625    -31.8599     
1 1 1 6   14 3  o 0 84.6    7.2   ?     ?   146.562   71.2508      222.32     71.2508      88.3835    71.2508      
1 1 1 6   14 4  o 0 218.7   9.1   ?     ?   184.679   -69.0713     454.224    -69.0713     285.766    -69.0713     
1 1 1 6   14 5  o 0 5.7     6.3   ?     ?   81.1379   8.46735      40.2542    -171.533     114.093    -171.533     
1 1 1 6   14 6  o 0 79.9    8.5   ?     ?   168.218   121.17       197.176    121.17       44.5208    121.17       
1 1 1 6   14 7  f 1 93.8    9.1   ?     ?   181.699   -133.818     230.156    -133.818     69.0769    -133.818     
1 1 1 6   14 8  o 0 118.6   9.2   ?     ?   218.426   -136.108     258.95     -136.108     67.0313    -136.108     
1 1 1 6   14 9  o 0 197.3   12.1  ?     ?   355.549   -64.7788     289.979    -64.7788     22.2607    115.221      
1 1 1 6   14 10 o 0 18.8    10.7  ?     ?   140.052   -128.723     3.73015    -128.723     118.677    51.2767      
1 1 1 6   14 11 o 0 72.8    12.4  ?     ?   144.33    -25.3522     199.954    -25.3522     73.371     -25.3522     
1 1 1 6   14 12 f 1 7.4     14    ?     ?   144.563   -62.9089     28.136     117.091      165.683    117.091      
1 1 1 6   14 13 o 0 87.6    16.3  ?     ?   249.081   -51.5636     161.883    -51.5636     72.4312    128.436      
1 1 1 6   14 14 o 0 65.3    16.4  ?     ?   209.021   137.051      135.291    137.051      61.4875    -42.9492     
1 1 1 6   14 15 o 0 162.3   22.5  ?     ?   253.875   134.515      314.775    134.515      85.4719    134.515      
1 1 1 6   14 16 o 0 27.6    20.5  ?     ?   52.6693   169.474      72.542     169.474      26.318     169.474      
1 1 1 6   14 17 o 0 163.6   21.8  ?     ?   266.139   -111.604     308.419    -111.604     79.7594    -111.604     
1 1 1 6   14 18 o 0 163.1   26.3  ?     ?   289.555   -73.071      279        -73.071      31.7958    -73.071      
1 1 1 6   14 19 < 0 9.4     20.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  16 14 < 0 58.3    19    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  16 13 o 0 -10.1   14.8  ?     ?   83.5025   35.7962      3.45897    -144.204     72.2714    -144.204     
1 1 1 -6  16 12 o 0 6.8     11.8  ?     ?   40.0168   -24.6638     12.1172    -24.6638     21.0162    155.336      
1 1 1 -6  16 11 o 0 173     16.7  ?     ?   275.165   -46.0975     313.553    -46.0975     84.2353    -46.0975     
1 1 1 -6  16 10 o 0 183.5   15.6  ?     ?   288.404   -18.9486     318.866    -18.9486     73.8711    -18.9486     
1 1 1 -6  16 9  o 0 536.9   18.8  ?     ?   391.548   -1.7271      647.625    -1.7271      306.044    -1.7271      
1 1 1 -6  16 8  o 0 51.2    11.7  ?     ?   191.359   110.365      111.447    110.365      56.3356    -69.6346     
1 1 1 -6  16 7  o 0 86.9    10.3  ?     ?   314.908   -110.469     102.956    -110.469     184.081    69.5314      
1 1 1 -6  16 6  o 0 62.4    10.1  ?     ?   205.234   -9.23335     132.29     -9.23335     55.5439    170.767      
1 1 1 -6  16 5  o 0 298.7   13.7  ?     ?   267.032   -7.02147     496.464    -7.02147     253.016    -7.02147     
1 1 1 -6  16 4  o 0 -12     9.2   ?     ?   38.6733   107.524      23.5009    -72.4758     58.8686    -72.4758     
1 1 1 -6  16 3  o 0 168.3   10.6  ?     ?   150.534   144.578      398.766    144.578      260.733    144.578      
1 1 1 -6  16 2  o 0 66      10.3  ?     ?   231.196   60.6615      121.728    60.6615      90.7302    -119.338     
1 1 1 -6  16 1  o 0 87.1    9.6   ?     ?   272.296   -21.5412     142.725    -21.5412     107.933    158.459      
1 1 1 6   16 0  o 0 -0.6    9.4   ?     ?   112.875   -144.036     51.14      35.9635      155.63     35.9635      
1 1 1 6   16 1  o 0 176.2   10.8  ?     ?   176.465   -103.569     397.667    -103.569     234.438    -103.569     
1 1 1 6   16 2  o 0 270.3   11.9  ?     ?   340.145   -77.4959     403.037    -77.4959     88.7885    -77.4959     
1 1 1 6   16 3  o 0 62.1    10.6  ?     ?   195.93    -33.0689     138.571    -33.0689     42.1374    146.931      
1 1 1 6   16 4  o 0 61      10    ?     ?   155.019   95.0141      164.996    95.0141      22.3262    95.0141      
1 1 1 6   16 5  o 0 8.8     9.2   ?     ?   220.334   154.76       91.7062    -25.24       293.959    -25.24       
1 1 1 6   16 6  o 0 53.4    11.9  ?     ?   187.094   -160.812     119.462    -160.812     53.0344    19.188       
1 1 1 6   16 7  o 0 246.5   14.7  ?     ?   273.131   -134.345     420.843    -134.345     169.915    -134.345     
1 1 1 6   16 8  o 0 -7      12.7  ?     ?   77.652    27.8457      24.5271    -152.154     93.1869    -152.154     
1 1 1 6   16 9  o 0 9.8     11.6  ?     ?   187.986   -91.5354     47.4044    88.4646      212.873    88.4646      
1 1 1 6   16 10 o 0 26      15.9  ?     ?   126.425   149.989      60.0965    149.989      48.3214    -30.0114     
1 1 1 6   16 11 o 0 30.3    16.9  ?     ?   103.142   113.959      90.4564    113.959      3.63483    113.959      
1 1 1 6   16 12 o 0 64.6    18.5  ?     ?   148.709   99.0861      180.624    99.0861      56.1896    99.0861      
1 1 1 6   16 13 o 0 95.7    20.1  ?     ?   186.218   -115.333     230.104    -115.333     74.9344    -115.333     
1 1 1 6   16 14 < 0 48.6    19.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  18 7  < 1 23.9    15.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  18 6  < 0 53.9    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  18 5  < 0 490.6   20    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  18 4  < 0 164.2   15.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  18 3  < 0 52.5    16.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -6  18 2  o 0 71.1    14.2  ?     ?   171.828   28.4557      184.579    28.4557      45.5891    28.4557      
1 1 1 -6  18 1  o 0 104.8   13.4  ?     ?   150.13    -139.617     277.836    -139.617     156.159    -139.617     
1 1 1 6   18 0  o 0 141.8   14.9  ?     ?   207.227   -40.6811     308.315    -40.6811     139.19     -40.6811     
1 1 1 6   18 1  o 0 195.4   15.4  ?     ?   291.747   -18.7868     330.59     -18.7868     92.7334    -18.7868     
1 1 1 6   18 2  o 0 72      14.6  ?     ?   208.334   176.869      160.851    176.869      8.74663    -3.13095     
1 1 1 6   18 3  < 0 130.1   15.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 6   18 4  < 0 33      14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 6   18 5  < 0 13.7    15.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 6   18 6  < 0 113.1   17.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 6   18 7  < 1 46.7    17.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  1  29 < 1 -7.8    20.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  1  28 o 0 283.7   24.4  ?     ?   325.304   -77.3379     481.97     -77.3379     176.543    -77.3379     
1 1 1 -7  1  27 o 0 9.7     17.1  ?     ?   65.435    -57.4612     29.8176    -57.4612     33.1617    122.539      
1 1 1 -7  1  26 o 0 8.5     14.1  ?     ?   75.8864   -73.5597     10.4735    -73.5597     67.5984    106.44       
1 1 1 -7  1  25 o 0 34.3    14.1  ?     ?   117.388   -122.469     87.3826    -122.469     24.2584    57.5307      
1 1 1 -7  1  24 o 0 65.7    14.6  ?     ?   175.506   -102.684     172.08     -102.684     4.85459    -102.684     
1 1 1 -7  1  23 o 0 39.4    12.1  ?     ?   204.469   -40.1747     64.249     -40.1747     131.834    139.825      
1 1 1 -7  1  22 o 0 749     19.8  ?     ?   735.496   15.7174      586.487    15.7174      156.405    -164.283     
1 1 1 -7  1  21 f 1 479.2   14.8  ?     ?   562.376   12.4789      475.083    12.4789      111.526    -167.521     
1 1 1 -7  1  20 o 0 104.1   8.9   ?     ?   208.432   105.077      176.197    105.077      17.1134    -74.9231     
1 1 1 -7  1  19 o 0 320.2   11.4  ?     ?   301.092   -139.311     454.928    -139.311     175.703    -139.311     
1 1 1 -7  1  18 o 0 86.5    7.9   ?     ?   142.895   163.983      96.2402    163.983      40.2154    -16.0175     
1 1 1 -7  1  17 o 0 47      7.9   ?     ?   251.326   -54.9954     39.2776    125.005      281.163    125.005      
1 1 1 -7  1  16 o 0 116.1   9.3   ?     ?   159.521   45.4317      158.967    45.4317      6.53839    45.4317      
1 1 1 -7  1  15 o 0 694.6   14.6  ?     ?   684.187   -108.392     488.465    -108.392     178.569    71.6075      
1 1 1 -7  1  14 o 0 1508.3  27    ?     ?   888.478   109.288      864.51     109.288      7.38074    -70.7119     
1 1 1 -7  1  13 o 0 101.7   5.4   ?     ?   259.881   78.3997      119.862    78.3997      147.062    -101.6       
1 1 1 -7  1  12 o 0 1172.6  24.1  ?     ?   895.227   159.176      704.143    159.176      220.564    -20.8244     
1 1 1 -7  1  11 o 0 114.4   4.1   ?     ?   183.645   150.977      182.871    150.977      7.8095     -29.0233     
1 1 1 -7  1  10 o 0 750.6   14.7  ?     ?   502.553   -5.78075     787.806    -5.78075     256.12     -5.78075     
1 1 1 -7  1  9  o 0 265.8   5.7   ?     ?   424.034   -100.362     308.708    -100.362     141.808    79.6383      
1 1 1 -7  1  7  o 0 1672.6  29.3  ?     ?   793.685   -120.979     1093.68    -120.979     309.418    -120.979     
1 1 1 -7  1  6  o 0 1272.6  22.6  ?     ?   769.242   35.1274      841.572    35.1274      109.378    35.1274      
1 1 1 -7  1  5  o 0 1773.9  31    ?     ?   963.293   86.4776      932.022    86.4776      34.085     86.4776      
1 1 1 -7  1  4  o 0 469.3   9.1   ?     ?   552.52    4.25425      399.628    4.25425      115.849    -175.746     
1 1 1 -7  1  3  o 0 3909    131.8 ?     ?   1508.07   132.709      1299.35    132.709      80.0589    -47.2905     
1 1 1 -7  1  2  o 0 989.4   20.3  ?     ?   748.476   165.326      644.217    165.326      39.5043    -14.6744     
1 1 1 -7  1  1  o 0 278.4   5.8   ?     ?   788.993   176.027      27.8565    -3.97267     747.254    -3.97267     
1 1 1 7   1  2  o 0 338.2   9.3   ?     ?   590.636   -135.653     217.805    -135.653     321.865    44.3472      
1 1 1 7   1  3  o 0 1964    36.3  ?     ?   980.878   3.56377      997.268    3.56377      96.892     3.56377      
1 1 1 7   1  4  o 0 344.8   6.8   ?     ?   468.502   -157.161     336.4      -157.161     103.089    22.8386      
1 1 1 7   1  5  o 0 1771.4  30.5  ?     ?   945.599   -66.4069     953.094    -66.4069     65.806     -66.4069     
1 1 1 7   1  6  o 0 327.4   6.9   ?     ?   376.71    127.053      398.389    127.053      37.1809    127.053      
1 1 1 7   1  7  o 0 312.4   6.5   ?     ?   404.803   -176.833     370.479    -176.833     32.6744    3.16654      
1 1 1 7   1  8  o 0 53.2    3     ?     ?   245.124   -3.47662     10.9257    176.523      254.39     176.523      
1 1 1 7   1  9  o 0 22.2    3.1   ?     ?   83.474    -101.724     40.785     78.2765      130.246    78.2765      
1 1 1 7   1  10 o 0 592.6   11.8  ?     ?   643.429   53.1601      501.476    53.1601      185.447    -126.84      
1 1 1 7   1  11 o 0 646.5   13.7  ?     ?   511.517   -32.647      665.19     -32.647      129.039    -32.647      
1 1 1 7   1  12 o 0 704     14.7  ?     ?   492.447   75.3865      734.199    75.3865      220.512    75.3865      
1 1 1 7   1  14 o 0 120.3   8.1   ?     ?   212.559   9.56298      171.205    9.56298      39.6192    -170.437     
1 1 1 7   1  15 o 0 450.8   15.7  ?     ?   411.255   80.6158      507.335    80.6158      101.921    80.6158      
1 1 1 7   1  16 o 0 134.2   20    ?     ?   126.512   -175.499     185.126    -175.499     62.8354    -175.499     
1 1 1 7   1  17 o 0 1090.2  26.2  ?     ?   711.711   32.7137      797.42     32.7137      104.167    32.7137      
1 1 1 7   1  18 o 0 1397.8  33.3  ?     ?   777.337   30.7465      930.53     30.7465      178.884    30.7465      
1 1 1 7   1  19 o 0 213.8   13    ?     ?   357.506   46.7789      269.6      46.7789      66.2816    -133.221     
1 1 1 7   1  20 o 0 179.7   15    ?     ?   315.1     64.648       254.855    64.648       41.3643    -115.352     
1 1 1 7   1  21 f 1 94.2    11    ?     ?   208.401   -69.6771     196.427    -69.6771     24.0339    110.323      
1 1 1 7   1  22 o 0 43.5    16    ?     ?   106.641   1.76918      89.0634    1.76918      20.2373    -178.231     
1 1 1 7   1  23 o 0 177.5   16.9  ?     ?   337.651   -48.2403     302.153    -48.2403     26.61      131.76       
1 1 1 7   1  24 o 0 43.3    20.5  ?     ?   115.72    -167.089     112.577    -167.089     0.561602   -167.089     
1 1 1 7   1  25 o 0 76      23.9  ?     ?   193.54    6.42927      183.981    6.42927      12.1853    -173.571     
1 1 1 7   1  26 o 0 50.2    20.4  ?     ?   201.069   -1.81099     92.985     -1.81099     117.43     178.189      
1 1 1 7   1  27 o 0 -4.9    23.9  ?     ?   61.331    6.63745      24.3701    6.63745      35.7133    -173.363     
1 1 1 7   1  28 o 0 38.2    26.6  ?     ?   60.0133   -84.0876     145.329    -84.0876     87.8087    -84.0876     
1 1 1 -7  3  28 f 1 7.2     18.4  ?     ?   126.058   -151.25      23.2344    -151.25      94.5466    28.7504      
1 1 1 -7  3  27 f 1 69.9    20.1  ?     ?   163.952   -31.8043     198.039    -31.8043     41.3057    -31.8043     
1 1 1 -7  3  26 f 1 56.7    18.4  ?     ?   112.273   -58.1602     183.761    -58.1602     72.8596    -58.1602     
1 1 1 -7  3  25 o 0 120.7   16.9  ?     ?   192.662   112.812      306.913    112.812      110.232    112.812      
1 1 1 -7  3  24 o 0 -10.7   13.4  ?     ?   111.831   99.8847      57.8555    -80.1153     163.256    -80.1153     
1 1 1 -7  3  23 o 0 5.7     13.9  ?     ?   140.155   161.013      39.5173    -18.9874     172.514    -18.9874     
1 1 1 -7  3  22 o 0 5.8     13.4  ?     ?   63.599    -161.462     16.7567    18.5384      79.2813    18.5384      
1 1 1 -7  3  21 o 0 926.9   24    ?     ?   594.28    26.1627      876.177    26.1627      276.164    26.1627      
1 1 1 -7  3  20 o 0 291.4   12    ?     ?   462.636   -57.8409     337.004    -57.8409     142.888    122.159      
1 1 1 -7  3  19 o 0 317     12.6  ?     ?   504.549   -94.4331     292.354    -94.4331     175.37     85.5669      
1 1 1 -7  3  18 o 0 444.8   13.2  ?     ?   388.724   -54.4414     533.333    -54.4414     173.017    -54.4414     
1 1 1 -7  3  17 o 0 694.2   16.9  ?     ?   732.241   -82.613      461.24     -82.613      237.648    97.387       
1 1 1 -7  3  16 f 1 263     10    ?     ?   277.124   21.1605      379.942    21.1605      108.751    21.1605      
1 1 1 -7  3  15 o 0 219.9   8.9   ?     ?   360.802   29.4415      252.815    29.4415      91.7707    -150.559     
1 1 1 -7  3  14 o 0 67.3    6     ?     ?   160.752   164.451      52.9557    164.451      103.69     -15.5486     
1 1 1 -7  3  13 o 0 747.4   15.1  ?     ?   388.203   6.24868      801.493    6.24868      420.704    6.24868      
1 1 1 -7  3  12 o 0 1299    25.1  ?     ?   726.998   -8.97029     953.255    -8.97029     206.824    -8.97029     
1 1 1 -7  3  11 o 0 907.3   18.8  ?     ?   695.415   106.471      704.066    106.471      14.0624    -73.5288     
1 1 1 -7  3  10 o 0 1013.7  18.8  ?     ?   726.47    -68.2376     760.311    -68.2376     6.09973    -68.2376     
1 1 1 -7  3  9  o 0 73.7    3     ?     ?   157.075   -88.4312     81.8763    -88.4312     84.3128    91.5688      
1 1 1 -7  3  8  o 0 1007.5  17.9  ?     ?   717.717   68.8114      794.973    68.8114      32.2264    68.8114      
1 1 1 -7  3  7  o 0 280.4   6.3   ?     ?   441.557   64.7293      291.909    64.7293      143.267    -115.271     
1 1 1 -7  3  6  f 1 1713.9  29.8  ?     ?   851.44    -167.029     1058.54    -167.029     212.19     -167.029     
1 1 1 -7  3  5  o 0 527.8   9.8   ?     ?   530.174   52.6151      486.73     52.6151      18.4986    -127.385     
1 1 1 -7  3  4  o 0 2695.8  45.9  ?     ?   1305.63   50.6315      1074.85    50.6315      172.007    -129.368     
1 1 1 -7  3  3  f 1 1662.6  28.9  ?     ?   803.669   -97.4893     1039.95    -97.4893     267.501    -97.4893     
1 1 1 -7  3  2  o 0 1821.1  34.1  ?     ?   945.728   133.096      975.525    133.096      91.0921    133.096      
1 1 1 -7  3  1  f 1 733.4   14.6  ?     ?   550.733   -135.031     638.454    -135.031     121.034    -135.031     
1 1 1 7   3  0  o 0 1319.4  23.6  ?     ?   455.973   -84.0431     1116.09    -84.0431     694.748    -84.0431     
1 1 1 7   3  1  f 1 1982.4  34.4  ?     ?   1305.65   -126.116     714.529    -126.116     502.588    53.8841      
1 1 1 7   3  2  o 0 1303.8  23    ?     ?   870.989   -17.0848     750.301    -17.0848     60.1141    162.915      
1 1 1 7   3  3  f 1 358.5   7.8   ?     ?   547.342   -98.2468     287.741    -98.2468     237.076    81.7532      
1 1 1 7   3  4  o 0 1020.2  19.5  ?     ?   698.687   -0.0774065   740.709    -0.0774065   73.5092    -0.0774065   
1 1 1 7   3  5  o 0 1047.6  18.9  ?     ?   617.071   -35.9602     867.535    -35.9602     254.387    -35.9602     
1 1 1 7   3  6  f 1 213.7   5.3   ?     ?   396.997   38.1006      230.384    38.1006      165.628    -141.899     
1 1 1 7   3  7  o 0 606     12    ?     ?   447.676   85.2998      656.267    85.2998      212.93     85.2998      
1 1 1 7   3  8  o 0 114     3.7   ?     ?   199.947   -124.308     183.169    -124.308     30.5804    55.692       
1 1 1 7   3  9  o 0 362.6   11.7  ?     ?   336.841   -167.814     524.54     -167.814     165.711    -167.814     
1 1 1 7   3  10 o 0 848.4   23    ?     ?   861.75    20.7367      496.644    20.7367      404.881    -159.263     
1 1 1 7   3  11 o 0 568.7   12.2  ?     ?   576.66    -82.4817     521.301    -82.4817     79.206     97.5183      
1 1 1 7   3  12 o 0 63.8    6.1   ?     ?   334.624   165.952      35.9573    -14.0478     382.653    -14.0478     
1 1 1 7   3  13 o 0 1403.2  26.7  ?     ?   955.211   -138.202     745.135    -138.202     200.968    41.7984      
1 1 1 7   3  14 o 0 420.7   13.3  ?     ?   630.124   -179.873     277.659    -179.873     342.736    0.127291     
1 1 1 7   3  15 o 0 1048.9  24.3  ?     ?   852.636   -96.7456     613.677    -96.7456     209.573    83.2544      
1 1 1 7   3  16 f 1 95.7    13.2  ?     ?   261.518   -58.6445     89.1708    -58.6445     169.709    121.355      
1 1 1 7   3  17 o 0 84      12    ?     ?   252.765   117.892      67.8801    117.892      176.305    -62.1084     
1 1 1 7   3  18 o 0 364.7   14.8  ?     ?   375.86    -69.1479     459.39     -69.1479     106.556    -69.1479     
1 1 1 7   3  19 o 0 792.8   19.8  ?     ?   555.747   53.7521      717.526    53.7521      195.463    53.7521      
1 1 1 7   3  20 o 0 192     14.2  ?     ?   227.454   173.347      394.275    173.347      155.045    173.347      
1 1 1 7   3  21 o 0 3.9     14.3  ?     ?   24.1453   133.126      9.44769    -46.8736     34.181     -46.8736     
1 1 1 7   3  22 o 0 54.8    15.7  ?     ?   272.792   -38.7362     54.1542    -38.7362     218.103    141.264      
1 1 1 7   3  23 o 0 183.7   18.9  ?     ?   167.324   -66.4612     448.628    -66.4612     287.338    -66.4612     
1 1 1 7   3  24 o 0 135.9   20.4  ?     ?   230.692   -121.132     304.212    -121.132     81.2678    -121.132     
1 1 1 7   3  25 o 0 108.3   19.5  ?     ?   214.584   -111.218     260.339    -111.218     37.526     -111.218     
1 1 1 7   3  26 f 1 -37.7   24.2  ?     ?   60.0022   -9.0566      12.0172    170.943      72.3415    170.943      
1 1 1 7   3  27 f 1 60.3    24.4  ?     ?   172.055   -38.8638     146.021    -38.8638     21.5023    141.136      
1 1 1 7   3  28 f 1 48.6    23.4  ?     ?   163.614   -59.4746     121.194    -59.4746     34.6142    120.525      
1 1 1 -7  5  28 < 0 26.1    26.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  5  27 o 0 0.7     24.7  ?     ?   33.2967   129.572      41.2099    129.572      10.5113    129.572      
1 1 1 -7  5  26 o 0 63.8    22.7  ?     ?   192.729   -106.635     145.173    -106.635     36.6253    73.3646      
1 1 1 -7  5  25 o 0 37.8    15.7  ?     ?   134.108   -142.071     101.813    -142.071     33.4462    37.9289      
1 1 1 -7  5  24 o 0 133.3   15.3  ?     ?   239.372   144.927      293.251    144.927      50.9141    144.927      
1 1 1 -7  5  23 o 0 98.4    14.6  ?     ?   213.527   -100.675     229.399    -100.675     29.8335    -100.675     
1 1 1 -7  5  22 o 0 55.9    13.4  ?     ?   223.361   40.198       106.049    40.198       104.115    -139.802     
1 1 1 -7  5  21 o 0 181.1   11.9  ?     ?   266.197   38.1208      355.656    38.1208      96.1851    38.1208      
1 1 1 -7  5  20 o 0 118     12.1  ?     ?   165.192   20.6894      295.41     20.6894      130.06     20.6894      
1 1 1 -7  5  19 o 0 243.5   12.1  ?     ?   306.669   -72.5092     407.064    -72.5092     91.7229    -72.5092     
1 1 1 -7  5  18 o 0 463.8   13.7  ?     ?   483.565   -43.5706     472.349    -43.5706     28.018     -43.5706     
1 1 1 -7  5  17 o 0 123.6   9.5   ?     ?   378.888   -86.6183     90.8297    -86.6183     257.246    93.3817      
1 1 1 -7  5  16 o 0 11.9    11    ?     ?   212.92    -63.4325     143.1      116.567      344.492    116.567      
1 1 1 -7  5  15 o 0 521.2   16.3  ?     ?   210.952   56.0918      716.034    56.0918      514.962    56.0918      
1 1 1 -7  5  14 o 0 1112    29.8  ?     ?   824.606   -42.4132     669.292    -42.4132     110.968    137.587      
1 1 1 -7  5  13 o 0 611.5   25.1  ?     ?   445.749   -18.3609     623.547    -18.3609     193.263    -18.3609     
1 1 1 -7  5  12 o 0 655.2   23.2  ?     ?   354.272   -30.2706     742.626    -30.2706     398.441    -30.2706     
1 1 1 -7  5  11 o 0 3346.8  74    ?     ?   1168.62   -85.0403     1450.25    -85.0403     308.098    -85.0403     
1 1 1 -7  5  10 o 0 853.1   17.5  ?     ?   505.255   -53.2103     835.588    -53.2103     319.042    -53.2103     
1 1 1 -7  5  9  o 0 2053.8  35.5  ?     ?   1120.6    103.179      1005.87    103.179      145.565    -76.8214     
1 1 1 -7  5  8  f 1 1123.8  20.6  ?     ?   685.63    -110.331     874.056    -110.331     162.718    -110.331     
1 1 1 -7  5  7  o 0 678.9   12.9  ?     ?   700.871   -45.33       515.695    -45.33       227.31     134.67       
1 1 1 -7  5  6  o 0 140.4   4.2   ?     ?   325.125   -2.23422     168.157    -2.23422     174.701    177.766      
1 1 1 -7  5  5  o 0 1277.4  22.9  ?     ?   729.763   -134.293     978.197    -134.293     206.503    -134.293     
1 1 1 -7  5  4  o 0 772.1   14.2  ?     ?   538.819   -148.361     773.413    -148.361     202.455    -148.361     
1 1 1 -7  5  3  o 0 1928.4  33.6  ?     ?   900.648   178.205      1122.47    178.205      239.744    178.205      
1 1 1 -7  5  2  o 0 155.4   3.9   ?     ?   171.936   -142.724     257.208    -142.724     88.5913    -142.724     
1 1 1 -7  5  1  o 0 199.2   4.4   ?     ?   164.351   -28.0753     335.695    -28.0753     174.533    -28.0753     
1 1 1 7   5  0  o 0 607.8   11.8  ?     ?   557.587   -47.4821     550.077    -47.4821     6.95794    -47.4821     
1 1 1 7   5  1  o 0 482.7   10.1  ?     ?   448.937   -171.286     523.739    -171.286     85.5755    -171.286     
1 1 1 7   5  2  o 0 422.6   8.5   ?     ?   528.4     25.9116      389.32     25.9116      127.204    -154.088     
1 1 1 7   5  3  o 0 114.7   3.1   ?     ?   224.807   178.927      161.224    178.927      58.7363    -1.07281     
1 1 1 7   5  4  o 0 1233.5  22.2  ?     ?   775.681   176.922      902.431    176.922      80.6259    176.922      
1 1 1 7   5  6  o 0 1478.6  26.5  ?     ?   954.67    53.992       883.114    53.992       126.289    -126.008     
1 1 1 7   5  7  o 0 1238.7  26.4  ?     ?   542.516   32.7779      1130.98    32.7779      553.611    32.7779      
1 1 1 7   5  8  f 1 210     6.5   ?     ?   252.425   33.508       343.925    33.508       80.7179    33.508       
1 1 1 7   5  9  o 0 765.6   14.9  ?     ?   684.703   -12.2975     596.895    -12.2975     110.916    167.703      
1 1 1 7   5  10 o 0 309.9   8.8   ?     ?   608.586   152.63       183.791    152.63       442.76     -27.3703     
1 1 1 7   5  11 o 0 265.5   8.4   ?     ?   385.63    -101.709     303.207    -101.709     76.6653    78.2912      
1 1 1 7   5  12 o 0 1857.5  33.8  ?     ?   960.249   -152.278     987.657    -152.278     46.6218    -152.278     
1 1 1 7   5  13 o 0 648.5   14.5  ?     ?   450.127   -43.577      662.499    -43.577      229.579    -43.577      
1 1 1 7   5  14 o 0 564.6   16.6  ?     ?   633.53    16.1433      421.661    16.1433      183.928    -163.857     
1 1 1 7   5  15 o 0 194.3   10.5  ?     ?   273.166   145.504      281.854    145.504      18.6341    145.504      
1 1 1 7   5  16 o 0 253     12.9  ?     ?   272.494   -62.4089     370.732    -62.4089     109.995    -62.4089     
1 1 1 7   5  17 o 0 616.6   17.8  ?     ?   501.052   -66.0349     610.835    -66.0349     144.867    -66.0349     
1 1 1 7   5  18 o 0 287.5   15    ?     ?   444.187   -13.6678     307.111    -13.6678     106.33     166.332      
1 1 1 7   5  19 o 0 177.8   15.2  ?     ?   222.84    -24.3358     367.66     -24.3358     135.394    -24.3358     
1 1 1 7   5  20 o 0 441.3   19.2  ?     ?   377.92    131.063      624.264    131.063      240.573    131.063      
1 1 1 7   5  21 o 0 74.2    16.4  ?     ?   183.747   118.891      184.538    118.891      2.7544     118.891      
1 1 1 7   5  22 o 0 4.2     18.7  ?     ?   104.735   -54.1786     10.174     125.821      110.261    125.821      
1 1 1 7   5  23 o 0 107.5   18.9  ?     ?   196.824   177.902      264.486    177.902      77.533     177.902      
1 1 1 7   5  24 o 0 -14.9   23.6  ?     ?   36.5261   -41.9068     1.37573    -41.9068     36.231     138.093      
1 1 1 7   5  25 o 0 15.4    26.2  ?     ?   53.7873   -23.196      52.6751    -23.196      2.53317    156.804      
1 1 1 7   5  26 o 0 70.2    28.3  ?     ?   156.003   20.235       182.725    20.235       32.8638    20.235       
1 1 1 7   5  27 o 0 8.8     27    ?     ?   85.1893   -85.9887     70.3472    -85.9887     9.69605    94.0113      
1 1 1 -7  7  27 < 0 14.6    27    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  7  26 f 1 -9.9    22.7  ?     ?   58.7265   -102.613     30.637     -102.613     22.903     77.3867      
1 1 1 -7  7  25 o 0 39.9    20.8  ?     ?   131.089   103.661      109.497    103.661      12.1416    -76.3389     
1 1 1 -7  7  24 o 0 38.9    18.4  ?     ?   170.004   64.3026      77.6928    64.3026      85.2794    -115.697     
1 1 1 -7  7  23 o 0 72.1    16.1  ?     ?   76.398    -160.996     235.616    -160.996     159.549    -160.996     
1 1 1 -7  7  22 o 0 108.2   13.6  ?     ?   179.205   -18.0232     276.517    -18.0232     110.372    -18.0232     
1 1 1 -7  7  21 o 0 355     16.4  ?     ?   356.792   -60.1396     530.776    -60.1396     200.694    -60.1396     
1 1 1 -7  7  20 o 0 142.9   11.5  ?     ?   291.712   -34.4459     256.419    -34.4459     23.111     145.554      
1 1 1 -7  7  19 o 0 158.4   10.9  ?     ?   268.176   -177.67      298.951    -177.67      35.1038    -177.67      
1 1 1 -7  7  18 o 0 27.1    8     ?     ?   181.043   -116.379     19.0974    63.6213      202.046    63.6213      
1 1 1 -7  7  17 o 0 407.9   13.8  ?     ?   546.555   -93.9508     352.623    -93.9508     140.815    86.0492      
1 1 1 -7  7  16 o 0 181.2   10    ?     ?   300.382   -131.439     260.952    -131.439     12.4942    48.5606      
1 1 1 -7  7  15 o 0 10.6    7.7   ?     ?   143.646   -75.0742     93.3117    104.926      223.964    104.926      
1 1 1 -7  7  14 o 0 159.7   8.2   ?     ?   389.639   15.1782      135.258    15.1782      229.37     -164.822     
1 1 1 -7  7  13 o 0 260.8   9.6   ?     ?   412.736   30.9232      275.884    30.9232      113.06     -149.077     
1 1 1 -7  7  12 o 0 1733.7  34.3  ?     ?   796.227   -46.0122     1049.59    -46.0122     305.301    -46.0122     
1 1 1 -7  7  11 f 1 163.8   7.2   ?     ?   232.972   -104.186     236.244    -104.186     16.0263    -104.186     
1 1 1 -7  7  10 o 0 1318.7  32.8  ?     ?   709.816   -153.824     897.145    -153.824     217.057    -153.824     
1 1 1 -7  7  9  o 0 1552.3  39.7  ?     ?   879.202   38.5835      881.534    38.5835      34.9138    38.5835      
1 1 1 -7  7  8  o 0 149.8   5.6   ?     ?   595.16    -136.047     65.6417    43.9527      641.323    43.9527      
1 1 1 -7  7  7  o 0 1443.4  36.1  ?     ?   713.18    -75.9982     1043.04    -75.9982     322.601    -75.9982     
1 1 1 -7  7  6  f 1 13.2    2.1   ?     ?   233.906   46.3724      165.799    -133.628     404.097    -133.628     
1 1 1 -7  7  5  o 0 2609.9  47.5  ?     ?   1169.99   138.018      1219.38    138.018      30.2604    138.018      
1 1 1 -7  7  4  o 0 1533.5  27.1  ?     ?   944.791   9.17861      879.275    9.17861      83.0054    -170.821     
1 1 1 -7  7  3  o 0 1343.9  23.9  ?     ?   707.052   58.0277      995.922    58.0277      274.697    58.0277      
1 1 1 -7  7  2  o 0 303.1   7.3   ?     ?   391.958   -73.394      372.888    -73.394      27.2893    106.606      
1 1 1 -7  7  1  o 0 753.1   14.6  ?     ?   658.173   9.4697       604.585    9.4697       67.6119    -170.53      
1 1 1 7   7  0  o 0 1695.1  31.1  ?     ?   998.637   46.7709      920.91     46.7709      95.8624    -133.229     
1 1 1 7   7  1  o 0 160.1   6.4   ?     ?   328.637   160.825      196.411    160.825      138.567    -19.1752     
1 1 1 7   7  2  o 0 542.4   10.9  ?     ?   694.007   -11.3934     370.915    -11.3934     336.954    168.607      
1 1 1 7   7  3  o 0 625.2   11.8  ?     ?   589.826   -133.257     553.327    -133.257     48.3669    46.7432      
1 1 1 7   7  4  o 0 776.4   17.8  ?     ?   750.082   -156.524     534.129    -156.524     230.714    23.4755      
1 1 1 7   7  5  o 0 195.4   5     ?     ?   363.401   119.06       232.066    119.06       138.097    -60.9405     
1 1 1 7   7  6  f 1 333.1   7.6   ?     ?   233.225   -158.931     529.572    -158.931     291.188    -158.931     
1 1 1 7   7  7  o 0 1146.1  21.5  ?     ?   897.438   173.113      671.09     173.113      239.394    -6.88739     
1 1 1 7   7  8  o 0 1299.9  23.8  ?     ?   958.935   152.236      664.936    152.236      267.529    -27.7644     
1 1 1 7   7  9  o 0 380.5   9.5   ?     ?   346.012   148.961      474.1      148.961      138.829    148.961      
1 1 1 7   7  10 o 0 1257.4  25.2  ?     ?   695.191   -133.149     879.226    -133.149     208.389    -133.149     
1 1 1 7   7  11 f 1 87.7    6.5   ?     ?   133.475   -155.69      93.2643    -155.69      33.9152    24.3101      
1 1 1 7   7  12 o 0 1742.4  34.4  ?     ?   933.057   108.921      938.54     108.921      58.6352    108.921      
1 1 1 7   7  13 o 0 75.2    8.8   ?     ?   301.715   -81.4161     17.109     -81.4161     269.955    98.5839      
1 1 1 7   7  14 o 0 80.4    9.4   ?     ?   295.767   3.08588      34.2026    3.08588      245.463    -176.914     
1 1 1 7   7  15 o 0 447.5   14.3  ?     ?   719.236   51.892       252.072    51.892       409.407    -128.108     
1 1 1 7   7  16 o 0 866.7   21.6  ?     ?   769.594   99.3578      570.95     99.3578      137.965    -80.6422     
1 1 1 7   7  17 o 0 25.6    13.7  ?     ?   69.9528   140.569      12.1861    -39.4311     76.137     -39.4311     
1 1 1 7   7  18 o 0 191.7   13.2  ?     ?   385.114   -91.2105     247.429    -91.2105     146.921    88.7895      
1 1 1 7   7  19 o 0 537.9   19.6  ?     ?   481.031   -154.565     622.645    -154.565     142.743    -154.565     
1 1 1 7   7  20 o 0 48.2    14.2  ?     ?   199.205   32.5381      89.1121    32.5381      104.583    -147.462     
1 1 1 7   7  21 o 0 88.8    17.7  ?     ?   219.696   -101.557     200.019    -101.557     7.14105    78.4429      
1 1 1 7   7  22 o 0 151.7   21.8  ?     ?   292.155   -145.449     274.824    -145.449     0.404478   34.5514      
1 1 1 7   7  23 o 0 77.2    17.6  ?     ?   179.72    178.264      204.17     178.264      22.2181    178.264      
1 1 1 7   7  24 o 0 169     33.5  ?     ?   324.686   -168.318     259.871    -168.318     56.8417    11.6816      
1 1 1 7   7  25 o 0 -39     34    ?     ?   72.4602   -146.964     16.3158    -146.964     52.1476    33.0358      
1 1 1 7   7  26 f 1 37.4    33.7  ?     ?   75.8882   -68.5969     135.686    -68.5969     65.187     -68.5969     
1 1 1 -7  9  25 < 0 73.5    15.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  9  24 o 0 21.3    18.8  ?     ?   140.886   -95.6319     45.8491    -95.6319     80.0179    84.3681      
1 1 1 -7  9  23 o 0 26.3    18.3  ?     ?   8.06363   82.9703      14.1533    82.9703      6.77076    82.9703      
1 1 1 -7  9  22 o 0 44.1    14.6  ?     ?   139.38    -76.7544     122.105    -76.7544     14.2466    103.246      
1 1 1 -7  9  21 o 0 56.3    13.4  ?     ?   179.262   152.205      140.476    152.205      35.4295    -27.7954     
1 1 1 -7  9  20 o 0 23.1    12.1  ?     ?   218.007   115.034      20.376     -64.9663     219.453    -64.9663     
1 1 1 -7  9  19 o 0 56.3    13.5  ?     ?   267.007   50.2608      69.9986    50.2608      173.15     -129.739     
1 1 1 -7  9  18 f 1 170     12.9  ?     ?   224.01    128.777      356.573    128.777      144.334    128.777      
1 1 1 -7  9  17 o 0 100.3   11.5  ?     ?   217.425   -130.267     211.221    -130.267     0.938606   -130.267     
1 1 1 -7  9  16 o 0 518.8   15.9  ?     ?   630.844   -113.932     448.754    -113.932     166.523    66.0676      
1 1 1 -7  9  15 o 0 89.8    8.8   ?     ?   196.006   -127.061     184.315    -127.061     11.807     52.9387      
1 1 1 -7  9  14 o 0 120.7   9.1   ?     ?   402.36    142.473      72.2035    142.473      287.051    -37.5274     
1 1 1 -7  9  13 o 0 402     11    ?     ?   439.277   147.54       428.781    147.54       37.2235    147.54       
1 1 1 -7  9  12 o 0 572.9   14    ?     ?   457.301   -32.6719     586.164    -32.6719     175.857    -32.6719     
1 1 1 -7  9  11 o 0 452.2   12    ?     ?   621.961   46.0512      319.733    46.0512      253.654    -133.949     
1 1 1 -7  9  10 o 0 28.7    5.2   ?     ?   92.2985   -89.7781     28.8085    90.2219      114.373    90.2219      
1 1 1 -7  9  9  o 0 135.8   6.7   ?     ?   107.283   -151.898     170.771    -151.898     69.6014    -151.898     
1 1 1 -7  9  8  o 0 381.6   11.1  ?     ?   463.117   -85.0019     368.296    -85.0019     58.8797    94.9981      
1 1 1 -7  9  7  o 0 52.8    4.1   ?     ?   317.415   -114.375     59.9934    65.6255      353.941    65.6255      
1 1 1 -7  9  6  o 0 498.1   13.7  ?     ?   556.495   -88.0107     413.824    -88.0107     103.296    91.9893      
1 1 1 -7  9  5  o 0 357.6   11    ?     ?   356.542   -66.8277     427.819    -66.8278     91.1676    -66.8278     
1 1 1 -7  9  4  o 0 597.5   13.7  ?     ?   502.844   147.986      550.834    147.986      74.9428    147.986      
1 1 1 -7  9  3  o 0 1422.4  38.2  ?     ?   743.807   115.707      918.096    115.707      212.914    115.707      
1 1 1 -7  9  2  o 0 1160.6  34.4  ?     ?   565.206   82.5942      919.813    82.5942      383.296    82.5942      
1 1 1 -7  9  1  f 1 735.9   21.1  ?     ?   536.234   -96.226      639.149    -96.226      127.15     -96.226      
1 1 1 7   9  0  o 0 602     15.4  ?     ?   652.928   -70.6644     424.069    -70.6644     195.959    109.336      
1 1 1 7   9  1  f 1 3573.4  71.2  ?     ?   1251.56   87.7091      1410.89    87.7091      215.657    87.7091      
1 1 1 7   9  2  o 0 2283    41.9  ?     ?   787.581   128.413      1322.24    128.413      573.892    128.413      
1 1 1 7   9  3  o 0 1049.3  21.2  ?     ?   717.158   -150.273     710.958    -150.273     29.803     -150.273     
1 1 1 7   9  4  o 0 161.6   5.2   ?     ?   330.794   -105.309     175.643    -105.309     138.256    74.6914      
1 1 1 7   9  5  o 0 263.2   7.2   ?     ?   838.25    -121.031     109.226    58.9689      903.508    58.9689      
1 1 1 7   9  6  o 0 2498.7  44.2  ?     ?   1478.08   178.008      789.09     178.008      590.451    -1.99191     
1 1 1 7   9  7  o 0 2426.3  43.3  ?     ?   1157.23   105.563      1049.82    105.563      27.4842    -74.4367     
1 1 1 7   9  8  o 0 6.7     5.3   ?     ?   278.978   -74.7972     219.163    105.203      478.064    105.203      
1 1 1 7   9  9  o 0 559.8   13.8  ?     ?   421.933   26.7481      602.009    26.7481      206.147    26.7481      
1 1 1 7   9  10 o 0 373.3   11.1  ?     ?   367.45    95.6578      449.529    95.6578      106.238    95.6578      
1 1 1 7   9  11 o 0 494.5   14.1  ?     ?   557.311   -80.8041     421.107    -80.8041     97.0871    99.1959      
1 1 1 7   9  12 o 0 23.4    9     ?     ?   75.3567   66.6029      26.913     -113.397     95.159     -113.397     
1 1 1 7   9  13 o 0 459.1   14.4  ?     ?   497.298   -70.1107     445.994    -70.1106     1.77602    109.889      
1 1 1 7   9  14 o 0 101     10    ?     ?   218.351   0.419487     159.821    0.419487     37.2611    -179.581     
1 1 1 7   9  15 o 0 102     11.4  ?     ?   115.831   -114.162     237.407    -114.162     120.158    -114.162     
1 1 1 7   9  16 o 0 55.2    10.1  ?     ?   296.71    -64.5661     26.3659    -64.5661     266.602    115.434      
1 1 1 7   9  17 o 0 61.2    13.9  ?     ?   144.173   136.222      165.385    136.222      26.4813    136.222      
1 1 1 7   9  18 f 1 -17.3   12.8  ?     ?   35.091    -172.811     22.6353    7.1894       56.3418    7.1894       
1 1 1 7   9  19 o 0 65.1    19.1  ?     ?   83.7862   -91.1517     188.332    -91.1517     110.633    -91.1517     
1 1 1 7   9  20 o 0 209.6   20.3  ?     ?   386.263   -68.5365     291.787    -68.5365     66.312     111.463      
1 1 1 7   9  21 o 0 121.3   20.8  ?     ?   264.961   -87.2356     233.975    -87.2356     30.1734    92.7644      
1 1 1 7   9  22 o 0 43.2    25.4  ?     ?   178.892   -57.3565     76.8523    -57.3565     101.069    122.644      
1 1 1 7   9  23 o 0 48.3    25.1  ?     ?   153.408   -78.6555     119.622    -78.6555     23.2707    101.344      
1 1 1 7   9  24 o 0 49.4    26.2  ?     ?   84.2521   -82.5376     159.039    -82.5376     82.4057    -82.5376     
1 1 1 -7  11 23 < 1 61.7    20.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  11 22 o 0 164.4   19    ?     ?   229.712   -113.305     348.749    -113.305     147.994    -113.305     
1 1 1 -7  11 21 o 0 36.4    15.9  ?     ?   160.935   168.579      80.6638    168.579      63.3787    -11.4208     
1 1 1 -7  11 20 o 0 35.1    16    ?     ?   183.8     -166.079     51.6038    -166.079     118.147    13.9214      
1 1 1 -7  11 19 o 0 102.4   14.1  ?     ?   109.726   -139.923     304.042    -139.923     198.921    -139.923     
1 1 1 -7  11 18 f 1 365.3   16.7  ?     ?   422.088   -91.1305     457.454    -91.1305     79.4759    -91.1305     
1 1 1 -7  11 17 o 0 114.5   13.3  ?     ?   158.027   123.4        292.07     123.4        151.244    123.4        
1 1 1 -7  11 16 o 0 149.3   11.5  ?     ?   297.665   96.9403      262.197    96.9403      4.33646    -83.0597     
1 1 1 -7  11 15 o 0 10.8    10.1  ?     ?   118.448   170.332      32.1163    -9.6683      141.766    -9.6683      
1 1 1 -7  11 14 o 0 -12     9.4   ?     ?   142.292   -115.235     101.499    64.7654      234.227    64.7654      
1 1 1 -7  11 13 f 1 36.4    8.7   ?     ?   106.998   -89.6109     66.5542    -89.6109     36.2       90.3891      
1 1 1 -7  11 12 o 0 5.2     7.9   ?     ?   190.359   -105.983     130.886    74.0172      317.227    74.0172      
1 1 1 -7  11 11 o 0 75.8    6.6   ?     ?   140.739   37.9363      165.238    37.9363      26.6196    37.9363      
1 1 1 -7  11 10 o 0 166.7   7.7   ?     ?   325.626   2.90679      210.414    2.90679      75.245     -177.093     
1 1 1 -7  11 9  o 0 951.7   19.2  ?     ?   644.664   -136.415     712.904    -136.415     144.449    -136.415     
1 1 1 -7  11 8  o 0 254.2   8.4   ?     ?   443.991   -97.9676     244.042    -97.9676     145.865    82.0324      
1 1 1 -7  11 7  o 0 113.8   5.9   ?     ?   312.455   -116.005     113.885    -116.005     161.639    63.9953      
1 1 1 -7  11 6  o 0 95      5.3   ?     ?   290.916   -26.2205     87.3422    -26.2205     170.111    153.779      
1 1 1 -7  11 5  o 0 79      4.9   ?     ?   240.048   -125.384     57.4703    -125.384     160.153    54.6158      
1 1 1 -7  11 4  o 0 77.9    4.9   ?     ?   493.427   -148.196     115.25     31.8038      563.727    31.8038      
1 1 1 -7  11 3  o 0 511.6   12.1  ?     ?   530.049   86.6046      451.834    86.6046      30.9125    -93.3954     
1 1 1 -7  11 2  o 0 350.6   10.8  ?     ?   377.514   68.177       405.543    68.177       61.1873    68.177       
1 1 1 -7  11 1  o 0 240.1   7.3   ?     ?   230.187   52.2172      356.76     52.2172      146.57     52.2172      
1 1 1 7   11 0  o 0 121.3   5.4   ?     ?   338.704   -21.5643     97.5444    -21.5643     212.332    158.436      
1 1 1 7   11 1  o 0 395     10.2  ?     ?   703.811   -99.0163     186.383    -99.0163     457.578    80.9837      
1 1 1 7   11 2  o 0 938.8   18.7  ?     ?   932.658   118.091      451.212    118.091      401.823    -61.9092     
1 1 1 7   11 3  o 0 1062    21.4  ?     ?   634.954   104.708      796.127    104.708      215.863    104.708      
1 1 1 7   11 4  o 0 487.9   11.7  ?     ?   591.41    57.7473      378.227    57.7473      161.533    -122.253     
1 1 1 7   11 5  o 0 365.7   9.8   ?     ?   322.525   -163.544     461.783    -163.544     167.958    -163.544     
1 1 1 7   11 6  o 0 373.9   11.2  ?     ?   440.311   58.3465      396.632    58.3465      4.77166    58.3465      
1 1 1 7   11 7  o 0 204     8.4   ?     ?   352.42    105.497      244.171    105.497      68.5796    -74.5026     
1 1 1 7   11 8  o 0 492.2   16.3  ?     ?   545.696   137.172      431.191    137.172      51.4543    -42.8282     
1 1 1 7   11 9  o 0 549.5   13.9  ?     ?   432.921   57.1311      579.506    57.1311      194.749    57.1311      
1 1 1 7   11 10 o 0 47.3    9.8   ?     ?   274.395   -20.5055     14.0181    159.495      256.814    159.495      
1 1 1 7   11 11 o 0 453     16.9  ?     ?   429.505   109.046      553.654    109.046      126.65     109.046      
1 1 1 7   11 12 o 0 89.1    10.9  ?     ?   250.052   21.1214      143.457    21.1214      103.794    -158.879     
1 1 1 7   11 13 f 1 128.4   10.6  ?     ?   343.899   3.51669      168.234    3.51669      165.611    -176.483     
1 1 1 7   11 14 o 0 -19.1   12.5  ?     ?   139.748   36.4462      94.9237    -143.554     226.789    -143.554     
1 1 1 7   11 15 o 0 63.3    12    ?     ?   75.4096   -156.494     179.251    -156.494     110.343    -156.494     
1 1 1 7   11 16 o 0 83.9    14.5  ?     ?   318.449   -172.745     104.805    -172.745     184.05     7.25492      
1 1 1 7   11 17 o 0 78.9    14.8  ?     ?   281.634   130.741      120.549    130.741      133.875    -49.259      
1 1 1 7   11 18 f 1 214.5   16.8  ?     ?   248.522   74.4044      427.515    74.4044      190.826    74.4044      
1 1 1 7   11 19 o 0 21.8    18.9  ?     ?   96.3006   48.2299      57.4833    48.2299      36.8762    -131.77      
1 1 1 7   11 20 o 0 74.2    20.2  ?     ?   239.776   -10.5701     139.159    -10.5701     85.8001    169.43       
1 1 1 7   11 21 o 0 126.1   22.5  ?     ?   195.811   -20.6882     300.638    -20.6882     122.476    -20.6882     
1 1 1 7   11 22 o 0 165.6   26.8  ?     ?   221.494   -34.6988     354.632    -34.6988     157.272    -34.6988     
1 1 1 7   11 23 < 1 27.3    24.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  13 20 < 0 -13.5   19.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  13 19 f 1 23.1    21.1  ?     ?   152.096   128.439      44.7886    128.439      86.0078    -51.5613     
1 1 1 -7  13 18 o 0 110.9   17.5  ?     ?   213.988   120.813      249.878    120.813      62.5939    120.813      
1 1 1 -7  13 17 f 1 166.2   17    ?     ?   226.097   151.834      346.745    151.834      141.746    151.834      
1 1 1 -7  13 16 f 1 149     14.8  ?     ?   333.983   -162.851     216.765    -162.851     99.3329    17.1486      
1 1 1 -7  13 15 o 0 169.1   13.6  ?     ?   289.161   71.2876      297.66     71.2876      25.1852    71.2876      
1 1 1 -7  13 14 o 0 58.5    11.6  ?     ?   106.425   -12.1922     174.153    -12.1922     81.0536    -12.1922     
1 1 1 -7  13 13 o 0 30      10.3  ?     ?   151.019   33.1468      50.3151    33.1468      81.6008    -146.853     
1 1 1 -7  13 12 o 0 22.2    8.4   ?     ?   156.248   -129.908     13.7238    -129.908     123.687    50.0923      
1 1 1 -7  13 11 o 0 224.5   10.2  ?     ?   303.444   -140.053     378.033    -140.053     110.499    -140.053     
1 1 1 -7  13 10 o 0 152.6   8.6   ?     ?   250.568   154.788      294.927    154.788      67.0548    154.788      
1 1 1 -7  13 9  o 0 257.7   9.9   ?     ?   431.139   -97.3735     312.843    -97.3735     81.3257    82.6265      
1 1 1 -7  13 8  f 1 208.7   8.4   ?     ?   413.072   -88.7527     245.092    -88.7527     142.805    91.2473      
1 1 1 -7  13 7  o 0 219     8.6   ?     ?   274.676   173.03       381.766    173.03       124.045    173.03       
1 1 1 -7  13 6  o 0 138.9   7.1   ?     ?   299.048   114.797      225.021    114.797      56.6346    -65.2026     
1 1 1 -7  13 5  o 0 915.4   19    ?     ?   595.687   108.663      796.684    108.663      223.789    108.663      
1 1 1 -7  13 4  o 0 11.6    5.3   ?     ?   52.9512   -41.0431     26.0651    138.957      77.1332    138.957      
1 1 1 -7  13 3  o 0 15.1    5.7   ?     ?   106.995   37.9564      40.7684    -142.044     144.197    -142.044     
1 1 1 -7  13 2  o 0 287.4   9.6   ?     ?   325.173   28.6298      430.853    28.6298      115.942    28.6298      
1 1 1 -7  13 1  f 1 170.7   8.3   ?     ?   302.624   -54.9667     268.325    -54.9667     26.6559    125.033      
1 1 1 7   13 0  o 0 423.6   11.8  ?     ?   466.856   -139.282     476.153    -139.282     21.6645    -139.282     
1 1 1 7   13 1  f 1 125     6.9   ?     ?   150.207   91.0556      280.533    91.0556      133.595    91.0556      
1 1 1 7   13 2  o 0 389.9   13.1  ?     ?   626.286   1.1919       288.45     1.1919       320.629    -178.808     
1 1 1 7   13 3  o 0 873.2   22.7  ?     ?   454.914   76.675       901.608    76.675       459.718    76.675       
1 1 1 7   13 4  o 0 408     12    ?     ?   319.574   -158.692     586.709    -158.692     276.798    -158.692     
1 1 1 7   13 5  o 0 101.6   6.9   ?     ?   33.7657   118.127      109.292    118.127      76.6168    118.127      
1 1 1 7   13 6  o 0 518     14.1  ?     ?   426.228   139.731      622.372    139.731      218.178    139.731      
1 1 1 7   13 7  o 0 215.8   9.8   ?     ?   151.438   -163.991     464.673    -163.991     321.511    -163.991     
1 1 1 7   13 8  f 1 90.2    8.3   ?     ?   289.659   13.2128      125.823    13.2128      148.422    -166.787     
1 1 1 7   13 9  o 0 66.9    8.8   ?     ?   169.714   120.121      164.166    120.121      7.61985    120.121      
1 1 1 7   13 10 o 0 35.8    10.2  ?     ?   212.827   73.42        32.3865    73.42        163.023    -106.58      
1 1 1 7   13 11 o 0 76.1    11.2  ?     ?   193.553   117.182      180.102    117.182      7.69514    117.182      
1 1 1 7   13 12 o 0 270.6   13.8  ?     ?   347.544   -112.621     408.117    -112.621     99.1117    -112.621     
1 1 1 7   13 13 o 0 110.2   13.9  ?     ?   227.317   -39.9077     233.414    -39.9077     32.531     -39.9077     
1 1 1 7   13 14 o 0 -8.1    15.8  ?     ?   49.3937   -74.672      13.3984    105.328      57.1421    105.328      
1 1 1 7   13 15 o 0 11.3    16.4  ?     ?   94.2207   -12.8628     13.1394    -12.8628     76.8044    167.137      
1 1 1 7   13 16 f 1 89.9    18.4  ?     ?   159.508   -67.6125     240.052    -67.6125     87.009     -67.6125     
1 1 1 7   13 17 f 1 305.4   26.2  ?     ?   310.731   -113.162     485.241    -113.162     199.435    -113.162     
1 1 1 7   13 18 o 0 75.2    23.7  ?     ?   133.819   -0.1171      207.591    -0.1171      88.6977    -0.1171      
1 1 1 7   13 19 f 1 81.9    20.6  ?     ?   111.535   -0.915367    254.003    -0.915367    156.569    -0.915367    
1 1 1 7   13 20 < 0 121.6   27.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  15 17 < 0 25.3    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  15 16 < 0 37.4    19.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  15 15 o 0 -2.9    16.2  ?     ?   60.9683   -99.301      8.72108    -99.301      42.1986    80.699       
1 1 1 -7  15 14 f 1 115.7   15.7  ?     ?   241.849   12.6914      237.389    12.6914      32.7546    12.6914      
1 1 1 -7  15 13 o 0 3.5     12.5  ?     ?   171.99    -2.44201     47.352     177.558      195.136    177.558      
1 1 1 -7  15 12 o 0 111.2   14.9  ?     ?   233.29    26.2967      230.435    26.2967      24.285     26.2967      
1 1 1 -7  15 11 o 0 46.3    11.5  ?     ?   138.096   -5.50697     131.388    -5.50697     4.28813    -5.50697     
1 1 1 -7  15 10 o 0 22.8    10.7  ?     ?   62.9595   -34.7288     44.9635    -34.7288     12.8949    145.271      
1 1 1 -7  15 9  o 0 35.6    9     ?     ?   33.3173   -49.7729     68.2419    -49.7729     37.4559    -49.7729     
1 1 1 -7  15 8  o 0 11.5    8.9   ?     ?   167.521   -150.689     41.0955    29.3113      184.405    29.3113      
1 1 1 -7  15 7  o 0 101.2   10    ?     ?   216.494   -44.8632     217.147    -44.8632     31.1074    -44.8632     
1 1 1 -7  15 6  o 0 172.7   9.5   ?     ?   380.645   -19.3615     223.92     -19.3615     101.641    160.639      
1 1 1 -7  15 5  o 0 200.9   10.2  ?     ?   400.534   -76.7004     253.251    -76.7004     90.531     103.3        
1 1 1 -7  15 4  o 0 212.3   9.6   ?     ?   490.139   -126.929     197.396    -126.929     224.577    53.0714      
1 1 1 -7  15 3  o 0 247.5   10.7  ?     ?   294.948   -84.3329     407.674    -84.3329     153.093    -84.3329     
1 1 1 -7  15 2  o 0 284.5   12.5  ?     ?   336.004   -28.1317     425.159    -28.1317     134.532    -28.1317     
1 1 1 -7  15 1  o 0 76.7    8.2   ?     ?   171.614   -61.498      190.928    -61.498      42.8066    -61.498      
1 1 1 7   15 0  o 0 1       7.9   ?     ?   110.099   -136.615     56.5221    43.3852      152.083    43.3852      
1 1 1 7   15 1  o 0 218.1   10    ?     ?   335.791   -90.2199     336.633    -90.2199     45.357     -90.2199     
1 1 1 7   15 2  o 0 5.8     7.8   ?     ?   229.341   -175.407     114.478    4.59303      313.957    4.59303      
1 1 1 7   15 3  o 0 52.2    8.8   ?     ?   98.3024   84.8595      148.87     84.8595      63.4954    84.8595      
1 1 1 7   15 4  o 0 18.3    8.7   ?     ?   131.17    -125.259     4.60807    -125.259     109.089    54.7411      
1 1 1 7   15 5  o 0 281.3   11.4  ?     ?   378.422   -135.569     386.836    -135.569     59.62      -135.569     
1 1 1 7   15 6  o 0 25.2    10.2  ?     ?   35.49     -124.009     32.3288    -124.009     1.46204    -124.009     
1 1 1 7   15 7  o 0 73.4    11.3  ?     ?   103.684   16.5095      214.972    16.5095      125.099    16.5095      
1 1 1 7   15 8  o 0 26.4    9.4   ?     ?   159.428   -0.147239    36.1132    -0.147239    108.207    179.853      
1 1 1 7   15 9  o 0 181     13.6  ?     ?   255.953   -54.9198     343.815    -54.9198     104.952    -54.9198     
1 1 1 7   15 10 o 0 52.6    14.3  ?     ?   24.0726   -168.577     83.6185    -168.577     61.2614    -168.577     
1 1 1 7   15 11 o 0 59.2    15.9  ?     ?   146.438   81.6356      163.794    81.6356      27.4986    81.6356      
1 1 1 7   15 12 o 0 8.2     15.4  ?     ?   40.1593   -9.96494     13.7461    -9.96494     22.1641    170.035      
1 1 1 7   15 13 o 0 43      18.3  ?     ?   160.782   -131.575     98.7032    -131.575     41.1875    48.4251      
1 1 1 7   15 14 f 1 83.1    20.4  ?     ?   183.095   170.223      204.681    170.223      47.7099    170.223      
1 1 1 7   15 15 o 0 6.9     18.2  ?     ?   153.14    150.135      4.01012    150.135      125.958    -29.8654     
1 1 1 7   15 16 < 0 21.4    22.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 7   15 17 < 0 20.8    22.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  17 11 < 0 4.4     16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  17 10 < 0 49      14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -7  17 9  o 0 -3.1    13.8  ?     ?   99.8796   100.035      2.44796    -79.9652     83.8707    -79.9652     
1 1 1 -7  17 8  f 1 58.5    13    ?     ?   45.587    9.29724      181.387    9.29724      143.923    9.29724      
1 1 1 -7  17 7  o 0 70      13.1  ?     ?   200.066   -106.855     163.003    -106.855     1.34584    73.145       
1 1 1 -7  17 6  o 0 33.6    12.3  ?     ?   105.692   -93.166      106.333    -93.166      19.1416    -93.166      
1 1 1 -7  17 5  o 0 -1.2    11.2  ?     ?   127.646   65.4816      37.4831    -114.518     144.578    -114.518     
1 1 1 -7  17 4  o 0 33.5    11.9  ?     ?   82.2474   -4.37075     105.321    -4.37075     36.0885    -4.37075     
1 1 1 -7  17 3  o 0 24.7    12    ?     ?   119.113   -134.782     58.7028    -134.782     41.8438    45.2182      
1 1 1 -7  17 2  o 0 29.3    13.3  ?     ?   95.2565   -106.669     76.4731    -106.669     5.8403     73.3306      
1 1 1 -7  17 1  o 0 178.4   12    ?     ?   321.502   -89.0956     277.811    -89.0956     0.530451   90.9044      
1 1 1 7   17 0  o 0 177.3   12.5  ?     ?   312.968   -106.848     284.892    -106.848     11.9907    -106.848     
1 1 1 7   17 1  o 0 9.8     11.4  ?     ?   127.554   -179.435     12.7778    0.565401     123.905    0.565401     
1 1 1 7   17 2  o 0 35.5    12.8  ?     ?   123.461   153.207      99.0705    153.207      6.10812    -26.7929     
1 1 1 7   17 3  o 0 39.7    13    ?     ?   22.2369   14.8633      64.2603    14.8633      45.3498    14.8633      
1 1 1 7   17 4  o 0 117.6   14.2  ?     ?   152.801   -144.733     303.05     -144.733     173.397    -144.733     
1 1 1 7   17 5  o 0 208.3   14.6  ?     ?   325.138   -156.597     327.059    -156.597     51.9213    -156.597     
1 1 1 7   17 6  o 0 46.5    15    ?     ?   171.149   -166.829     110.442    -166.829     32.0473    13.1707      
1 1 1 7   17 7  o 0 -14.5   15.9  ?     ?   16.1459   -56.0928     0.735651   123.907      14.129     123.907      
1 1 1 7   17 8  f 1 23      16.1  ?     ?   142.173   -12.4325     50.5108    -12.4325     67.8091    167.568      
1 1 1 7   17 9  o 0 13.6    20.3  ?     ?   95.0154   -101.693     54.7479    -101.693     23.5614    78.3069      
1 1 1 7   17 10 < 0 22.1    14.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 7   17 11 < 0 16.6    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  0  29 < 0 -1.9    26.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  0  28 o 0 31.9    34.2  ?     ?   166.588   0            99.9428    0            56.5993    180          
1 1 1 -8  0  27 o 0 10.9    20.7  ?     ?   2.76714   0            1.51715    0            1.14807    180          
1 1 1 -8  0  26 o 0 -0.6    18.4  ?     ?   17.81     180          5.74599    180          12.5878    3.20293e-15  
1 1 1 -8  0  25 o 0 -24.5   25    ?     ?   119.609   180          22.0717    180          91.7338    1.68826e-15  
1 1 1 -8  0  24 o 0 32.1    17.1  ?     ?   37.4499   180          31.8848    180          3.80945    5.87293e-14  
1 1 1 -8  0  23 o 0 805.4   27.9  ?     ?   596.534   0            689.356    0            117.192    0            
1 1 1 -8  0  22 o 0 116.9   19.8  ?     ?   364.421   0            261.325    0            106.767    180          
1 1 1 -8  0  21 o 0 531.7   23    ?     ?   479.364   0            571.049    0            73.6565    0            
1 1 1 -8  0  20 o 0 74.2    13.8  ?     ?   252.644   180          172.107    180          62.136     1.94351e-14  
1 1 1 -8  0  19 o 0 43.6    10.7  ?     ?   79.8369   180          41.0003    180          33.0028    8.71706e-15  
1 1 1 -8  0  18 o 0 45.9    12.1  ?     ?   325.481   180          117.136    180          193.469    4.24829e-15  
1 1 1 -8  0  17 f 1 2033.4  54.5  ?     ?   759.399   180          1026.47    180          292.489    180          
1 1 1 -8  0  16 o 0 5232.3  127.5 ?     ?   1841.84   180          1614.37    180          143.649    7.8856e-14   
1 1 1 -8  0  15 o 0 9.9     8.1   ?     ?   410.256   180          29.4414    180          369.991    5.58343e-16  
1 1 1 -8  0  14 o 0 41.4    6.3   ?     ?   151.369   0            67.63      0            80.6728    180          
1 1 1 -8  0  13 o 0 14.6    7.3   ?     ?   23.2472   180          3.32414    180          20.5073    1.13738e-15  
1 1 1 -8  0  12 o 0 230.3   8.5   ?     ?   432.806   180          364.94     180          81.1047    3.15725e-14  
1 1 1 -8  0  11 o 0 75.5    6.6   ?     ?   163.905   0            136.06     0            33.671     180          
1 1 1 -8  0  10 o 0 122.7   5.1   ?     ?   286.867   180          257.113    180          45.4329    3.97089e-14  
1 1 1 -8  0  9  o 0 255.4   8     ?     ?   595.633   180          398.818    180          231.684    1.20785e-14  
1 1 1 -8  0  8  o 0 2.7     2     ?     ?   87.2399   180          1.95856    180          83.6015    1.64382e-16  
1 1 1 -8  0  7  f 1 897.6   23.2  ?     ?   501.213   0            694.382    0            199.148    0            
1 1 1 -8  0  6  o 0 516.7   13.6  ?     ?   564.917   0            507.02     0            27.3671    180          
1 1 1 -8  0  5  o 0 0.3     1     ?     ?   16.2469   180          0.0768723  180          14.955     3.60675e-17  
1 1 1 -8  0  4  o 0 34      2.1   ?     ?   143.36    180          52.8782    180          79.6683    4.6572e-15   
1 1 1 -8  0  3  o 0 4334.7  117.8 ?     ?   1377.53   0            1403.81    0            157.345    0            
1 1 1 -8  0  2  o 0 131.1   3.9   ?     ?   563.61    0            243.072    0            265.42     180          
1 1 1 -8  0  1  o 0 23.8    1.3   ?     ?   410.565   180          81.3942    180          288.159    1.98196e-15  
1 1 1 8   0  0  o 0 583.5   16.9  ?     ?   395.425   -2.37535e-14 513.086    0            156.845    5.3951e-14   
1 1 1 8   0  1  o 0 55.8    2.4   ?     ?   353.143   0            141.117    0            178.542    180          
1 1 1 8   0  2  o 0 5004.9  138.2 ?     ?   1695.77   180          1517.7     180          26.2442    4.05777e-13  
1 1 1 8   0  3  o 0 6321.6  149.8 ?     ?   1922.08   0            1713.26    0            44.4344    180          
1 1 1 8   0  4  o 0 77.9    3.5   ?     ?   170.354   0            128.909    0            30.3324    180          
1 1 1 8   0  5  o 0 214.5   9.2   ?     ?   180.637   180          286.161    180          117.192    180          
1 1 1 8   0  6  o 0 1351.7  34.2  ?     ?   943.701   180          828.889    180          73.5578    7.90681e-14  
1 1 1 8   0  7  f 1 790.9   19.9  ?     ?   730.123   0            658.914    0            70.3322    180          
1 1 1 8   0  8  o 0 3121.3  75.4  ?     ?   979.817   180          1305.28    180          333.887    180          
1 1 1 8   0  9  o 0 688.9   18.2  ?     ?   781.937   0            662.237    0            174.546    180          
1 1 1 8   0  10 o 0 33.1    5.4   ?     ?   261.692   180          94.3263    180          184.739    3.58268e-15  
1 1 1 8   0  11 o 0 107.9   6.6   ?     ?   513.801   180          252.473    180          285.632    6.20214e-15  
1 1 1 8   0  12 o 0 9.5     7.7   ?     ?   124.763   0            10.5012    0            119.574    180          
1 1 1 8   0  14 o 0 125.5   12.8  ?     ?   188.33    0            205.257    0            18.4623    0            
1 1 1 8   0  15 o 0 711.7   24.5  ?     ?   602.504   0            607.394    0            13.2945    0            
1 1 1 8   0  16 o 0 209.6   25.5  ?     ?   105.119   180          208.185    180          106.523    180          
1 1 1 8   0  17 f 1 282.5   20.9  ?     ?   384.012   0            385.976    0            9.72635    0            
1 1 1 8   0  18 o 0 -25.6   17.5  ?     ?   352.276   0            10.7188    0            330.238    180          
1 1 1 8   0  19 o 0 238.2   24.2  ?     ?   80.0718   0            211.489    0            136.172    0            
1 1 1 8   0  20 o 0 41.3    19.9  ?     ?   208.696   180          85.5528    180          110.91     5.41248e-15  
1 1 1 8   0  21 o 0 274.1   21    ?     ?   258.082   0            415.293    0            143.239    0            
1 1 1 8   0  22 o 0 184.5   27.8  ?     ?   102.366   0            309.902    0            204.794    0            
1 1 1 8   0  23 o 0 446.8   34.6  ?     ?   231.301   0            519.526    0            293.859    0            
1 1 1 8   0  24 o 0 1.3     24.7  ?     ?   116.144   180          33.8094    180          78.8674    3.00796e-15  
1 1 1 8   0  25 o 0 186.2   32.7  ?     ?   261.606   0            337.569    0            71.7662    0            
1 1 1 8   0  27 o 0 -6.7    37.2  ?     ?   72.7844   180          39.6124    180          31.8954    8.71439e-15  
1 1 1 -8  2  29 < 0 -2.2    17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  2  28 o 0 34.3    21.7  ?     ?   149.709   -127.977     86.4674    -127.977     53.3778    52.0228      
1 1 1 -8  2  27 o 0 40      15.3  ?     ?   62.8834   -65.4643     135.422    -65.4642     75.3285    -65.4642     
1 1 1 -8  2  26 o 0 101.6   20.3  ?     ?   181.349   32.248       266.865    32.248       81.5817    32.248       
1 1 1 -8  2  25 o 0 71.8    19    ?     ?   144.425   140.479      217.348    140.479      69.2444    140.479      
1 1 1 -8  2  24 o 0 78.1    17.7  ?     ?   51.8071   36.3624      195.838    36.3624      146.796    36.3624      
1 1 1 -8  2  23 o 0 33.8    13.9  ?     ?   110.153   56.4235      80.2263    56.4235      24.7449    -123.576     
1 1 1 -8  2  22 o 0 309.3   13.4  ?     ?   343.23    29.5348      493.754    29.5348      154.936    29.5348      
1 1 1 -8  2  21 o 0 202.8   13.4  ?     ?   267.288   70.0999      374.195    70.0999      98.445     70.0999      
1 1 1 -8  2  20 f 1 93.2    9.7   ?     ?   169.274   -122.789     162.814    -122.789     5.90752    -122.789     
1 1 1 -8  2  19 o 0 173.4   10.5  ?     ?   401.091   -154.614     166.02     -154.614     203.914    25.3856      
1 1 1 -8  2  18 o 0 92      8.2   ?     ?   190.465   57.3199      129.758    57.3199      47.4026    -122.68      
1 1 1 -8  2  17 o 0 253.4   9.9   ?     ?   233.823   -73.1534     392.085    -73.1534     168.174    -73.1534     
1 1 1 -8  2  16 o 0 619.8   15.5  ?     ?   777.371   40.4138      339.975    40.4138      399.278    -139.586     
1 1 1 -8  2  15 o 0 918.9   21.1  ?     ?   651.629   -177.316     700.141    -177.316     75.979     -177.316     
1 1 1 -8  2  14 o 0 690.9   15.3  ?     ?   337.247   0.165536     791.678    0.165536     462.155    0.165536     
1 1 1 -8  2  13 o 0 840     19.4  ?     ?   490.402   -115.467     831.475    -115.467     323.769    -115.467     
1 1 1 -8  2  12 o 0 243.5   7.2   ?     ?   541.981   -164.63      151.173    -164.63      406.536    15.3704      
1 1 1 -8  2  11 o 0 331.5   7.7   ?     ?   377.2     -151.754     429.467    -151.754     39.1843    -151.754     
1 1 1 -8  2  10 o 0 105.2   3.7   ?     ?   254.404   11.1998      136.295    11.1998      134.336    -168.8       
1 1 1 -8  2  9  o 0 726.7   13.5  ?     ?   669.333   54.1877      602.298    54.1877      106.814    -125.812     
1 1 1 -8  2  8  o 0 204.1   5.8   ?     ?   379.082   -44.1605     228.982    -44.1605     143.503    135.839      
1 1 1 -8  2  7  o 0 696.3   12.8  ?     ?   572.372   -46.291      624.052    -46.291      59.6319    -46.291      
1 1 1 -8  2  6  o 0 684.6   17.9  ?     ?   489.979   -143.451     690.143    -143.451     205.517    -143.451     
1 1 1 -8  2  5  o 0 2309    40.2  ?     ?   986.182   112.593      1197.55    112.593      258.077    112.593      
1 1 1 -8  2  4  f 1 1798.6  31.4  ?     ?   846.082   173.888      1047.94    173.888      254.622    173.888      
1 1 1 -8  2  3  o 0 4269.3  118.1 ?     ?   1413.17   -155.192     1538.57    -155.192     219.212    -155.192     
1 1 1 -8  2  2  o 0 2080.2  51.9  ?     ?   1045.41   -157.681     991.965    -157.681     34.861     -157.681     
1 1 1 8   2  0  o 0 1042    29.2  ?     ?   889.378   79.7491      548.856    79.7491      254.387    -100.251     
1 1 1 8   2  1  f 1 340     7.2   ?     ?   491.447   -122.719     299.093    -122.719     149.154    57.2813      
1 1 1 8   2  2  o 0 3731.4  63.3  ?     ?   1483.39   58.1289      1284.7     58.1289      94.4636    -121.871     
1 1 1 8   2  3  o 0 426.7   8.1   ?     ?   484.274   -39.9464     413.431    -39.9464     38.4023    140.054      
1 1 1 8   2  4  f 1 843.3   15.4  ?     ?   896.55    156.587      414.806    156.587      427.6      -23.4128     
1 1 1 8   2  5  o 0 589.2   11.3  ?     ?   522.901   -93.2009     553.655    -93.2009     53.4392    -93.2009     
1 1 1 8   2  6  o 0 646.4   12.2  ?     ?   634.068   140.126      526.834    140.126      103.904    -39.8743     
1 1 1 8   2  7  o 0 131.3   3.8   ?     ?   233.97    164.512      196.029    164.512      36.2927    -15.4878     
1 1 1 8   2  8  o 0 662.1   13.3  ?     ?   536.592   -26.8151     680.752    -26.8151     105.424    -26.8151     
1 1 1 8   2  9  o 0 1300    25.7  ?     ?   945.237   -163.666     781.534    -163.666     228.637    16.3342      
1 1 1 8   2  10 o 0 8       4.1   ?     ?   106.638   -30.4443     92.3707    149.556      206.886    149.556      
1 1 1 8   2  11 o 0 2433.6  43.2  ?     ?   1200.27   -4.34284     1137.01    -4.34284     117.494    175.657      
1 1 1 8   2  12 o 0 827.5   17.7  ?     ?   779.996   -117.937     558.858    -117.937     252.433    62.0634      
1 1 1 8   2  13 o 0 154.1   12.6  ?     ?   340.303   72.9577      162.699    72.9577      175.75     -107.042     
1 1 1 8   2  14 o 0 147.2   9.9   ?     ?   215.628   33.8222      224.713    33.8222      11.4912    33.8222      
1 1 1 8   2  15 o 0 352.5   12.1  ?     ?   364.303   145.719      434.159    145.719      80.807     145.719      
1 1 1 8   2  16 o 0 13.4    13.8  ?     ?   273.412   62.3466      179.829    -117.653     443.276    -117.653     
1 1 1 8   2  17 o 0 1499.6  32    ?     ?   970.38    83.3859      814.652    83.3859      127.463    -96.6141     
1 1 1 8   2  18 o 0 252.8   13.5  ?     ?   300.364   81.5228      371.654    81.5228      88.227     81.5228      
1 1 1 8   2  19 o 0 321.3   14.5  ?     ?   190.022   60.6489      543.816    60.6489      364.349    60.6489      
1 1 1 8   2  20 f 1 54      12.8  ?     ?   58.984    88.9408      42.3814    88.9408      13.155     -91.0592     
1 1 1 8   2  21 o 0 125     15.3  ?     ?   267.2     -95.1446     241.711    -95.1446     33.5851    84.8554      
1 1 1 8   2  22 o 0 47.8    17.5  ?     ?   207.632   -75.7613     75.9275    -75.7613     132.542    104.239      
1 1 1 8   2  23 o 0 323.5   19.2  ?     ?   339.698   -36.2748     528.477    -36.2748     198.994    -36.2748     
1 1 1 8   2  24 o 0 9.4     17.2  ?     ?   56.5078   -16.4208     6.08934    -16.4208     48.3939    163.579      
1 1 1 8   2  25 o 0 92.5    24.8  ?     ?   211.826   -41.6821     217.962    -41.6821     3.44453    138.318      
1 1 1 8   2  26 o 0 94.7    22.6  ?     ?   235.164   -75.1857     201.126    -75.1857     43.9505    104.814      
1 1 1 8   2  27 o 0 108.5   28.1  ?     ?   313.183   -86.5833     165.048    -86.5833     140.464    93.4167      
1 1 1 8   2  28 o 0 26.5    24.2  ?     ?   131.435   175.066      80.1172    175.066      45.3112    -4.9344      
1 1 1 -8  4  28 < 0 -6.2    23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  4  27 o 0 3.4     22    ?     ?   64.0136   -80.1571     38.0262    -80.1571     21.386     99.8429      
1 1 1 -8  4  26 o 0 198.2   18.9  ?     ?   256.603   -107.843     403.705    -107.843     154.322    -107.843     
1 1 1 -8  4  25 o 0 29.4    16.4  ?     ?   122.749   -168.918     75.0693    -168.918     49.8098    11.0819      
1 1 1 -8  4  24 o 0 256     15.9  ?     ?   227.966   -174.856     507.406    -174.856     292.976    -174.856     
1 1 1 -8  4  23 o 0 59.9    12.3  ?     ?   190.139   -100.513     144.189    -100.513     35.0217    79.4868      
1 1 1 -8  4  22 o 0 114.7   12.1  ?     ?   247.903   82.5641      237.009    82.5641      4.20117    -97.4359     
1 1 1 -8  4  21 o 0 195.3   12.4  ?     ?   270.135   8.66743      369.548    8.66743      99.5587    8.66743      
1 1 1 -8  4  20 o 0 492.1   14.5  ?     ?   390.798   -87.4361     653.207    -87.4361     251.848    -87.4361     
1 1 1 -8  4  19 o 0 360.8   13.5  ?     ?   438.332   -80.4437     397.826    -80.4437     4.56365    99.5563      
1 1 1 -8  4  18 o 0 450.7   15.9  ?     ?   369.216   -17.4234     549.16     -17.4234     210.19     -17.4234     
1 1 1 -8  4  17 o 0 172.4   11.7  ?     ?   533.121   -79.2538     40.2469    -79.2538     463.831    100.746      
1 1 1 -8  4  16 o 0 1429.4  27.4  ?     ?   693.572   27.0798      1013.08    27.0798      352.028    27.0798      
1 1 1 -8  4  15 o 0 241.1   8.7   ?     ?   287.533   -34.5916     332.91     -34.5916     60.7728    -34.5916     
1 1 1 -8  4  14 o 0 1360.4  28.9  ?     ?   742.631   -62.0822     907.452    -62.0822     199.522    -62.0822     
1 1 1 -8  4  13 o 0 233.9   8.8   ?     ?   177.63    -26.4279     376.466    -26.4279     203.739    -26.4279     
1 1 1 -8  4  12 o 0 694.1   14.6  ?     ?   810.509   157.174      371.298    157.174      421.847    -22.8256     
1 1 1 -8  4  11 o 0 1982.9  35.2  ?     ?   1083.46   42.1889      1002.1     42.1889      107.377    -137.811     
1 1 1 -8  4  10 o 0 1763.9  31.1  ?     ?   1076.71   -55.6551     892.552    -55.6552     216.038    124.345      
1 1 1 -8  4  9  o 0 1233.4  22.3  ?     ?   841.272   39.3726      801.983    39.3726      68.5412    -140.627     
1 1 1 -8  4  8  f 1 774.9   14.2  ?     ?   507.521   -129.469     799.61     -129.469     261.864    -129.469     
1 1 1 -8  4  7  o 0 278.8   5.6   ?     ?   193.579   -34.7568     493.313    -34.7568     288.439    -34.7568     
1 1 1 -8  4  6  o 0 118.2   3     ?     ?   321.595   -80.2431     122.281    -80.2431     219.247    99.7569      
1 1 1 -8  4  5  o 0 905     16.3  ?     ?   658.468   -148.449     714.451    -148.449     66.7166    -148.449     
1 1 1 -8  4  3  o 0 825.3   14.8  ?     ?   530.463   -128.131     771.934    -128.131     248.316    -128.131     
1 1 1 -8  4  1  o 0 1113.9  21.2  ?     ?   581.333   -100.162     905.268    -100.162     353.676    -100.162     
1 1 1 8   4  0  o 0 1064.1  19.6  ?     ?   846.181   -69.9203     625.966    -69.9203     169.468    110.08       
1 1 1 8   4  2  o 0 276.4   5.5   ?     ?   387.444   -62.0867     318.369    -62.0867     47.6455    117.913      
1 1 1 8   4  3  o 0 1134.8  20.4  ?     ?   477.576   73.1176      1047.78    73.1176      577.492    73.1176      
1 1 1 8   4  4  o 0 317.2   6.6   ?     ?   353.926   53.4376      414.539    53.4376      65.7587    53.4376      
1 1 1 8   4  5  o 0 897.8   19.8  ?     ?   737.958   37.651       635.194    37.651       91.8859    -142.349     
1 1 1 8   4  6  o 0 121.8   3.7   ?     ?   331.609   56.6001      123.191    56.6001      230.125    -123.4       
1 1 1 8   4  7  o 0 4.6     2.5   ?     ?   147.398   56.5442      139.51     -123.456     296.252    -123.456     
1 1 1 8   4  8  f 1 563.3   13.4  ?     ?   360.374   -60.4537     735.977    -60.4537     351.822    -60.4537     
1 1 1 8   4  9  o 0 527.4   12.9  ?     ?   715.866   -65.933      341.353    -65.933      404.761    114.067      
1 1 1 8   4  10 o 0 530.4   13.1  ?     ?   385.521   -76.6727     658.254    -76.6727     258.032    -76.6727     
1 1 1 8   4  11 o 0 295.8   8.1   ?     ?   321.266   169.734      426.545    169.734      94.5313    169.734      
1 1 1 8   4  12 o 0 123.6   7.2   ?     ?   212.035   -146.261     177.911    -146.261     31.6779    33.7394      
1 1 1 8   4  13 o 0 965.8   19.6  ?     ?   709.986   135.883      682.829    135.883      15.108     -44.1173     
1 1 1 8   4  14 o 0 675.5   16.8  ?     ?   691.968   -8.44024     472.944    -8.44024     194.422    171.56       
1 1 1 8   4  15 o 0 396.5   14.4  ?     ?   488.754   -162.258     377.596    -162.258     90.7652    17.7425      
1 1 1 8   4  16 o 0 356.2   14.5  ?     ?   286.521   -89.9219     502.567    -89.9219     225.868    -89.9219     
1 1 1 8   4  17 o 0 1156.1  25.9  ?     ?   694.107   -59.2689     863.272    -59.2689     211.677    -59.2689     
1 1 1 8   4  18 o 0 50      14    ?     ?   58.3971   104.451      17.8843    104.451      36.5165    -75.5487     
1 1 1 8   4  19 o 0 21.3    12.7  ?     ?   123.887   69.1674      40.044     -110.833     155.526    -110.833     
1 1 1 8   4  20 o 0 552.9   18.9  ?     ?   484.905   165.168      638.027    165.168      131.976    165.168      
1 1 1 8   4  21 o 0 39      13.8  ?     ?   91.1945   67.3124      71.5642    67.3124      21.1193    -112.688     
1 1 1 8   4  22 o 0 73.1    15.3  ?     ?   187.769   156.21       188.861    156.21       7.57112    156.21       
1 1 1 8   4  23 o 0 151.7   19.2  ?     ?   289.653   178.141      286.427    178.141      8.40496    178.141      
1 1 1 8   4  24 o 0 128.7   23.6  ?     ?   88.5962   -52.6939     365.178    -52.6939     280.247    -52.6939     
1 1 1 8   4  25 o 0 49.8    26.2  ?     ?   192.7     -11.7824     90.6418    -11.7824     109.307    168.218      
1 1 1 8   4  26 o 0 -56.3   28    ?     ?   12.818    65.9692      1.91729    -114.031     14.6326    -114.031     
1 1 1 8   4  27 o 0 119.3   28.8  ?     ?   228.039   -89.9678     264.515    -89.9678     48.3131    -89.9678     
1 1 1 8   4  28 < 0 -16.7   26.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  6  27 < 1 5.4     16.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  6  26 o 0 85.3    16    ?     ?   236.555   138.132      189.823    138.132      27.0493    -41.8682     
1 1 1 -8  6  25 o 0 74.3    25.3  ?     ?   171.257   136.153      189.518    136.153      25.1215    136.153      
1 1 1 -8  6  24 o 0 183.6   15.4  ?     ?   284.423   51.9178      345.054    51.9178      59.2665    51.9178      
1 1 1 -8  6  23 f 1 72.4    14.2  ?     ?   255.951   28.6254      125.624    28.6254      113.359    -151.375     
1 1 1 -8  6  22 o 0 74      15.4  ?     ?   368.714   41.2896      35.2229    41.2896      307.947    -138.71      
1 1 1 -8  6  21 o 0 61.5    11.2  ?     ?   242.296   -23.7668     110.554    -23.7668     116.427    156.233      
1 1 1 -8  6  20 o 0 119.5   12    ?     ?   150.913   132.07       301.479    132.07       152.57     132.07       
1 1 1 -8  6  19 o 0 181.2   11    ?     ?   247.031   -97.2451     346.398    -97.2451     95.9564    -97.2451     
1 1 1 -8  6  18 o 0 12.1    8.7   ?     ?   318.516   -56.0918     195.063    123.908      483.659    123.908      
1 1 1 -8  6  17 o 0 60.6    8.9   ?     ?   159.04    154.939      79.2481    154.939      66.1042    -25.0608     
1 1 1 -8  6  16 o 0 183.4   9.4   ?     ?   319.31    141.01       242.018    141.01       49.669     -38.9905     
1 1 1 -8  6  15 o 0 516.4   13.6  ?     ?   404.98    83.3449      575.083    83.3449      194.303    83.3449      
1 1 1 -8  6  14 o 0 169.1   8.6   ?     ?   336.338   -120.552     193.376    -120.552     125.208    59.4483      
1 1 1 -8  6  13 o 0 538     12.9  ?     ?   406.605   -170.472     582.805    -170.472     200.597    -170.472     
1 1 1 -8  6  12 o 0 1236.1  25    ?     ?   717.753   -25.6123     846.812    -25.6123     167.728    -25.6123     
1 1 1 -8  6  11 o 0 795.2   24.8  ?     ?   756.063   -136.461     498.797    -136.461     230.358    43.5389      
1 1 1 -8  6  10 o 0 1268.2  33.6  ?     ?   917.113   -89.7575     682.504    -89.7575     206.895    90.2425      
1 1 1 -8  6  9  o 0 2092.6  36.7  ?     ?   1044.05   45.5685      1089.06    45.5685      30.4547    45.5685      
1 1 1 -8  6  8  o 0 1404.2  24.6  ?     ?   784.037   -52.3038     957.979    -52.3038     159.399    -52.3038     
1 1 1 -8  6  7  o 0 1281.9  23.1  ?     ?   681.61    -62.9849     982.398    -62.9849     285.381    -62.9849     
1 1 1 -8  6  6  o 0 556.2   10.5  ?     ?   799.207   15.6476      283.642    15.6476      536.401    -164.352     
1 1 1 -8  6  5  o 0 217.8   5.6   ?     ?   344.641   173.979      294.306    173.979      68.4423    -6.02095     
1 1 1 -8  6  4  o 0 1293.6  23.1  ?     ?   761.864   -38.5294     940.093    -38.5294     136.496    -38.5294     
1 1 1 -8  6  3  o 0 296.3   6.9   ?     ?   453.887   -26.3563     321.97     -26.3563     153.343    153.644      
1 1 1 -8  6  2  o 0 1494.7  26.9  ?     ?   728.397   132.297      1115.12    132.297      351.713    132.297      
1 1 1 -8  6  1  o 0 434.7   8.8   ?     ?   521.889   62.0866      438.193    62.0866      108.901    -117.913     
1 1 1 8   6  0  o 0 75.4    3.9   ?     ?   143.235   61.1255      84.9974    61.1255      64.3985    -118.874     
1 1 1 8   6  1  o 0 465.2   10.1  ?     ?   378.27    88.6875      604.231    88.6875      209.085    88.6875      
1 1 1 8   6  2  o 0 176.5   4.3   ?     ?   340.37    145.105      226.437    145.105      129.512    -34.8946     
1 1 1 8   6  3  o 0 2246.3  39.8  ?     ?   1117.54   -151.297     1147.95    -151.297     21.3982    28.7028      
1 1 1 8   6  4  o 0 1304.7  27.7  ?     ?   769.141   -162.134     940.611    -162.134     128.847    -162.134     
1 1 1 8   6  5  o 0 534.5   10.5  ?     ?   530.413   -167.193     525.154    -167.193     21.6848    12.807       
1 1 1 8   6  6  o 0 186.1   5.6   ?     ?   352.93    88.1999      226.904    88.1999      136.438    -91.8001     
1 1 1 8   6  7  o 0 1009.8  20.5  ?     ?   708.508   141.585      767.12     141.585      39.2483    141.585      
1 1 1 8   6  8  o 0 1935.6  35    ?     ?   866.108   133.715      1194.46    133.715      307.146    133.715      
1 1 1 8   6  9  o 0 202.2   6.8   ?     ?   84.0808   106.942      282.937    106.942      197.089    106.942      
1 1 1 8   6  10 o 0 2526.5  45.7  ?     ?   1152.48   160.291      1124.47    160.291      2.15401    -19.7087     
1 1 1 8   6  11 o 0 286.1   8.9   ?     ?   352.199   -78.8034     354.254    -78.8034     11.5219    -78.8034     
1 1 1 8   6  12 o 0 317.2   11.1  ?     ?   426.638   -60.0688     334.634    -60.0688     73.0464    119.931      
1 1 1 8   6  13 o 0 191.2   10.8  ?     ?   278.614   -93.3907     262.784    -93.3907     1.9636     86.6093      
1 1 1 8   6  14 o 0 42.2    9.6   ?     ?   70.2489   72.0974      1.50288    -107.903     68.8258    -107.903     
1 1 1 8   6  15 o 0 412.7   14.3  ?     ?   553.827   35.4425      347.379    35.4425      179.915    -144.558     
1 1 1 8   6  16 o 0 36.9    10.5  ?     ?   168.533   174.055      19.9267    -5.94534     175.946    -5.94534     
1 1 1 8   6  17 o 0 100.4   11.3  ?     ?   368.347   170.902      58.9571    170.902      282.476    -9.09763     
1 1 1 8   6  18 o 0 119.1   13.3  ?     ?   48.4007   17.9148      189.161    17.9148      138.902    17.9148      
1 1 1 8   6  19 o 0 185.6   15.3  ?     ?   258.124   -19.7419     366.295    -19.7419     105.114    -19.7419     
1 1 1 8   6  20 o 0 98.2    16.2  ?     ?   219.09    102.786      222.731    102.786      6.63719    102.786      
1 1 1 8   6  21 o 0 102.9   17.4  ?     ?   184.734   -55.8017     265.47     -55.8017     89.4076    -55.8017     
1 1 1 8   6  22 o 0 -32.4   22.7  ?     ?   78.3213   -63.9265     29.7776    116.073      103.996    116.073      
1 1 1 8   6  23 f 1 -10     20.4  ?     ?   78.072    47.9284      12.888     -132.072     87.1649    -132.072     
1 1 1 8   6  24 o 0 16.9    25.8  ?     ?   112.64    -65.682      53.7551    -65.682      61.6599    114.318      
1 1 1 8   6  25 o 0 -1.8    27.1  ?     ?   116.256   -163.056     18.1836    -163.056     95.709     16.9443      
1 1 1 8   6  26 o 0 -6.2    23.4  ?     ?   45.3241   166.016      24.5142    166.016      17.9269    -13.9844     
1 1 1 8   6  27 < 1 21.1    26.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  8  26 < 0 30.9    20.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  8  25 o 0 16      21    ?     ?   101.478   91.7402      57.1299    91.7402      34.0139    -88.2598     
1 1 1 -8  8  24 o 0 9.5     16.4  ?     ?   90.2531   -121.509     24.6469    -121.509     58.4506    58.4909      
1 1 1 -8  8  23 o 0 16.4    15.1  ?     ?   128.732   -108.424     17.7808    -108.424     108.908    71.5757      
1 1 1 -8  8  22 o 0 15.7    13.5  ?     ?   127.157   -122.168     8.19762    -122.168     117.37     57.8319      
1 1 1 -8  8  21 o 0 322.8   15.4  ?     ?   317.717   178.785      513.112    178.785      221.042    178.785      
1 1 1 -8  8  20 o 0 78.1    13    ?     ?   211.541   -98.1628     176.954    -98.1628     17.0436    81.8372      
1 1 1 -8  8  19 o 0 29.4    9.6   ?     ?   92.3265   162.592      53.7311    162.592      33.9442    -17.4081     
1 1 1 -8  8  18 o 0 85.2    10.3  ?     ?   219.293   -110.089     174.269    -110.089     39.4825    69.9112      
1 1 1 -8  8  17 o 0 549.5   14.6  ?     ?   537.837   -93.9868     558.721    -93.9868     20.4311    -93.9868     
1 1 1 -8  8  16 o 0 1549.3  30.1  ?     ?   702.08    -110.625     1170.43    -110.625     461.842    -110.625     
1 1 1 -8  8  15 o 0 69.8    7.8   ?     ?   185.752   -41.1713     97.228     -41.1713     70.136     138.829      
1 1 1 -8  8  14 o 0 174     8.1   ?     ?   285.013   88.9834      245.331    88.9834      11.1548    -91.0166     
1 1 1 -8  8  13 o 0 13.3    6.4   ?     ?   116.553   46.5024      69.5134    -133.498     175.141    -133.498     
1 1 1 -8  8  12 o 0 527.5   12.6  ?     ?   777.387   -53.8542     260.83     -53.8542     463.416    126.146      
1 1 1 -8  8  11 o 0 282.6   8.6   ?     ?   373.486   -143.497     329.988    -143.497     24.3268    36.5027      
1 1 1 -8  8  10 o 0 1172.9  29.7  ?     ?   855.712   -177.129     668.322    -177.129     126.558    2.87059      
1 1 1 -8  8  9  o 0 253.4   7.5   ?     ?   434.352   -133.883     237.855    -133.883     167.667    46.117       
1 1 1 -8  8  8  o 0 44.5    3.6   ?     ?   173.617   18.2579      12.9698    -161.742     177.948    -161.742     
1 1 1 -8  8  7  o 0 354.7   10.2  ?     ?   550.06    -172.71      266.422    -172.71      258.35     7.29043      
1 1 1 -8  8  6  o 0 190     6.3   ?     ?   398.707   -103.613     172.541    -103.613     209.139    76.3873      
1 1 1 -8  8  5  o 0 348.4   7.5   ?     ?   418.046   147.014      374.562    147.014      26.7706    -32.9862     
1 1 1 -8  8  4  o 0 1185.8  31.4  ?     ?   665.047   77.5364      903.93     77.5364      230.217    77.5364      
1 1 1 -8  8  3  f 1 538.5   14    ?     ?   468.276   102.957      569.261    102.957      97.3321    102.957      
1 1 1 -8  8  2  o 0 69.2    3.9   ?     ?   493.366   -144.011     151.837    35.9886      647.07     35.9886      
1 1 1 -8  8  1  o 0 568     18    ?     ?   380.926   16.7587      678.388    16.7587      295.79     16.7587      
1 1 1 8   8  0  f 1 86.9    3.6   ?     ?   225.886   132.589      96.6706    132.589      130.988    -47.4109     
1 1 1 8   8  1  o 0 1395.7  27.6  ?     ?   854.386   41.8273      870.137    41.8273      12.7369    41.8273      
1 1 1 8   8  2  o 0 421.7   9.9   ?     ?   380.798   -65.0463     523.269    -65.0463     140.977    -65.0463     
1 1 1 8   8  3  f 1 381.5   11    ?     ?   170.254   -87.3439     605.76     -87.3439     433.976    -87.3439     
1 1 1 8   8  4  o 0 739.3   15.2  ?     ?   598.963   -159.226     629.664    -159.226     21.5328    -159.226     
1 1 1 8   8  5  o 0 149.9   5.8   ?     ?   136.346   148.236      225.009    148.236      93.6788    148.236      
1 1 1 8   8  6  o 0 2250    40    ?     ?   984.426   132.33       1138.84    132.33       192.3      132.33       
1 1 1 8   8  7  o 0 879     17    ?     ?   475.307   137.755      813.027    137.755      357.092    137.755      
1 1 1 8   8  8  o 0 1590.1  29.3  ?     ?   1139.75   -116.406     653.307    -116.406     436.779    63.594       
1 1 1 8   8  9  o 0 1291.9  25.9  ?     ?   695.098   131.548      896.745    131.548      242.903    131.548      
1 1 1 8   8  10 o 0 316.8   10.8  ?     ?   241.863   126.059      456.005    126.059      229.426    126.059      
1 1 1 8   8  11 o 0 40.9    8.3   ?     ?   77.4232   -137.329     4.07981    42.6714      77.3366    42.6714      
1 1 1 8   8  12 o 0 681.7   16.3  ?     ?   503.428   97.5787      645.444    97.5787      171.56     97.5787      
1 1 1 8   8  13 o 0 474.9   16.3  ?     ?   372.712   -64.7424     570.752    -64.7424     229.166    -64.7424     
1 1 1 8   8  14 o 0 45.4    9.6   ?     ?   182.179   44.2215      2.8818     44.2215      163.055    -135.779     
1 1 1 8   8  15 o 0 189.4   14.5  ?     ?   382.491   -173.24      211.31     -173.24      137.802    6.75983      
1 1 1 8   8  16 o 0 66.2    10.3  ?     ?   163.456   134.806      136.012    134.806      31.2454    -45.1938     
1 1 1 8   8  17 o 0 142     14.2  ?     ?   175.001   179.669      318.135    179.669      140.416    179.669      
1 1 1 8   8  18 o 0 173.2   14.4  ?     ?   406.595   -153.054     204.005    -153.054     198.458    26.9464      
1 1 1 8   8  19 o 0 337.7   17.3  ?     ?   362.566   -142.974     501.83     -142.974     151.913    -142.974     
1 1 1 8   8  20 o 0 199.9   18.9  ?     ?   398.954   -35.2573     271.944    -35.2573     101.592    144.743      
1 1 1 8   8  21 o 0 69.3    18.9  ?     ?   174.971   -103.113     178.088    -103.113     14.3565    -103.113     
1 1 1 8   8  22 o 0 67.7    26.7  ?     ?   152.546   -174.285     172.991    -174.285     19.5292    -174.285     
1 1 1 8   8  23 o 0 44.8    26.8  ?     ?   251.825   -147.91      15.0148    -147.91      237.661    32.0898      
1 1 1 8   8  24 o 0 107.9   26    ?     ?   183.849   -152.739     272.689    -152.739     99.9664    -152.739     
1 1 1 8   8  25 o 0 7.3     24.7  ?     ?   122.757   -82.4937     43.8518    -82.4937     68.9956    97.5063      
1 1 1 -8  10 24 < 0 19.8    20.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  10 23 o 0 116.7   19.5  ?     ?   214.645   -17.1022     269.239    -17.1022     79.7736    -17.1022     
1 1 1 -8  10 22 o 0 23.1    16.8  ?     ?   149.18    -69.1649     40.2179    -69.1649     94.6906    110.835      
1 1 1 -8  10 21 o 0 7       16.1  ?     ?   136.667   152.844      13.6168    -27.1562     145.642    -27.1562     
1 1 1 -8  10 20 o 0 55.7    15    ?     ?   154.791   -72.1493     152.456    -72.1493     2.50553    -72.1493     
1 1 1 -8  10 19 o 0 352.2   17.4  ?     ?   447.845   -114.421     426.747    -114.421     23.1415    -114.421     
1 1 1 -8  10 18 o 0 186.1   14.8  ?     ?   296.587   -131.074     327.17     -131.074     59.6987    -131.074     
1 1 1 -8  10 17 o 0 58.3    12.2  ?     ?   94.8645   -65.5336     170.448    -65.5336     84.45      -65.5336     
1 1 1 -8  10 16 o 0 128.7   10.5  ?     ?   387.448   -9.4421      140.31     -9.4421      222.971    170.558      
1 1 1 -8  10 15 o 0 64.1    9.2   ?     ?   203.933   141.563      124.679    141.563      71.3557    -38.437      
1 1 1 -8  10 14 o 0 163     9.7   ?     ?   444.596   -167.902     133.877    -167.902     304.41     12.0979      
1 1 1 -8  10 13 o 0 79.6    7.6   ?     ?   102.492   106.29       171.363    106.29       69.6032    106.29       
1 1 1 -8  10 12 o 0 26.2    6.7   ?     ?   209.399   -77.9209     53.7824    102.079      239.14     102.079      
1 1 1 -8  10 11 o 0 713     16.1  ?     ?   580.669   111.089      594.901    111.089      82.2205    111.089      
1 1 1 -8  10 10 o 0 1070    20.8  ?     ?   862.438   159.443      617.171    159.443      148.596    -20.5571     
1 1 1 -8  10 9  o 0 42.1    5.4   ?     ?   142.613   175.498      3.24762    175.498      124.032    -4.50197     
1 1 1 -8  10 8  o 0 31.6    4.6   ?     ?   66.6854   112.948      15.8792    -67.0517     76.9414    -67.0517     
1 1 1 -8  10 7  o 0 233.7   7.7   ?     ?   258.89    151.983      336.606    151.983      98.5773    151.983      
1 1 1 -8  10 6  o 0 405.8   9.6   ?     ?   261.336   -47.8321     551.38     -47.8321     310.247    -47.8321     
1 1 1 -8  10 5  o 0 459.5   11.8  ?     ?   410.813   -103.34      500.095    -103.34      115.293    -103.34      
1 1 1 -8  10 4  o 0 72.3    6.2   ?     ?   259.3     -170.546     28.2389    -170.546     208.85     9.45355      
1 1 1 -8  10 3  o 0 520.1   11.3  ?     ?   635.027   101.299      361.981    101.299      219.79     -78.7012     
1 1 1 -8  10 2  o 0 1181.2  41.8  ?     ?   806.191   -128.297     708.49     -128.297     31.1608    51.7034      
1 1 1 -8  10 1  o 0 1241.2  34.2  ?     ?   833.765   -41.3182     722.315    -41.3182     43.3611    138.682      
1 1 1 8   10 0  o 0 605.6   13.2  ?     ?   647.486   -140.765     430.076    -140.765     165.14     39.2347      
1 1 1 8   10 1  o 0 438.3   11    ?     ?   404.484   -175.062     474.372    -175.062     102.419    -175.062     
1 1 1 8   10 2  o 0 151.7   8     ?     ?   473.19    62.8792      47.1798    62.8792      387.904    -117.121     
1 1 1 8   10 3  o 0 255.3   8     ?     ?   241.109   161.356      368.106    161.356      146.542    161.356      
1 1 1 8   10 4  o 0 687.3   15.4  ?     ?   636.914   119.722      507.631    119.722      77.0228    -60.2781     
1 1 1 8   10 5  o 0 1147.1  24.8  ?     ?   675.434   -139.693     823.3      -139.693     187.564    -139.693     
1 1 1 8   10 6  o 0 556.2   13.8  ?     ?   501.79    129.645      526.66     129.645      60.995     129.645      
1 1 1 8   10 7  o 0 950     22.5  ?     ?   514.051   64.9979      832.329    64.9979      356.545    64.9979      
1 1 1 8   10 8  o 0 1495.9  28    ?     ?   633.448   89.6873      1071.04    89.6873      486.605    89.6873      
1 1 1 8   10 9  o 0 233.6   9.3   ?     ?   260.355   -28.0828     352.397    -28.0828     118.064    -28.0828     
1 1 1 8   10 10 o 0 123.6   8.1   ?     ?   241.102   1.69304      176.358    1.69304      39.7269    -178.307     
1 1 1 8   10 11 o 0 490.8   13.7  ?     ?   500.484   171.437      475.083    171.437      24.7539    171.437      
1 1 1 8   10 12 o 0 51.2    10.1  ?     ?   259.741   -56.9541     7.22376    -56.9541     225.256    123.046      
1 1 1 8   10 13 o 0 352.9   13.1  ?     ?   338.687   -67.5497     522.855    -67.5497     182.556    -67.5497     
1 1 1 8   10 14 o 0 68.7    10.7  ?     ?   192.294   -134.921     126.864    -134.921     65.1349    45.0788      
1 1 1 8   10 15 o 0 210.7   15.3  ?     ?   287.717   -130.38      370.501    -130.38      90.1454    -130.38      
1 1 1 8   10 16 o 0 101.7   14.5  ?     ?   158.503   -147.822     264.823    -147.822     114.051    -147.822     
1 1 1 8   10 17 o 0 117.1   15.5  ?     ?   208.769   29.3541      272.096    29.3541      79.9391    29.3541      
1 1 1 8   10 18 o 0 52      15.2  ?     ?   77.9561   26.1572      145.257    26.1572      73.8184    26.1572      
1 1 1 8   10 19 o 0 118.8   17.1  ?     ?   242.026   -41.1203     245.821    -41.1203     24.0035    -41.1203     
1 1 1 8   10 20 o 0 103.3   18.4  ?     ?   295.363   -70.8817     164.84     -70.8817     126.372    109.118      
1 1 1 8   10 21 o 0 61.8    21.8  ?     ?   204.405   -57.2822     123.178    -57.2822     71.1829    122.718      
1 1 1 8   10 22 o 0 64.5    23.6  ?     ?   193.167   39.744       141.335    39.744       36.7429    -140.256     
1 1 1 8   10 23 o 0 -32     25    ?     ?   37.8173   48.2556      6.58608    48.2556      27.4705    -131.744     
1 1 1 8   10 24 < 0 -3.1    27.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  12 22 < 0 37.9    19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  12 21 o 0 55.2    19.3  ?     ?   161.235   -126.541     142.269    -126.541     3.37037    -126.541     
1 1 1 -8  12 20 o 0 0.5     17.8  ?     ?   42.3609   -114.992     17.0732    -114.992     19.7191    65.008       
1 1 1 -8  12 19 o 0 -19     17.8  ?     ?   56.5407   9.02866      13.59      -170.971     64.9167    -170.971     
1 1 1 -8  12 18 f 1 116.3   17.5  ?     ?   222.123   -39.2718     249.284    -39.2718     37.5337    -39.2718     
1 1 1 -8  12 17 o 0 118.9   14    ?     ?   192.381   128.353      284.071    128.353      101.315    128.353      
1 1 1 -8  12 16 o 0 137.6   11.2  ?     ?   232.026   79.4627      285.104    79.4627      80.2913    79.4627      
1 1 1 -8  12 15 o 0 207.1   11.5  ?     ?   281.12    -28.63       367.49     -28.63       119.476    -28.63       
1 1 1 -8  12 14 o 0 311.3   11.7  ?     ?   279.13    -90.9135     518.82     -90.9135     271.589    -90.9135     
1 1 1 -8  12 13 o 0 639.3   17.3  ?     ?   432.286   -149.995     740.82     -149.995     355.156    -149.995     
1 1 1 -8  12 12 o 0 126.1   10.8  ?     ?   261.323   -150.159     238.187    -150.159     2.52316    29.8413      
1 1 1 -8  12 11 o 0 47.5    7.2   ?     ?   38.7976   -137.541     59.2947    -137.541     22.7222    -137.541     
1 1 1 -8  12 10 o 0 148.2   7     ?     ?   150.666   169.655      349.418    169.655      206.572    169.655      
1 1 1 -8  12 9  o 0 156.7   7.3   ?     ?   226.504   -110.716     302.866    -110.716     83.1496    -110.716     
1 1 1 -8  12 8  f 1 268.9   8.5   ?     ?   259.778   -77.5117     460.287    -77.5117     205.792    -77.5117     
1 1 1 -8  12 7  o 0 391.2   10.6  ?     ?   526.504   119.398      337.88     119.398      118.538    -60.6024     
1 1 1 -8  12 6  o 0 172.9   6.8   ?     ?   214.819   85.7307      288.571    85.7307      101.65     85.7307      
1 1 1 -8  12 5  o 0 421.3   10.6  ?     ?   483.071   177.963      407.026    177.963      14.6695    -2.03671     
1 1 1 -8  12 4  o 0 100.5   5.6   ?     ?   409.631   -122.34      24.9185    -122.34      333.644    57.6602      
1 1 1 -8  12 3  o 0 908.2   19.5  ?     ?   521.534   -36.5416     778.112    -36.5416     324.551    -36.5416     
1 1 1 -8  12 2  o 0 268.3   9.5   ?     ?   343.359   47.7782      334.846    47.7782      35.7171    47.7782      
1 1 1 -8  12 1  o 0 437.5   12.4  ?     ?   201.034   -108.367     608.854    -108.367     433.496    -108.367     
1 1 1 8   12 0  f 1 905.5   19.3  ?     ?   748.167   -95.1074     590.724    -95.1074     67.4237    84.8926      
1 1 1 8   12 1  o 0 325.9   9.7   ?     ?   276.342   106.094      451.647    106.094      209.814    106.094      
1 1 1 8   12 2  o 0 54      5.6   ?     ?   105.189   -92.6946     33.3061    -92.6946     58.6996    87.3054      
1 1 1 8   12 3  o 0 69.2    6.1   ?     ?   373.176   178.566      29.6643    -1.43445     355.753    -1.43445     
1 1 1 8   12 4  o 0 218.4   7.9   ?     ?   295.327   95.5561      312        95.5561      52.0538    95.5561      
1 1 1 8   12 5  o 0 565.8   13.8  ?     ?   595.323   108.129      454.202    108.129      68.7894    -71.8713     
1 1 1 8   12 6  o 0 533.1   13.1  ?     ?   879.923   108.196      182.38     108.196      588.758    -71.8044     
1 1 1 8   12 7  o 0 67.7    8.5   ?     ?   170.402   47.4664      92.5263    47.4664      56.3727    -132.534     
1 1 1 8   12 8  f 1 24.1    7.6   ?     ?   150.623   21.9031      18.4085    -158.097     167.268    -158.097     
1 1 1 8   12 9  o 0 48.5    10    ?     ?   236.294   82.3368      33.4102    82.3368      198.008    -97.6632     
1 1 1 8   12 10 o 0 198.5   10.5  ?     ?   233.39    90.258       389.111    90.258       165.524    90.258       
1 1 1 8   12 11 o 0 105.3   10.7  ?     ?   142.88    118.444      263.029    118.444      126.826    118.444      
1 1 1 8   12 12 o 0 108.7   11.2  ?     ?   149.33    -138.804     281.852    -138.804     142.641    -138.804     
1 1 1 8   12 13 o 0 296.6   14.3  ?     ?   322.775   39.307       473.543    39.307       181.868    39.307       
1 1 1 8   12 14 o 0 132.8   15.4  ?     ?   142.983   131.127      339.361    131.127      210.983    131.127      
1 1 1 8   12 15 o 0 22.1    14.5  ?     ?   99.1113   6.9165       32.0746    6.9165       56.6327    -173.083     
1 1 1 8   12 16 o 0 20.2    16.9  ?     ?   185.829   163.544      5.98602    -16.4556     172.531    -16.4556     
1 1 1 8   12 17 o 0 15.9    21.8  ?     ?   62.5444   145.122      38.6875    145.122      21.6849    -34.8778     
1 1 1 8   12 18 f 1 122.1   20.6  ?     ?   308.811   32.9786      185.022    32.9786      114.347    -147.021     
1 1 1 8   12 19 o 0 167.7   20.7  ?     ?   301.297   6.10371      286.347    6.10371      7.98931    6.10371      
1 1 1 8   12 20 o 0 136.1   23.2  ?     ?   178.221   46.169       332.382    46.169       174.722    46.169       
1 1 1 8   12 21 o 0 -26.5   23.3  ?     ?   11.6316   -91.9765     5.06312    -91.9765     5.15079    88.0235      
1 1 1 8   12 22 < 0 6.6     26.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  14 19 < 0 18.8    19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  14 18 o 0 2.5     20.4  ?     ?   105.371   -178.086     28.8583    -178.086     59.5708    1.91373      
1 1 1 -8  14 17 o 0 116.1   18.3  ?     ?   234.868   -127.377     242.622    -127.377     44.1315    -127.377     
1 1 1 -8  14 16 o 0 44.6    15.2  ?     ?   140.742   -119.855     121.519    -119.855     0.0596103  60.1445      
1 1 1 -8  14 15 o 0 148.1   14.8  ?     ?   194.5     48.7946      336.13     48.7946      163.102    48.7946      
1 1 1 -8  14 14 f 1 145.4   14.8  ?     ?   252.453   6.60329      277.894    6.60329      42.4487    6.60329      
1 1 1 -8  14 13 o 0 621.1   22.5  ?     ?   446.795   -27.7524     687.627    -27.7524     273.106    -27.7524     
1 1 1 -8  14 12 f 1 59.9    10.8  ?     ?   47.2537   -137.299     162.645    -137.299     118.274    -137.299     
1 1 1 -8  14 11 o 0 79.3    9.6   ?     ?   239.952   -110.403     151.016    -110.403     56.8069    69.5971      
1 1 1 -8  14 10 o 0 22.4    8.1   ?     ?   184.272   -82.334      0.400337   97.666       159.551    97.666       
1 1 1 -8  14 9  o 0 69.5    8.5   ?     ?   226.17    -137.4       136.812    -137.4       59.5882    42.5997      
1 1 1 -8  14 8  o 0 592.5   15.5  ?     ?   398.971   -125.982     708.093    -125.982     361.231    -125.982     
1 1 1 -8  14 7  o 0 42.6    7.2   ?     ?   94.3048   167.805      115.671    167.805      33.3187    167.805      
1 1 1 -8  14 6  o 0 73      7     ?     ?   157.844   70.6837      183.514    70.6837      41.5968    70.6837      
1 1 1 -8  14 5  o 0 137.2   7.3   ?     ?   140.696   -25.213      336.163    -25.213      209.225    -25.213      
1 1 1 -8  14 4  o 0 164.2   8.4   ?     ?   361.064   -131.392     224.312    -131.392     102.413    48.608       
1 1 1 -8  14 3  o 0 166.7   7.9   ?     ?   215.889   108.758      345.638    108.758      149.795    108.758      
1 1 1 -8  14 2  o 0 52.8    6.8   ?     ?   229.334   10.4071      80.9464    10.4071      127.512    -169.593     
1 1 1 -8  14 1  o 0 92.6    8.1   ?     ?   89.5417   5.57595      247.913    5.57595      166.396    5.57595      
1 1 1 8   14 0  o 0 169.1   9.5   ?     ?   288.287   177.815      296.206    177.815      32.3497    177.815      
1 1 1 8   14 1  o 0 53.6    7.3   ?     ?   17.565    -15.3926     43.7188    -15.3926     27.6489    -15.3926     
1 1 1 8   14 2  o 0 42      7     ?     ?   229.144   133.894      45.3609    133.894      164.101    -46.1061     
1 1 1 8   14 3  o 0 68.7    7.2   ?     ?   204.526   79.4343      145.72     79.4343      40.994     -100.566     
1 1 1 8   14 4  o 0 286.8   10.5  ?     ?   299.592   -127.584     463.151    -127.584     190.133    -127.584     
1 1 1 8   14 5  o 0 293     10.8  ?     ?   288.486   176.498      479.291    176.498      216.983    176.498      
1 1 1 8   14 6  o 0 145     9.8   ?     ?   327.258   136.83       227.706    136.83       61.6585    -43.1699     
1 1 1 8   14 7  o 0 35.9    8.1   ?     ?   201.921   -165.19      49.5825    -165.19      128.387    14.8096      
1 1 1 8   14 8  o 0 109.3   10.7  ?     ?   138.403   80.3888      287.88     80.3888      166.344    80.3888      
1 1 1 8   14 9  o 0 94.6    11    ?     ?   305.687   108.041      137.945    108.041      130.376    -71.9592     
1 1 1 8   14 10 o 0 18.9    11.7  ?     ?   63.6716   122.755      18.7641    122.755      36.8642    -57.2448     
1 1 1 8   14 11 o 0 99.1    11.9  ?     ?   277.16    91.8716      169.119    91.8716      73.8925    -88.1284     
1 1 1 8   14 12 f 1 110.4   13.5  ?     ?   292.272   69.8572      180.125    69.8572      97.9108    -110.143     
1 1 1 8   14 13 o 0 2.9     16.2  ?     ?   24.4171   64.8503      1.76715    64.8503      21.2005    -115.15      
1 1 1 8   14 14 f 1 -4.8    15.9  ?     ?   152.333   97.2028      50.9282    -82.7972     195.079    -82.7972     
1 1 1 8   14 15 o 0 114.1   19.5  ?     ?   207.233   -9.06232     257.669    -9.06232     70.47      -9.06232     
1 1 1 8   14 16 o 0 59      20.8  ?     ?   194.715   -76.1568     121.257    -76.1568     49.6705    103.843      
1 1 1 8   14 17 o 0 -27.1   25.2  ?     ?   61.5925   -127.229     10.1114    -127.229     42.825     52.7707      
1 1 1 8   14 18 < 0 -7.5    28.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 8   14 19 < 0 80.2    25.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  16 14 < 0 27.1    14.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  16 13 o 0 25.9    12.9  ?     ?   90.3456   117.357      87.7472    117.357      13.5639    117.357      
1 1 1 -8  16 12 o 0 -0.5    10.9  ?     ?   82.8491   -4.36975     10.9689    175.63       79.3254    175.63       
1 1 1 -8  16 11 o 0 116.6   16.5  ?     ?   171.535   122.733      287.727    122.733      145.263    122.733      
1 1 1 -8  16 10 f 1 45      13.2  ?     ?   67.351    132.942      148.086    132.942      90.771     132.942      
1 1 1 -8  16 9  o 0 39.5    11.8  ?     ?   188.447   -174.274     72.8963    -174.274     90.9649    5.72566      
1 1 1 -8  16 8  o 0 293.2   14.6  ?     ?   323.341   -178.087     443.646    -178.087     161.044    -178.087     
1 1 1 -8  16 7  o 0 69.3    10.2  ?     ?   150.637   -118.315     190.242    -118.315     53.362     -118.315     
1 1 1 -8  16 6  o 0 135     9.3   ?     ?   279.17    -60.0981     235.668    -60.0981     19.0648    119.902      
1 1 1 -8  16 5  o 0 36.2    8.9   ?     ?   149.59    174.566      90.0091    174.566      46.9904    -5.43362     
1 1 1 -8  16 4  o 0 65.4    9.7   ?     ?   251.95    -142.959     102.5      -142.959     127.261    37.0411      
1 1 1 -8  16 3  o 0 24.7    9.2   ?     ?   140.16    -103.994     39.3306    -103.994     88.8353    76.006       
1 1 1 -8  16 2  o 0 219.8   12.1  ?     ?   276.809   -81.847      381.988    -81.847      128.293    -81.847      
1 1 1 -8  16 1  o 0 221.9   11.6  ?     ?   339.847   -145.945     331.971    -145.945     19.9387    -145.945     
1 1 1 8   16 0  f 1 195.6   11.8  ?     ?   304.522   -133.498     322.787    -133.498     39.7276    -133.498     
1 1 1 8   16 1  o 0 46.5    9.6   ?     ?   162.47    112.211      115.761    112.211      34.3804    -67.789      
1 1 1 8   16 2  o 0 38.8    9.2   ?     ?   131.723   132.637      107.298    132.637      14.2903    -47.3635     
1 1 1 8   16 3  o 0 44.1    10.8  ?     ?   146.422   163.932      116.519    163.932      18.4205    -16.0684     
1 1 1 8   16 4  o 0 196.2   12.9  ?     ?   269.061   165.746      352.96     165.746      105.509    165.746      
1 1 1 8   16 5  o 0 9.1     10.2  ?     ?   68.9715   -155.856     1.55012    -155.856     62.1964    24.1441      
1 1 1 8   16 6  o 0 40.4    11.7  ?     ?   74.4605   114.902      130.493    114.902      61.8796    114.902      
1 1 1 8   16 7  o 0 49.9    12.4  ?     ?   180.408   87.3318      111.856    87.3318      53.8107    -92.6682     
1 1 1 8   16 8  o 0 80.3    15.7  ?     ?   147.079   -58.7895     223.211    -58.7895     93.2114    -58.7895     
1 1 1 8   16 9  o 0 208.5   20.3  ?     ?   296.795   -87.6345     343.05     -87.6345     81.8788    -87.6345     
1 1 1 8   16 10 f 1 84.8    16.7  ?     ?   6.94999   -78.3367     55.5672    -78.3367     49.5776    -78.3367     
1 1 1 8   16 11 o 0 2.8     18.4  ?     ?   87.1865   143.688      21.2512    143.688      52.1324    -36.3115     
1 1 1 8   16 12 o 0 23.2    18.2  ?     ?   112.95    -164.598     71.3232    -164.598     23.4018    15.4025      
1 1 1 8   16 13 o 0 171.4   20.2  ?     ?   305.06    -83.5831     283.397    -83.5831     29.1775    -83.5831     
1 1 1 8   16 14 < 0 54.5    24.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  18 6  < 0 34.3    15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  18 5  < 0 99.7    14.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  18 4  < 0 157.8   15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  18 3  < 0 91.3    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  18 2  < 0 99.8    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -8  18 1  o 0 28.7    13.6  ?     ?   161.798   -31.6379     55.5524    -31.6379     75.2246    148.362      
1 1 1 8   18 0  o 0 2.4     14.4  ?     ?   91.0502   -144.832     14.7794    -144.832     59.4696    35.1681      
1 1 1 8   18 1  o 0 329.1   16.7  ?     ?   322.362   -165.658     481.14     -165.658     218.518    -165.658     
1 1 1 8   18 2  < 0 113.1   14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 8   18 3  < 0 22.5    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 8   18 4  < 0 27.8    15.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 8   18 5  < 0 115.1   18.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 8   18 6  < 0 -4      17.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  1  29 < 0 27.1    20.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  1  28 o 0 0.4     14.3  ?     ?   49.2743   8.11517      19.9397    8.11517      26.2157    -171.885     
1 1 1 -9  1  27 o 0 42.5    22.6  ?     ?   120.769   109.024      127.695    109.024      11.9802    109.024      
1 1 1 -9  1  26 o 0 65.5    16.5  ?     ?   141.445   58.6261      203.772    58.6261      58.8955    58.6261      
1 1 1 -9  1  25 o 0 19.2    13    ?     ?   113.256   -174.054     25.1892    -174.054     87.2449    5.94641      
1 1 1 -9  1  24 o 0 104.2   11.5  ?     ?   99.4359   17.3247      310.088    17.3247      215.748    17.3247      
1 1 1 -9  1  23 o 0 147.6   11.3  ?     ?   229.742   32.5349      333.237    32.5349      113.847    32.5349      
1 1 1 -9  1  22 o 0 264.4   13.4  ?     ?   268.417   115.613      485.349    115.613      215.361    115.613      
1 1 1 -9  1  21 o 0 111.9   10.3  ?     ?   305.597   -173.886     160.654    -173.886     155.179    6.11373      
1 1 1 -9  1  20 f 1 104.2   10.6  ?     ?   314.429   173.543      107.408    173.543      184.517    -6.45735     
1 1 1 -9  1  19 f 1 154.6   9.5   ?     ?   43.2276   116.731      123.459    116.731      83.3269    116.731      
1 1 1 -9  1  18 o 0 643.5   15    ?     ?   593.9     139.581      539.711    139.581      25.1612    -40.4189     
1 1 1 -9  1  17 o 0 317.5   9.8   ?     ?   470.312   -80.2465     308.785    -80.2465     142.062    99.7535      
1 1 1 -9  1  16 o 0 695.8   15.7  ?     ?   555.194   -88.2017     605.995    -88.2017     77.5866    -88.2017     
1 1 1 -9  1  15 o 0 2169.1  38.7  ?     ?   1197.85   -169.654     908.09     -169.654     255.1      10.3458      
1 1 1 -9  1  14 o 0 1961.5  34.7  ?     ?   945.811   -135.876     1052.59    -135.876     128.132    -135.876     
1 1 1 -9  1  13 o 0 371.7   9.5   ?     ?   503.042   -109.602     362.882    -109.602     151.719    70.3982      
1 1 1 -9  1  12 o 0 144.6   4.5   ?     ?   231.434   159.854      231.783    159.854      6.29854    -20.1463     
1 1 1 -9  1  11 o 0 141.4   4.1   ?     ?   237.675   59.8966      223.184    59.8966      22.5711    -120.103     
1 1 1 -9  1  10 o 0 983.8   18    ?     ?   789.274   -105.191     697.005    -105.191     134.457    74.8087      
1 1 1 -9  1  9  o 0 172.7   4.1   ?     ?   388.687   164.967      180.594    164.967      230.539    -15.0325     
1 1 1 -9  1  8  f 1 93.3    2.6   ?     ?   405.128   176.509      10.5531    -3.49061     409.805    -3.49061     
1 1 1 -9  1  6  o 0 1017.8  18.4  ?     ?   560.384   -137.432     856.102    -137.432     325.515    -137.432     
1 1 1 -9  1  5  o 0 2165.7  37.3  ?     ?   932.106   -177.963     1174.25    -177.963     290.517    -177.963     
1 1 1 -9  1  4  o 0 1034.8  18.8  ?     ?   812.739   -126.394     627.765    -126.394     125.878    53.6058      
1 1 1 -9  1  3  o 0 1109.7  19.8  ?     ?   901.591   -14.2694     586.106    -14.2694     233.34     165.731      
1 1 1 -9  1  2  o 0 1652.5  36.4  ?     ?   780.858   96.6604      1005.46    96.6604      296.574    96.6604      
1 1 1 -9  1  1  o 0 2269.8  55.9  ?     ?   1071.15   -129.442     1046.66    -129.442     75.3603    -129.442     
1 1 1 9   1  0  o 0 577.9   11.2  ?     ?   490.436   82.7178      536.855    82.7178      96.0561    82.7178      
1 1 1 9   1  2  o 0 450.8   8.5   ?     ?   527.2     -41.9403     391.875    -41.9403     87.1368    138.06       
1 1 1 9   1  3  o 0 123.1   3.7   ?     ?   162.94    -156.379     181.689    -156.379     30.0283    -156.379     
1 1 1 9   1  4  o 0 1303.6  23.1  ?     ?   938.886   134.32       690.871    134.32       185.406    -45.6805     
1 1 1 9   1  5  o 0 5203.1  88.3  ?     ?   1738.55   -144.035     1575.31    -144.035     86.1905    35.9645      
1 1 1 9   1  6  o 0 2731.3  47.2  ?     ?   1312.42   81.909       1084.09    81.909       169.752    -98.091      
1 1 1 9   1  7  o 0 487.7   9.8   ?     ?   488.515   -39.6045     503.032    -39.6045     17.9933    -39.6045     
1 1 1 9   1  8  f 1 282.5   6.6   ?     ?   552.373   -68.7972     194.667    -68.7972     355.367    111.203      
1 1 1 9   1  9  o 0 467.1   10.9  ?     ?   496.127   -144.122     510.527    -144.122     20.0129    35.878       
1 1 1 9   1  10 o 0 7.9     4.2   ?     ?   142.085   -68.3886     123.768    111.611      276.491    111.611      
1 1 1 9   1  11 o 0 386.2   9.3   ?     ?   492.517   -105.578     399.438    -105.578     115.96     74.4217      
1 1 1 9   1  12 o 0 732.1   15.6  ?     ?   735.621   -89.7056     520.905    -89.7056     245.369    90.2944      
1 1 1 9   1  13 o 0 156.2   8.2   ?     ?   407.958   12.2025      118.012    12.2025      309.905    -167.797     
1 1 1 9   1  14 o 0 486.6   13.9  ?     ?   493.958   119.594      475.357    119.594      14.0606    -60.4059     
1 1 1 9   1  15 o 0 106.6   10.3  ?     ?   147.276   90.9136      139.409    90.9136      3.75726    -89.0864     
1 1 1 9   1  16 o 0 59.7    12.8  ?     ?   426.054   68.7469      122.238    -111.253     533.77     -111.253     
1 1 1 9   1  17 o 0 1003.8  32    ?     ?   676.551   41.6216      767.283    41.6216      108.678    41.6216      
1 1 1 9   1  18 o 0 22.5    12    ?     ?   184.095   137.555      81.3482    -42.4451     255.566    -42.4451     
1 1 1 9   1  19 f 1 101.9   13    ?     ?   189.082   -139.665     153.718    -139.665     24.7765    40.3346      
1 1 1 9   1  20 f 1 8.9     10.5  ?     ?   190.285   -156.695     118.464    23.3054      298.223    23.3054      
1 1 1 9   1  21 o 0 4.6     12.8  ?     ?   128.759   -152.045     78.3951    27.9552      213.89     27.9552      
1 1 1 9   1  22 o 0 75.2    18.2  ?     ?   290.451   -115.681     102.452    -115.681     190.264    64.3189      
1 1 1 9   1  23 o 0 24.6    17.1  ?     ?   143.997   -51.8582     31.9789    -51.8582     108.241    128.142      
1 1 1 9   1  24 o 0 81.3    27.7  ?     ?   221.569   -107.943     163.924    -107.943     50.5961    72.0566      
1 1 1 9   1  25 o 0 -30.4   22.8  ?     ?   28.0302   -142.887     6.34635    37.1134      35.7725    37.1134      
1 1 1 9   1  26 o 0 -26.4   21.5  ?     ?   114.484   104.376      37.6889    -75.6241     157.546    -75.6241     
1 1 1 9   1  27 o 0 15.7    22.3  ?     ?   131.338   164.423      40.8899    164.423      87.8458    -15.5771     
1 1 1 9   1  28 o 0 205.6   31.3  ?     ?   277.141   -165.587     393.972    -165.587     128.171    -165.587     
1 1 1 -9  3  28 o 0 -7.1    18.8  ?     ?   2.24532   -56.3401     1.43366    -56.3401     0.643745   123.66       
1 1 1 -9  3  27 f 1 20.2    16.9  ?     ?   78.4169   43.7454      59.3048    43.7454      15.3156    -136.255     
1 1 1 -9  3  26 o 0 -20.1   18.5  ?     ?   50.448    -158.837     11.7674    21.1633      61.1205    21.1633      
1 1 1 -9  3  25 o 0 255.7   16.8  ?     ?   281.029   164.256      474.731    164.256      189.111    164.256      
1 1 1 -9  3  24 o 0 30.4    11.9  ?     ?   62.1734   -135.207     70.4919    -135.207     11.638     -135.207     
1 1 1 -9  3  23 o 0 46.2    11.9  ?     ?   163.936   -86.7691     115.705    -86.7691     39.1887    93.2309      
1 1 1 -9  3  22 o 0 -1      11.3  ?     ?   158.875   -67.8596     89.3123    112.14       244.842    112.14       
1 1 1 -9  3  21 f 1 35      12    ?     ?   137.972   -24.0971     52.6609    -24.0971     86.7731    155.903      
1 1 1 -9  3  20 o 0 436.9   15.3  ?     ?   362.902   -141.748     619.661    -141.748     244.778    -141.748     
1 1 1 -9  3  19 o 0 101.2   9.7   ?     ?   323.49    114.367      95.4923    114.367      203.162    -65.6332     
1 1 1 -9  3  18 o 0 609.3   15.6  ?     ?   494.577   50.5945      605.41     50.5945      148.833    50.5945      
1 1 1 -9  3  17 o 0 206.8   9.2   ?     ?   400.662   161.615      207.835    161.615      173.04     -18.385      
1 1 1 -9  3  16 o 0 241.5   9.7   ?     ?   322.723   122.161      317.578    122.161      4.63415    122.161      
1 1 1 -9  3  15 o 0 119.1   6.9   ?     ?   235.693   -65.3354     151.464    -65.3354     72.7404    114.665      
1 1 1 -9  3  14 o 0 588     12.8  ?     ?   544.334   -90.4253     519.262    -90.4253     9.05851    89.5747      
1 1 1 -9  3  13 o 0 2065    38.8  ?     ?   1217.43   166.821      843.821    166.821      345.595    -13.179      
1 1 1 -9  3  12 o 0 415.3   9     ?     ?   397.685   -73.0651     510.885    -73.0651     104.21     -73.0651     
1 1 1 -9  3  11 o 0 252.8   6.2   ?     ?   599.342   158.064      110.481    158.064      505.922    -21.9364     
1 1 1 -9  3  10 o 0 1102.1  21.7  ?     ?   703.172   -80.0973     845.888    -80.0973     118.882    -80.0973     
1 1 1 -9  3  9  o 0 549.4   10.8  ?     ?   568.913   22.8301      519.344    22.8301      85.2557    -157.17      
1 1 1 -9  3  8  o 0 722.6   15    ?     ?   582.238   -19.0896     684.416    -19.0896     68.3452    -19.0896     
1 1 1 -9  3  7  o 0 167     4.2   ?     ?   352.635   -29.7592     201.427    -29.7592     173.121    150.241      
1 1 1 -9  3  5  o 0 327.3   6.6   ?     ?   395.329   158.332      394.511    158.332      4.36913    158.332      
1 1 1 -9  3  3  o 0 3437.8  83.3  ?     ?   1378.97   -108.321     1300.67    -108.321     11.1015    71.679       
1 1 1 -9  3  2  o 0 126.8   3.7   ?     ?   304.978   123.542      138.697    123.542      151.549    -56.4578     
1 1 1 -9  3  1  o 0 10987.4 313.5 ?     ?   1587.63   12.5609      3084.63    12.5609      1607.87    12.5609      
1 1 1 9   3  0  o 0 936.2   23.4  ?     ?   603.172   22.6153      737.859    22.6153      183.271    22.6153      
1 1 1 9   3  1  o 0 5819.9  192.7 ?     ?   1831.23   139.184      1606.72    139.184      82.7875    -40.8162     
1 1 1 9   3  3  o 0 130     3.2   ?     ?   316.822   61.692       136.791    61.692       163.933    -118.308     
1 1 1 9   3  4  o 0 770.5   14.3  ?     ?   782.869   124.569      473.132    124.569      271.038    -55.4314     
1 1 1 9   3  5  o 0 752.5   13.7  ?     ?   868.468   156.48       395.45     156.48       463.98     -23.5204     
1 1 1 9   3  6  o 0 247.9   5.3   ?     ?   360.036   146.618      314.31     146.618      41.721     -33.3824     
1 1 1 9   3  7  o 0 262.7   6.2   ?     ?   250.692   179.395      446.787    179.395      178.849    179.395      
1 1 1 9   3  8  o 0 147.1   4.3   ?     ?   178.508   -79.6016     261.881    -79.6016     71.5605    -79.6016     
1 1 1 9   3  9  o 0 96.6    4.8   ?     ?   202.57    -155.366     139.285    -155.366     77.8858    24.6343      
1 1 1 9   3  10 o 0 103.6   4.5   ?     ?   204.036   -102.362     152.885    -102.362     60.1428    77.6384      
1 1 1 9   3  11 o 0 637     12.7  ?     ?   575.515   -55.2063     589.21     -55.2063     9.0739     124.794      
1 1 1 9   3  12 o 0 723.9   15.7  ?     ?   680.281   119.517      564.731    119.517      139.047    -60.4826     
1 1 1 9   3  13 o 0 522.9   12.6  ?     ?   324.973   46.1958      654.47     46.1958      333.005    46.1958      
1 1 1 9   3  14 o 0 929.7   29.6  ?     ?   445.766   -5.64584     897.342    -5.64584     458.931    -5.64584     
1 1 1 9   3  15 o 0 1373.8  28.7  ?     ?   980.369   44.2003      704.59     44.2003      241.132    -135.8       
1 1 1 9   3  16 o 0 1375.1  29.8  ?     ?   596.676   157.582      1088.78    157.582      508.607    157.582      
1 1 1 9   3  17 o 0 418     14.7  ?     ?   340.517   164.564      536.606    164.564      207.845    164.564      
1 1 1 9   3  18 o 0 427.4   16.3  ?     ?   177.93    173.438      649.879    173.438      482.927    173.438      
1 1 1 9   3  19 o 0 18.8    13.3  ?     ?   162.084   75.7287      64.7934    -104.271     217.003    -104.271     
1 1 1 9   3  20 o 0 -7.2    13.9  ?     ?   80.197    -148.61      57.7404    31.3904      142.072    31.3904      
1 1 1 9   3  21 f 1 57.2    14.9  ?     ?   124.048   55.4071      145.373    55.4071      17.6617    55.4071      
1 1 1 9   3  22 o 0 -17.6   17.8  ?     ?   95.0053   96.3409      48.6813    -83.6591     143.504    -83.6591     
1 1 1 9   3  23 o 0 161.1   18.6  ?     ?   257.857   172.676      336.056    172.676      87.4597    172.676      
1 1 1 9   3  24 o 0 32.7    20.3  ?     ?   138.355   114.253      72.1033    114.253      61.6417    -65.7469     
1 1 1 9   3  25 o 0 51.6    20.2  ?     ?   243.273   84.1924      59.1473    84.1924      193.554    -95.8076     
1 1 1 9   3  26 o 0 167.6   27.5  ?     ?   147.157   85.4721      442.136    85.4721      294.871    85.4721      
1 1 1 9   3  27 f 1 37.2    25.3  ?     ?   179.971   -146.373     70.1665    -146.373     102.888    33.6273      
1 1 1 9   3  28 < 0 5.4     21.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  5  28 < 0 76.2    26.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  5  27 o 0 14.9    20.8  ?     ?   92.3135   84.3347      65.715     84.3347      18.9974    -95.6653     
1 1 1 -9  5  26 o 0 24.6    18.5  ?     ?   89.5336   92.887       75.6645    92.887       8.40326    -87.113      
1 1 1 -9  5  25 o 0 109.6   15.5  ?     ?   256.969   90.3451      219.301    90.3451      38.7024    -89.6549     
1 1 1 -9  5  24 o 0 -11.4   14.1  ?     ?   57.3074   21.0878      23.5415    -158.912     81.301     -158.912     
1 1 1 -9  5  23 o 0 81.5    13.4  ?     ?   174.493   -46.6395     214.439    -46.6395     52.068     -46.6395     
1 1 1 -9  5  22 o 0 10.7    12.1  ?     ?   45.2564   25.3968      1.6283     -154.603     44.0276    -154.603     
1 1 1 -9  5  21 o 0 15.5    9.3   ?     ?   59.792    -43.3173     0.52301    136.683      58.5571    136.683      
1 1 1 -9  5  20 o 0 636.7   17.4  ?     ?   450.841   -115.778     750.49     -115.778     301.1      -115.778     
1 1 1 -9  5  19 o 0 324.7   12.2  ?     ?   293.568   -106.699     535.395    -106.699     234.768    -106.699     
1 1 1 -9  5  18 o 0 13.6    8.1   ?     ?   163.459   -157.609     86.9833    22.3913      236.569    22.3913      
1 1 1 -9  5  17 o 0 905.1   20.4  ?     ?   423.129   122.143      897.596    122.143      510.441    122.143      
1 1 1 -9  5  16 o 0 455.7   12    ?     ?   330.664   89.3661      571.366    89.3661      259.85     89.3661      
1 1 1 -9  5  15 o 0 309.4   10.6  ?     ?   243.46    110.15       460.709    110.15       229.566    110.15       
1 1 1 -9  5  14 o 0 119     9.8   ?     ?   114.546   50.2976      146.257    50.2976      38.2955    50.2976      
1 1 1 -9  5  13 o 0 305     9.8   ?     ?   519.883   101.167      238.51     101.167      254.873    -78.833      
1 1 1 -9  5  12 o 0 192.7   10    ?     ?   458.966   175.211      128.171    175.211      316        -4.78933     
1 1 1 -9  5  11 o 0 1061.4  22.5  ?     ?   622.452   -142.714     824.702    -142.714     218.695    -142.714     
1 1 1 -9  5  10 o 0 1220.8  22.1  ?     ?   797.485   101.614      824.05     101.614      11.8881    101.614      
1 1 1 -9  5  9  o 0 1621.2  33.8  ?     ?   954.8     51.4697      926.285    51.4697      51.0028    -128.53      
1 1 1 -9  5  8  f 1 1051.8  19.5  ?     ?   771.65    -52.4007     732.978    -52.4007     64.5133    127.599      
1 1 1 -9  5  7  o 0 645.2   13.4  ?     ?   308.028   -44.7061     852.871    -44.7061     527.587    -44.7061     
1 1 1 -9  5  6  o 0 173.9   3.9   ?     ?   339.248   179.575      223.463    179.575      132.908    -0.424627    
1 1 1 -9  5  5  o 0 732.8   15.9  ?     ?   602.439   -67.5255     670.841    -67.5255     36.2262    -67.5255     
1 1 1 -9  5  4  o 0 314.3   6.3   ?     ?   320.013   -25.0459     467.993    -25.0459     130.17     -25.0459     
1 1 1 -9  5  3  o 0 462.2   8.9   ?     ?   396.491   20.8984      591.866    20.8984      172.703    20.8984      
1 1 1 -9  5  1  o 0 911.6   17    ?     ?   579.617   76.3386      787.346    76.3386      220.837    76.3386      
1 1 1 9   5  0  o 0 143.1   3.4   ?     ?   258.715   -9.34163     202.981    -9.34163     48.0331    170.658      
1 1 1 9   5  1  o 0 262.1   5.8   ?     ?   431.102   104.559      271.284    104.559      147.835    -75.4409     
1 1 1 9   5  2  o 0 161.9   3.9   ?     ?   344.953   -130.145     181.326    -130.145     154.591    49.8547      
1 1 1 9   5  3  o 0 939.3   17.2  ?     ?   661.485   140.718      791.578    140.718      93.4506    140.718      
1 1 1 9   5  4  o 0 110.3   3.3   ?     ?   347.352   115.862      82.3472    115.862      284.393    -64.1381     
1 1 1 9   5  5  o 0 642     12.6  ?     ?   462.049   8.05496      721.847    8.05496      234.179    8.05496      
1 1 1 9   5  6  o 0 677.7   18.4  ?     ?   630.806   89.7777      591.522    89.7777      73.5125    -90.2223     
1 1 1 9   5  7  o 0 960.9   17.7  ?     ?   589.362   150.294      854.097    150.294      242.559    150.294      
1 1 1 9   5  8  f 1 24.4    3.4   ?     ?   144.939   9.64458      63.671     -170.355     214.447    -170.355     
1 1 1 9   5  9  o 0 224.4   8.1   ?     ?   207.172   137.877      389.329    137.877      175.61     137.877      
1 1 1 9   5  10 o 0 180.3   6.6   ?     ?   420.455   135.959      158.088    135.959      273.986    -44.0408     
1 1 1 9   5  11 o 0 452.6   14.1  ?     ?   549.39    -5.41651     386.247    -5.41651     154.073    174.583      
1 1 1 9   5  12 o 0 210.7   8.1   ?     ?   514.688   177.667      109.423    177.667      394.264    -2.33296     
1 1 1 9   5  13 o 0 87.3    8.3   ?     ?   194.03    84.5805      92.9558    84.5805      93.4324    -95.4195     
1 1 1 9   5  14 o 0 934.4   25.3  ?     ?   563.833   -106.574     787.477    -106.574     249.06     -106.574     
1 1 1 9   5  15 o 0 607.4   16.4  ?     ?   611.625   -154.771     497.425    -154.771     91.4272    25.2293      
1 1 1 9   5  16 o 0 402.5   14.1  ?     ?   369.736   -164.135     491.821    -164.135     138.284    -164.135     
1 1 1 9   5  17 o 0 234.6   13.1  ?     ?   480.192   77.9367      199.556    77.9367      246.767    -102.063     
1 1 1 9   5  18 o 0 125.5   12.6  ?     ?   257.044   95.8567      194.538    95.8567      44.6173    -84.1433     
1 1 1 9   5  19 o 0 191.9   14.3  ?     ?   255.605   -128.581     368.189    -128.581     101.844    -128.581     
1 1 1 9   5  20 o 0 24.1    14.4  ?     ?   40.4139   129.012      11.7038    129.012      29.3214    -50.9882     
1 1 1 9   5  21 o 0 156.1   17    ?     ?   136.281   -104.419     405.954    -104.419     271.131    -104.419     
1 1 1 9   5  22 o 0 272.1   21.4  ?     ?   380.572   -117.271     410.745    -117.271     47.0218    -117.271     
1 1 1 9   5  23 o 0 168.2   21.5  ?     ?   349.448   -84.1312     261.061    -84.1312     73.8482    95.8688      
1 1 1 9   5  24 o 0 64.8    25.9  ?     ?   116.006   -20.9542     191.692    -20.9542     72.212     -20.9542     
1 1 1 9   5  25 o 0 46.1    25.7  ?     ?   141.143   -146.719     118.282    -146.719     21.7784    33.2815      
1 1 1 9   5  26 o 0 39.3    26.3  ?     ?   126.468   -113.618     110.525    -113.618     11.0365    66.3822      
1 1 1 9   5  27 o 0 51.5    30.7  ?     ?   129.009   -154.65      144.53     -154.65      23.2271    -154.65      
1 1 1 -9  7  27 < 0 -3.1    24.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  7  26 o 0 -16.5   18.7  ?     ?   45.2859   -66.3616     10.172     -66.3616     30.7114    113.638      
1 1 1 -9  7  25 o 0 13.7    16.2  ?     ?   22.3297   -37.7091     17.9655    -37.7091     2.65941    142.291      
1 1 1 -9  7  24 o 0 0.6     21.7  ?     ?   26.4832   130.291      10.4519    130.291      14.8216    -49.7092     
1 1 1 -9  7  23 o 0 227.2   16.9  ?     ?   252.759   128.226      444.338    128.226      193.787    128.226      
1 1 1 -9  7  22 o 0 157.8   14.2  ?     ?   304.639   124.252      275.327    124.252      5.88025    -55.748      
1 1 1 -9  7  21 o 0 270.7   14.1  ?     ?   349.611   163.812      422.717    163.812      99.449     163.812      
1 1 1 -9  7  20 o 0 85.3    11.4  ?     ?   169.638   108.188      219.611    108.188      57.7411    108.188      
1 1 1 -9  7  19 o 0 407.3   13.3  ?     ?   381.919   161.957      560.571    161.957      186.373    161.957      
1 1 1 -9  7  18 o 0 378.4   13.8  ?     ?   371.455   -45.7852     526.129    -45.7852     152.295    -45.7852     
1 1 1 -9  7  17 f 1 64.5    9.5   ?     ?   84.2551   -113.684     75.6391    -113.684     0.511679   66.3159      
1 1 1 -9  7  16 o 0 23.3    7.2   ?     ?   219.158   147.023      72.7551    -32.9773     271.471    -32.9773     
1 1 1 -9  7  15 f 1 275     10.3  ?     ?   257.595   65.4104      413.048    65.4104      178.468    65.4104      
1 1 1 -9  7  14 o 0 21      7.2   ?     ?   65.8417   113.354      32.0644    -66.6463     93.443     -66.6463     
1 1 1 -9  7  13 o 0 881     18.2  ?     ?   753.387   129.92       583.074    129.92       124.194    -50.0801     
1 1 1 -9  7  12 o 0 231.6   8.6   ?     ?   414.655   52.986       222.252    52.986       163.905    -127.014     
1 1 1 -9  7  11 o 0 482.9   11.6  ?     ?   668.23    -172.438     304.41     -172.438     321.691    7.56219      
1 1 1 -9  7  10 f 1 21.5    4.9   ?     ?   245.153   -52.3203     130.207    127.68       365.443    127.68       
1 1 1 -9  7  9  f 1 129.7   6.5   ?     ?   322.642   62.7588      122.637    62.7588      188.53     -117.241     
1 1 1 -9  7  8  o 0 326     7.3   ?     ?   538.872   170.346      244.476    170.346      274.931    -9.65364     
1 1 1 -9  7  7  o 0 1312.3  25.3  ?     ?   737.477   130.689      923.262    130.689      171.874    130.689      
1 1 1 -9  7  6  o 0 1790.5  37.2  ?     ?   876.199   62.3532      1088.33    62.3532      203.229    62.3532      
1 1 1 -9  7  5  o 0 307.7   7.9   ?     ?   331.575   101.074      426.331    101.074      90.4358    101.074      
1 1 1 -9  7  4  f 1 2216.2  38.5  ?     ?   852.727   8.23012      1338.76    8.23012      468.539    8.23012      
1 1 1 -9  7  3  o 0 872.6   17.6  ?     ?   815.71    -6.42941     548.103    -6.42941     281.441    173.571      
1 1 1 -9  7  2  o 0 735     14    ?     ?   550.216   167.577      690.074    167.577      129.938    167.577      
1 1 1 -9  7  1  o 0 2133.7  38.5  ?     ?   1095.16   46.8848      1063.85    46.8848      51.6154    -133.115     
1 1 1 9   7  0  o 0 335.2   13.2  ?     ?   356.114   63.9613      443.616    63.9613      82.1339    63.9613      
1 1 1 9   7  1  o 0 365.5   11.1  ?     ?   550.651   119.971      308.285    119.971      251.326    -60.0292     
1 1 1 9   7  2  o 0 353.1   7.6   ?     ?   250.802   -81.2704     546.006    -81.2704     290.931    -81.2704     
1 1 1 9   7  3  o 0 771     15.7  ?     ?   504.423   -153.481     763.634    -153.481     250.481    -153.481     
1 1 1 9   7  4  f 1 356.3   7.8   ?     ?   438.249   -94.5507     398.615    -94.5507     49.38      85.4493      
1 1 1 9   7  5  o 0 249.3   5.9   ?     ?   319.124   58.5527      353.67     58.5527      29.4069    58.5527      
1 1 1 9   7  6  o 0 494.1   11.1  ?     ?   608.533   79.0429      400.768    79.0429      216.631    -100.957     
1 1 1 9   7  7  o 0 1651.4  29.6  ?     ?   622.467   145.521      1249.43    145.521      611.635    145.521      
1 1 1 9   7  8  o 0 535.2   13.1  ?     ?   561.688   -67.2703     453.642    -67.2703     91.4934    112.73       
1 1 1 9   7  9  f 1 223.6   7.3   ?     ?   310.771   -65.9585     293.681    -65.9585     8.46597    114.041      
1 1 1 9   7  10 f 1 585.8   13.9  ?     ?   250.359   124.895      747.03     124.895      504.576    124.895      
1 1 1 9   7  11 o 0 92.6    7.7   ?     ?   232.625   15.4649      92.6249    15.4649      127.591    -164.535     
1 1 1 9   7  12 o 0 188.5   9.4   ?     ?   306.113   -56.4082     238.938    -56.4082     49.3907    123.592      
1 1 1 9   7  13 o 0 761.3   20.9  ?     ?   645.985   -41.1743     592.96     -41.1743     21.0204    138.826      
1 1 1 9   7  14 o 0 322.8   13.3  ?     ?   614.994   95.549       185.841    95.549       395.159    -84.451      
1 1 1 9   7  15 f 1 350.7   13.4  ?     ?   319.08    122.443      474.284    122.443      179.533    122.443      
1 1 1 9   7  16 o 0 315     14.5  ?     ?   465.769   -165.313     320.713    -165.313     108.083    14.6874      
1 1 1 9   7  17 f 1 238.8   13.2  ?     ?   372.102   -129.115     339.43     -129.115     46.465     50.8849      
1 1 1 9   7  18 o 0 109.3   13.7  ?     ?   71.2744   -29.722      217.165    -29.722      144.204    -29.722      
1 1 1 9   7  19 o 0 200.4   16    ?     ?   220.658   -17.2099     416.703    -17.2099     196.602    -17.2099     
1 1 1 9   7  20 o 0 274.8   17.9  ?     ?   324.551   -10.0744     462.913    -10.0744     155.21     -10.0744     
1 1 1 9   7  21 o 0 89.6    17.6  ?     ?   101.621   -74.8861     266.819    -74.8861     170.989    -74.8861     
1 1 1 9   7  22 o 0 110     20.6  ?     ?   254.498   76.2617      219.467    76.2617      20.3339    -103.738     
1 1 1 9   7  23 o 0 -5.3    17.9  ?     ?   140.859   49.1443      42.3716    -130.856     185.025    -130.856     
1 1 1 9   7  24 o 0 40.8    26.1  ?     ?   99.9083   10.3524      126.218    10.3524      28.7196    10.3524      
1 1 1 9   7  25 o 0 -18.1   30.9  ?     ?   108.212   64.5824      16.5454    64.5824      85.7552    -115.418     
1 1 1 -9  9  25 < 0 -20.4   14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  9  24 o 0 92.4    18    ?     ?   218.211   -0.332835    214.712    -0.332835    20.6522    -0.332835    
1 1 1 -9  9  23 o 0 47.4    17.7  ?     ?   122.152   50.5331      145.144    50.5331      33.8106    50.5331      
1 1 1 -9  9  22 o 0 -23.6   13    ?     ?   113.325   -143.522     67.4116    36.4775      177.786    36.4775      
1 1 1 -9  9  21 o 0 92.8    14.8  ?     ?   216.942   -149.016     210.198    -149.016     1.76211    30.984       
1 1 1 -9  9  20 o 0 20      14.8  ?     ?   208.474   -39.447      24.3481    140.553      213.912    140.553      
1 1 1 -9  9  19 f 1 36.9    11.8  ?     ?   113.43    -45.9973     97.2758    -45.9973     6.50632    134.003      
1 1 1 -9  9  18 o 0 19.6    11    ?     ?   41.9026   -10.3922     15.8967    -10.3922     22.46      169.608      
1 1 1 -9  9  17 o 0 658.9   17.9  ?     ?   526.339   -50.9383     687.448    -50.9383     188.916    -50.9383     
1 1 1 -9  9  16 o 0 1230    26.2  ?     ?   776.608   -31.5913     888.533    -31.5913     134.082    -31.5913     
1 1 1 -9  9  15 o 0 138     9.9   ?     ?   300.924   22.9325      215.145    22.9325      84.7909    -157.067     
1 1 1 -9  9  14 o 0 455.7   12.6  ?     ?   355.946   21.1188      551.237    21.1188      234.634    21.1188      
1 1 1 -9  9  13 o 0 209.9   8.5   ?     ?   317.138   21.9964      289.224    21.9964      5.12585    21.9964      
1 1 1 -9  9  12 o 0 21.1    6     ?     ?   190.327   -0.320869    81.8416    179.679      251.984    179.679      
1 1 1 -9  9  11 f 1 895.9   18.3  ?     ?   844.293   161.546      497.146    161.546      282.406    -18.454      
1 1 1 -9  9  10 o 0 581.9   12.8  ?     ?   696.642   -168.297     380.481    -168.297     263.071    11.7028      
1 1 1 -9  9  9  o 0 230.3   7.7   ?     ?   423.833   -95.8271     220.108    -95.8271     173.439    84.1729      
1 1 1 -9  9  8  o 0 15.5    3.9   ?     ?   189.094   165.767      114.739    -14.233      288.575    -14.233      
1 1 1 -9  9  7  o 0 810.6   18.8  ?     ?   661.408   -164.63      586.561    -164.63      23.9561    15.3695      
1 1 1 -9  9  6  o 0 551.7   11.2  ?     ?   471.584   -176.22      534.707    -176.22      97.8723    -176.22      
1 1 1 -9  9  5  o 0 650.4   18.8  ?     ?   689.512   118.651      429.619    118.651      219.439    -61.3494     
1 1 1 -9  9  4  o 0 482.6   11.8  ?     ?   425.656   179.013      506.141    179.013      104.485    179.013      
1 1 1 -9  9  3  o 0 3814.1  85.9  ?     ?   1254.67   170.401      1492.57    170.401      306.413    170.401      
1 1 1 -9  9  2  o 0 342.1   10.1  ?     ?   613.48    -90.6648     193.647    -90.6648     387.121    89.3352      
1 1 1 -9  9  1  o 0 606.3   15.5  ?     ?   537.157   -80.0965     529.524    -80.0965     20.5793    -80.0965     
1 1 1 9   9  0  o 0 54.3    3.6   ?     ?   112.088   -96.642      22.3651    -96.642      83.8157    83.358       
1 1 1 9   9  1  o 0 221     7.6   ?     ?   312.724   116.42       283.676    116.42       12.7454    -63.5802     
1 1 1 9   9  2  o 0 98.1    4.4   ?     ?   192.263   40.1828      120.934    40.1828      61.3362    -139.817     
1 1 1 9   9  3  o 0 967.7   25.8  ?     ?   939.943   -54.9862     448.795    -54.9862     442.021    125.014      
1 1 1 9   9  4  o 0 2777.4  67.6  ?     ?   1416.05   79.2468      948.438    79.2468      392.513    -100.753     
1 1 1 9   9  5  o 0 440.6   11.4  ?     ?   461.337   56.3279      437.93     56.3279      7.32286    56.3279      
1 1 1 9   9  6  o 0 5.3     5.1   ?     ?   497.079   -154.047     408.065    25.9534      871.163    25.9534      
1 1 1 9   9  7  o 0 183.7   7.1   ?     ?   514.024   90.6881      67.9036    90.6881      409.818    -89.3119     
1 1 1 9   9  8  o 0 636.3   14.2  ?     ?   535.427   -146.738     556.754    -146.738     60.6251    -146.738     
1 1 1 9   9  9  o 0 171.1   8.1   ?     ?   455.999   153.981      102.497    153.981      324.728    -26.0185     
1 1 1 9   9  10 o 0 292.2   9.9   ?     ?   445.312   46.7747      288.901    46.7747      126.61     -133.225     
1 1 1 9   9  11 f 1 899.5   22.7  ?     ?   740.697   168.418      616.004    168.418      61.0685    -11.5816     
1 1 1 9   9  12 o 0 870.8   21.2  ?     ?   695.497   98.0903      634.139    98.0903      4.8833     98.0903      
1 1 1 9   9  13 o 0 531.9   15.6  ?     ?   391.087   -129.392     609.173    -129.392     254.248    -129.392     
1 1 1 9   9  14 o 0 203     11.7  ?     ?   263.647   -140.455     317.802    -140.455     80.0015    -140.455     
1 1 1 9   9  15 o 0 174.6   11.9  ?     ?   108.92    -120.296     391.077    -120.296     280.887    -120.296     
1 1 1 9   9  16 o 0 261.3   14.1  ?     ?   314.663   -48.94       431.7      -48.94       121.14     -48.94       
1 1 1 9   9  17 o 0 27.5    12.8  ?     ?   63.032    -139.716     38.793     -139.716     21.9165    40.2842      
1 1 1 9   9  18 o 0 136.3   16.7  ?     ?   248.856   -88.4885     285.033    -88.4885     53.1812    -88.4885     
1 1 1 9   9  19 f 1 140.7   16.3  ?     ?   309.171   -59.2933     239.337    -59.2933     48.8323    120.707      
1 1 1 9   9  20 o 0 47      19.6  ?     ?   229.343   -70.1458     57.2705    -70.1458     155.364    109.854      
1 1 1 9   9  21 o 0 37.4    24.9  ?     ?   127.664   139.158      93.7491    139.158      33.5472    -40.8418     
1 1 1 9   9  22 o 0 -23.7   24.8  ?     ?   47.8021   41.3533      0.00613978 -138.647     47.5635    -138.647     
1 1 1 9   9  23 o 0 122.9   28.5  ?     ?   218.925   -108.801     272.368    -108.801     68.3626    -108.801     
1 1 1 9   9  24 o 0 11.5    28.3  ?     ?   125.014   -107.57      59.4596    -107.57      54.5675    72.4303      
1 1 1 -9  11 23 < 1 32.5    19    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  11 22 o 0 69.2    16.1  ?     ?   147.796   -155.426     209.637    -155.426     80.7586    -155.426     
1 1 1 -9  11 21 o 0 52      16.4  ?     ?   166.003   167.468      131.846    167.468      16.0832    -12.5323     
1 1 1 -9  11 20 o 0 117.9   17.5  ?     ?   331.175   -70.7911     168.462    -70.7911     136.087    109.209      
1 1 1 -9  11 19 o 0 180.5   15.4  ?     ?   342.19    -65.359      272.214    -65.359      56.6872    114.641      
1 1 1 -9  11 18 o 0 16.3    13.6  ?     ?   63.1099   95.338       19.7949    95.338       38.9087    -84.662      
1 1 1 -9  11 17 o 0 478.8   16.7  ?     ?   470.338   93.5796      547.435    93.5796      129.989    93.5796      
1 1 1 -9  11 16 o 0 150.6   11.6  ?     ?   223.836   49.8584      320.794    49.8584      121.163    49.8584      
1 1 1 -9  11 15 o 0 97.9    10.1  ?     ?   194.947   -113.84      235.8      -113.84      60.5096    -113.84      
1 1 1 -9  11 14 o 0 874     20.9  ?     ?   568.462   -158.19      815.105    -158.19      286.867    -158.19      
1 1 1 -9  11 13 o 0 28.3    8.1   ?     ?   48.3204   156.084      25.5931    156.084      20.4015    -23.9162     
1 1 1 -9  11 12 o 0 93.1    7     ?     ?   233.872   97.1806      163.937    97.1806      64.1637    -82.8194     
1 1 1 -9  11 11 o 0 32.1    6.9   ?     ?   150.676   39.9521      16.5288    39.9521      131.348    -140.048     
1 1 1 -9  11 10 o 0 746.3   16.3  ?     ?   595.281   154.306      599.907    154.306      79.5052    154.306      
1 1 1 -9  11 9  o 0 202.8   7.6   ?     ?   398.367   173.413      212.175    173.413      137.909    -6.58662     
1 1 1 -9  11 8  o 0 25.9    4.9   ?     ?   215.596   53.9872      74.9397    -126.013     263.649    -126.013     
1 1 1 -9  11 7  o 0 488     11.2  ?     ?   506.874   114.47       456.365    114.47       10.8334    114.47       
1 1 1 -9  11 6  o 0 303.9   9.7   ?     ?   368.459   -5.06447     366.251    -5.06447     41.1869    -5.06447     
1 1 1 -9  11 5  o 0 554     12.4  ?     ?   466.338   55.6313      554.062    55.6313      141.34     55.6313      
1 1 1 -9  11 4  o 0 147.5   5.9   ?     ?   346.302   59.3278      140.853    59.3278      172.986    -120.672     
1 1 1 -9  11 3  o 0 1041.8  20.7  ?     ?   381.344   -20.744      984.957    -20.744      638.617    -20.744      
1 1 1 -9  11 2  o 0 862     24.3  ?     ?   578.242   -11.11       701.195    -11.11       175.164    -11.11       
1 1 1 -9  11 1  o 0 1411.4  27.6  ?     ?   758.891   -122.459     900.92     -122.459     209.746    -122.459     
1 1 1 9   11 0  f 1 120.8   5.6   ?     ?   363.253   38.9783      77.9059    38.9783      255.47     -141.022     
1 1 1 9   11 1  o 0 355.1   9.1   ?     ?   566.614   117.226      258.962    117.226      258.47     -62.774      
1 1 1 9   11 2  o 0 459.8   11.3  ?     ?   610.099   128.85       334.507    128.85       222.478    -51.15       
1 1 1 9   11 3  o 0 21.3    5.2   ?     ?   216.258   12.454       108.065    -167.546     305.35     -167.546     
1 1 1 9   11 4  o 0 285.5   8.3   ?     ?   505.869   -10.7947     224.675    -10.7947     236.25     169.205      
1 1 1 9   11 5  o 0 33.3    5.7   ?     ?   285.368   -103.351     85.9436    76.6488      340.105    76.6488      
1 1 1 9   11 6  o 0 870.3   18.4  ?     ?   728       54.8196      595.136    54.8196      51.8178    -125.18      
1 1 1 9   11 7  o 0 9.8     6.3   ?     ?   195.929   -47.6183     129.976    132.382      303.618    132.382      
1 1 1 9   11 8  o 0 459.2   12.5  ?     ?   619.984   7.32073      337.213    7.32073      210.466    -172.679     
1 1 1 9   11 9  o 0 54      8.1   ?     ?   97.8313   -122.372     56.6966    -122.372     30.1543    57.6279      
1 1 1 9   11 10 o 0 314.9   12.2  ?     ?   374.378   -155.994     380.577    -155.994     49.6388    -155.994     
1 1 1 9   11 11 o 0 79      11.1  ?     ?   277.926   174.465      95.9192    174.465      180.148    -5.53465     
1 1 1 9   11 12 o 0 26.6    12.2  ?     ?   92.5092   -15.7976     2.15808    -15.7976     89.2465    164.202      
1 1 1 9   11 13 o 0 -8.9    12.7  ?     ?   86.0514   -44.3963     54.8489    135.604      137.905    135.604      
1 1 1 9   11 14 o 0 219.6   15.4  ?     ?   294.864   -127.499     382.876    -127.499     104.786    -127.499     
1 1 1 9   11 15 o 0 66.4    13.2  ?     ?   95.6675   68.1167      196.472    68.1167      109.087    68.1167      
1 1 1 9   11 16 o 0 51.1    14.2  ?     ?   120.436   110.696      145.966    110.696      36.34      110.696      
1 1 1 9   11 17 o 0 6.6     13.8  ?     ?   8.46977   144.762      0.200897   144.762      7.51642    -35.2382     
1 1 1 9   11 18 o 0 1.6     17.8  ?     ?   65.3584   -35.0837     2.79808    -35.0837     61.3215    144.916      
1 1 1 9   11 19 o 0 98.2    18.7  ?     ?   276.866   -114.843     166.711    -114.843     104.598    65.1569      
1 1 1 9   11 20 o 0 134.7   22    ?     ?   135.636   -123.84      366.369    -123.84      239.089    -123.84      
1 1 1 9   11 21 o 0 11.2    23.8  ?     ?   91.8374   -119.664     45.8796    -119.664     37.7061    60.336       
1 1 1 9   11 22 o 0 51.2    23.5  ?     ?   100.472   129.278      163.752    129.278      74.1888    129.278      
1 1 1 -9  13 20 < 0 99.7    20.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  13 19 o 0 56.9    19.5  ?     ?   104.087   -61.3971     186.628    -61.3971     97.7558    -61.3971     
1 1 1 -9  13 18 f 1 96.6    18.6  ?     ?   237.445   -46.1127     195.808    -46.1127     12.2023    133.887      
1 1 1 -9  13 17 o 0 42.6    15.8  ?     ?   111.707   126.402      128.937    126.402      28.5847    126.402      
1 1 1 -9  13 16 o 0 4.4     11.5  ?     ?   77.2498   -93.6956     9.69495    86.3044      82.1422    86.3044      
1 1 1 -9  13 15 f 1 69.4    12.4  ?     ?   198.536   3.21639      157.635    3.21639      29.6672    -176.784     
1 1 1 -9  13 14 o 0 90.5    11.9  ?     ?   268.084   -98.8678     155.458    -98.8678     78.1569    81.1322      
1 1 1 -9  13 13 o 0 56.7    9.4   ?     ?   218.113   -86.6571     106.634    -86.6571     83.1725    93.3429      
1 1 1 -9  13 12 o 0 46.8    8.4   ?     ?   76.6875   -82.5244     126.672    -82.5244     59.4777    -82.5244     
1 1 1 -9  13 11 f 1 14.2    8.6   ?     ?   43.6714   -71.4519     1.81186    -71.4519     36.7506    108.548      
1 1 1 -9  13 10 o 0 137.1   8     ?     ?   205.988   -14.7674     298.094    -14.7674     111.421    -14.7674     
1 1 1 -9  13 9  o 0 79.1    7.7   ?     ?   236.603   -106.013     149.548    -106.013     66.028     73.987       
1 1 1 -9  13 8  o 0 263.7   9     ?     ?   406.202   140.959      333.371    140.959      44.8622    -39.0411     
1 1 1 -9  13 7  o 0 327.7   9.8   ?     ?   385.871   129.89       437.468    129.89       76.5876    129.89       
1 1 1 -9  13 6  o 0 130.5   6.9   ?     ?   276.994   5.50138      225.693    5.50138      34.3704    -174.499     
1 1 1 -9  13 5  o 0 669     15.1  ?     ?   564.671   -63.953      621.784    -63.953      80.3737    -63.953      
1 1 1 -9  13 4  o 0 1024.8  21.9  ?     ?   819.96    -61.7173     667.103    -61.7174     121.36     118.283      
1 1 1 -9  13 3  o 0 150.6   7.2   ?     ?   206.585   -88.1464     302.684    -88.1464     103.556    -88.1464     
1 1 1 -9  13 2  o 0 77      6.3   ?     ?   335.027   40.1559      42.5367    40.1559      281.02     -139.844     
1 1 1 -9  13 1  o 0 62.6    5.9   ?     ?   294.007   -58.1252     36.0142    -58.1252     248.341    121.875      
1 1 1 9   13 0  o 0 98.3    6.5   ?     ?   283.212   149.582      138.877    149.582      136.373    -30.4175     
1 1 1 9   13 1  o 0 15.1    5.4   ?     ?   88.9101   30.5928      32.7647    -149.407     119.157    -149.407     
1 1 1 9   13 2  o 0 312.5   9.2   ?     ?   297.86    28.6212      488.631    28.6212      199.393    28.6212      
1 1 1 9   13 3  o 0 39.8    5.9   ?     ?   85.6818   130.347      48.8789    130.347      34.231     -49.6532     
1 1 1 9   13 4  o 0 157.7   8.6   ?     ?   359.295   -148.467     197.625    -148.467     150.338    31.5332      
1 1 1 9   13 5  o 0 27.9    8.2   ?     ?   51.4107   -176.525     10.019     -176.525     39.6686    3.47492      
1 1 1 9   13 6  o 0 206.9   11.2  ?     ?   414.736   153.486      245.538    153.486      147.304    -26.5138     
1 1 1 9   13 7  o 0 158.3   9.1   ?     ?   292.441   -178.999     267.421    -178.999     8.74711    1.00101      
1 1 1 9   13 8  o 0 172.1   9.8   ?     ?   333.571   45.5462      266.715    45.5462      41.9457    -134.454     
1 1 1 9   13 9  o 0 82.3    9.7   ?     ?   274.425   159.907      129.064    159.907      123.852    -20.0926     
1 1 1 9   13 10 o 0 52      10    ?     ?   205.674   78.4541      103.776    78.4541      80.2267    -101.546     
1 1 1 9   13 11 f 1 23      10.1  ?     ?   125.639   -31.0115     27.4563    -31.0115     84.959     148.989      
1 1 1 9   13 12 o 0 169.8   13.2  ?     ?   220.799   10.4101      354.514    10.4101      158.305    10.4101      
1 1 1 9   13 13 o 0 211.6   15    ?     ?   354.619   16.8544      313.219    16.8544      2.77251    -163.146     
1 1 1 9   13 14 o 0 78      15.3  ?     ?   180.476   81.4639      190.033    81.4639      30.2524    81.4639      
1 1 1 9   13 15 f 1 103.5   16.2  ?     ?   154.35    9.50515      277.483    9.50515      129.412    9.50515      
1 1 1 9   13 16 o 0 7.1     18.6  ?     ?   51.1523   58.7849      18.9286    58.7849      29.8944    -121.215     
1 1 1 9   13 17 o 0 37.6    23.1  ?     ?   209.371   86.815       38.342     86.815       153.25     -93.185      
1 1 1 9   13 18 f 1 36.3    18.5  ?     ?   255.29    62.1774      1.59268    62.1774      226.416    -117.823     
1 1 1 9   13 19 o 0 -4.4    21.3  ?     ?   62.7662   9.98092      33.5401    9.98092      21.1455    -170.019     
1 1 1 9   13 20 < 0 78.9    23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  15 17 < 0 19.3    16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  15 16 < 0 11.9    19.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  15 15 o 0 96.5    16    ?     ?   138.904   32.3155      272.649    32.3155      156.842    32.3155      
1 1 1 -9  15 14 o 0 31.5    11.1  ?     ?   159.192   -34.4657     71.399     -34.4656     62.0855    145.534      
1 1 1 -9  15 13 o 0 -6.3    12.1  ?     ?   80.4345   -66.0747     21.7959    113.925      90.6462    113.925      
1 1 1 -9  15 12 o 0 192.3   26.1  ?     ?   151.463   169.239      431.233    169.239      297.891    169.239      
1 1 1 -9  15 11 f 1 97.2    12.1  ?     ?   209.098   176.522      214.41     176.522      21.6794    176.522      
1 1 1 -9  15 10 f 1 58.3    10.6  ?     ?   72.7932   163.064      190.999    163.064      123.497    163.064      
1 1 1 -9  15 9  o 0 37.5    9.5   ?     ?   211.282   -174.691     47.4828    -174.691     147.068    5.30852      
1 1 1 -9  15 8  o 0 4.8     8.3   ?     ?   205.085   -158.577     98.795     21.423       282.106    21.423       
1 1 1 -9  15 7  f 1 120.7   9.2   ?     ?   232.154   -112.109     244.367    -112.109     44.5082    -112.109     
1 1 1 -9  15 6  o 0 3.7     7.6   ?     ?   117.727   -5.21717     49.2906    174.783      150.537    174.783      
1 1 1 -9  15 5  o 0 73.2    7.1   ?     ?   153.158   135.682      191.493    135.682      60.4473    135.682      
1 1 1 -9  15 4  o 0 82.4    9.3   ?     ?   248.595   143.038      151.031    143.038      62.3399    -36.9624     
1 1 1 -9  15 3  f 1 39.7    8.4   ?     ?   93.9955   63.2848      105.594    63.2848      24.287     63.2848      
1 1 1 -9  15 2  o 0 98.9    10.1  ?     ?   86.4523   88.2694      268.566    88.2694      194.003    88.2694      
1 1 1 -9  15 1  o 0 475.1   14.4  ?     ?   477.707   178.702      523.569    178.702      110.851    178.702      
1 1 1 9   15 0  o 0 77.5    8.3   ?     ?   197.02    -158.996     178.367    -158.996     6.95855    -158.996     
1 1 1 9   15 1  o 0 18.1    7.2   ?     ?   200.898   -119.343     32.4597    60.6572      207.151    60.6572      
1 1 1 9   15 2  o 0 10.1    8.5   ?     ?   230.617   -178.987     93.5115    1.01275      293.852    1.01275      
1 1 1 9   15 3  f 1 212.7   10.3  ?     ?   391.121   -13.2731     279.999    -13.2731     61.0364    166.727      
1 1 1 9   15 4  o 0 121.8   9.4   ?     ?   305.742   -51.3299     194.525    -51.3299     70.2034    128.67       
1 1 1 9   15 5  o 0 60.3    8.9   ?     ?   272.862   120.723      76.0563    120.723      159.649    -59.2773     
1 1 1 9   15 6  o 0 241.6   12.1  ?     ?   362.057   89.1619      343.985    89.1619      29.3772    89.1619      
1 1 1 9   15 7  f 1 234     13.1  ?     ?   340.419   142.8        347.733    142.8        51.3847    142.8        
1 1 1 9   15 8  o 0 303.5   15.2  ?     ?   381.063   -163.067     415.465    -163.067     58.5518    -163.067     
1 1 1 9   15 9  o 0 42.7    13.2  ?     ?   222.937   -133.159     54.2477    -133.159     153.674    46.8409      
1 1 1 9   15 10 f 1 205     15.3  ?     ?   223.878   140.341      406.839    140.341      196.391    140.341      
1 1 1 9   15 11 f 1 109.3   13.8  ?     ?   262.341   113.698      198.206    113.698      47.1131    -66.3016     
1 1 1 9   15 12 o 0 105.1   18.9  ?     ?   129.416   171.409      294.221    171.409      178.537    171.409      
1 1 1 9   15 13 o 0 70.2    17.8  ?     ?   137.01    -82.8394     204.931    -82.8394     85.7521    -82.8394     
1 1 1 9   15 14 o 0 12.9    20.1  ?     ?   51.152    78.7818      44.681     78.7818      1.05782    78.7818      
1 1 1 9   15 15 o 0 10.7    22.7  ?     ?   68.7004   -17.732      60.5553    -17.732      2.25244    -17.732      
1 1 1 9   15 16 < 0 45.6    26    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  17 11 < 0 130.7   17.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  17 10 < 0 -3.9    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -9  17 9  o 0 22.4    12    ?     ?   119.914   -161.918     59.7575    -161.918     37.6484    18.0818      
1 1 1 -9  17 8  f 1 132.3   13.1  ?     ?   316.074   -152.275     208.01     -152.275     51.422     27.7249      
1 1 1 -9  17 7  o 0 15.2    12.7  ?     ?   112.573   -65.2569     29.7518    -65.2569     62.4093    114.743      
1 1 1 -9  17 6  o 0 13.9    12.2  ?     ?   55.8845   57.7007      33.2807    57.7007      12.6687    -122.299     
1 1 1 -9  17 5  o 0 46.9    12    ?     ?   170.569   70.5629      115.117    70.5629      27.5273    -109.437     
1 1 1 -9  17 4  o 0 -11.7   11.6  ?     ?   66.521    -105.395     24.3682    74.6054      80.1862    74.6054      
1 1 1 -9  17 3  o 0 28.7    12.3  ?     ?   83.559    -76.7718     84.9728    -76.7718     14.655     -76.7718     
1 1 1 -9  17 2  o 0 73.4    12.8  ?     ?   191.271   -54.7274     176.693    -54.7274     15.341     -54.7274     
1 1 1 -9  17 1  o 0 81.5    11.5  ?     ?   110.909   -63.9796     248.093    -63.9796     154.348    -63.9796     
1 1 1 9   17 0  o 0 21.6    10.4  ?     ?   227.592   -158.424     24.6677    21.5765      218.76     21.5765      
1 1 1 9   17 1  o 0 80.4    12    ?     ?   191.627   159.031      196.152    159.031      32.8627    159.031      
1 1 1 9   17 2  o 0 33.7    11.9  ?     ?   57.3089   -102.25      99.6747    -102.25      50.9014    -102.25      
1 1 1 9   17 3  o 0 181.7   13.1  ?     ?   205.332   -173.059     382.139    -173.059     207.686    -173.059     
1 1 1 9   17 4  o 0 323.7   15.9  ?     ?   325.39    125.405      481.116    125.405      205.256    125.405      
1 1 1 9   17 5  o 0 53.6    13.3  ?     ?   85.9827   106.242      177.506    106.242      104.802    106.242      
1 1 1 9   17 6  o 0 71.1    14.4  ?     ?   259.873   35.0713      121.073    35.0713      95.1327    -144.929     
1 1 1 9   17 7  o 0 7.6     15.7  ?     ?   172.642   11.7558      19.8716    -168.244     162.994    -168.244     
1 1 1 9   17 8  f 1 111.3   17.9  ?     ?   165.631   -108.321     280.206    -108.321     142.435    -108.321     
1 1 1 9   17 9  o 0 43      19.3  ?     ?   124.515   -123.755     122.042    -123.755     19.4635    -123.755     
1 1 1 9   17 10 < 0 10.8    14.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 9   17 11 < 0 29.1    20.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 0  27 f 1 91.6    23.7  ?     ?   232.776   180          220.077    180          4.2247     3.65521e-13  
1 1 1 -10 0  26 o 0 -28.8   16.8  ?     ?   12.0355   0            1.57561    0            10.7568    180          
1 1 1 -10 0  25 o 0 11.3    18.1  ?     ?   148.465   180          49.0553    180          98.3713    3.49906e-15  
1 1 1 -10 0  24 o 0 43.4    18.6  ?     ?   182.94    0            129.256    0            44.3279    180          
1 1 1 -10 0  23 o 0 0.7     14.8  ?     ?   121.752   0            21.675     0            94.5882    180          
1 1 1 -10 0  22 f 1 249.3   17.1  ?     ?   349.276   180          385.04     180          31.9772    180          
1 1 1 -10 0  21 o 0 135.9   13.4  ?     ?   160.109   0            269.583    0            104.169    0            
1 1 1 -10 0  20 o 0 185.5   12.9  ?     ?   225.621   0            293.727    0            85.4325    0            
1 1 1 -10 0  19 o 0 104     10.9  ?     ?   131.741   180          145.764    180          24.1669    180          
1 1 1 -10 0  18 o 0 71.8    9.2   ?     ?   331.793   180          174.473    180          134.253    9.11883e-15  
1 1 1 -10 0  17 f 1 253.9   11.6  ?     ?   508.505   180          360.952    180          128.474    1.97136e-14  
1 1 1 -10 0  16 f 1 1848.3  46.8  ?     ?   837.424   0            956.034    0            155.977    0            
1 1 1 -10 0  15 o 0 3615.8  89.9  ?     ?   1268.66   180          1345.87    180          115.864    180          
1 1 1 -10 0  14 o 0 893.9   25.7  ?     ?   854.532   180          673.642    180          160.052    2.95326e-14  
1 1 1 -10 0  13 o 0 562.8   16    ?     ?   582.131   180          566.055    180          35.3412    1.12385e-13  
1 1 1 -10 0  12 o 0 504.8   21.6  ?     ?   306.44    0            538.034    0            223.581    0            
1 1 1 -10 0  11 o 0 179.7   9.2   ?     ?   195.716   180          287.639    180          85.8554    180          
1 1 1 -10 0  10 o 0 72.2    4.3   ?     ?   318.576   180          187.616    180          146.862    8.96384e-15  
1 1 1 -10 0  9  o 0 139.3   7.9   ?     ?   19.5017   180          35.5847    180          15.037     180          
1 1 1 -10 0  8  o 0 31.2    2.6   ?     ?   162.734   0            57.3848    0            101.449    180          
1 1 1 -10 0  7  o 0 956     24.6  ?     ?   685.668   180          713.018    180          42.3659    180          
1 1 1 -10 0  6  o 0 648     17.1  ?     ?   611.055   180          564.824    180          10.2025    3.88456e-13  
1 1 1 -10 0  5  o 0 919.6   23.1  ?     ?   778.907   180          673.088    180          60.1433    7.85268e-14  
1 1 1 -10 0  4  o 0 1471.4  36.8  ?     ?   1035.4    180          831.73     180          120.503    4.84305e-14  
1 1 1 -10 0  3  o 0 258.8   10.4  ?     ?   228.558   0            334.44     0            124.56     0            
1 1 1 -10 0  2  o 0 4646.6  153.3 ?     ?   1228.31   180          1442.89    180          338.847    180          
1 1 1 -10 0  1  o 0 169.1   6.5   ?     ?   321.294   180          268.826    180          19.6814    9.58404e-14  
1 1 1 10  0  0  o 0 29.7    1.6   ?     ?   199.633   -180         60.1096    180          119.376    3.11001e-13  
1 1 1 10  0  1  o 0 12.8    1.4   ?     ?   144.61    180          20.2322    180          110.257    1.28757e-15  
1 1 1 10  0  2  o 0 299     11.8  ?     ?   7.06984   180          23.9427    180          17.5337    180          
1 1 1 10  0  3  o 0 2994.7  72.6  ?     ?   1186.97   180          1197.25    180          95.5896    180          
1 1 1 10  0  4  o 0 7072.1  165.7 ?     ?   1776.9    180          1843.42    180          189.937    180          
1 1 1 10  0  5  o 0 485.2   13.3  ?     ?   548.683   180          494.959    180          27.9259    1.24364e-13  
1 1 1 10  0  6  o 0 531.8   15.2  ?     ?   581.049   0            518.119    0            35.5733    180          
1 1 1 10  0  7  o 0 42.3    4.5   ?     ?   177.986   180          82.5461    180          93.7756    6.17647e-15  
1 1 1 10  0  8  o 0 251     9.1   ?     ?   115.408   180          276.572    180          162.462    180          
1 1 1 10  0  9  o 0 670.8   18.7  ?     ?   527.623   0            651.912    0            88.6041    0            
1 1 1 10  0  10 o 0 25.2    5.6   ?     ?   319.342   180          85.5336    180          257.266    2.33286e-15  
1 1 1 10  0  11 o 0 23.6    5.6   ?     ?   392.885   180          88.9244    180          321.791    1.93901e-15  
1 1 1 10  0  12 o 0 1213.1  32.7  ?     ?   614.152   0            847.351    0            208.09     0            
1 1 1 10  0  13 o 0 1177.3  35.9  ?     ?   807.337   180          830.667    180          15.7484    3.70104e-13  
1 1 1 10  0  14 o 0 2493    65.9  ?     ?   741.208   180          1141.98    180          407.768    180          
1 1 1 10  0  15 o 0 180.5   16.1  ?     ?   24.9706   0            50.5571    0            26.2833    0            
1 1 1 10  0  16 f 1 572     26    ?     ?   805.87    0            540.3      0            242.283    180          
1 1 1 10  0  17 f 1 243.6   21.2  ?     ?   71.6472   0            183.295    0            113.158    0            
1 1 1 10  0  18 o 0 48.2    17.7  ?     ?   107.389   180          54.7452    180          46.9505    8.18161e-15  
1 1 1 10  0  19 o 0 249.9   18.5  ?     ?   368.608   180          357.472    180          10.9763    180          
1 1 1 10  0  20 o 0 29      18    ?     ?   113.321   0            34.8722    0            71.7503    180          
1 1 1 10  0  21 o 0 240.6   23.1  ?     ?   528.327   180          388.295    180          168.404    1.61787e-14  
1 1 1 10  0  22 f 1 37.2    27.8  ?     ?   257.168   180          114.457    180          146.445    5.48405e-15  
1 1 1 10  0  23 o 0 291.5   35.5  ?     ?   437.578   180          416.325    180          10.5111    2.77918e-13  
1 1 1 10  0  24 o 0 231.2   27.1  ?     ?   343.906   180          368.144    180          34.5324    180          
1 1 1 10  0  25 o 0 -6.6    36.8  ?     ?   9.55396   180          4.945      180          5.10632    6.79504e-15  
1 1 1 10  0  27 f 1 75.2    34.6  ?     ?   268.173   180          174.439    180          90.4505    1.35322e-14  
1 1 1 -10 2  28 o 0 8.1     18.7  ?     ?   105.26    68.0556      38.8737    68.0556      58.9735    -111.944     
1 1 1 -10 2  27 o 0 3       17.1  ?     ?   8.67866   -171.594     3.51923    -171.594     4.73465    8.40639      
1 1 1 -10 2  26 o 0 -3.3    18.1  ?     ?   93.1302   46.9922      7.79999    -133.008     102.503    -133.008     
1 1 1 -10 2  25 o 0 24.4    14.9  ?     ?   97.9678   95.9745      58.1972    95.9745      41.8004    -84.0255     
1 1 1 -10 2  24 o 0 84.7    14.5  ?     ?   103.68    -102.663     256.555    -102.663     158.856    -102.663     
1 1 1 -10 2  23 o 0 108.3   16.4  ?     ?   209.442   177.934      259.135    177.934      60.4461    177.934      
1 1 1 -10 2  22 o 0 295.7   13    ?     ?   373.521   -150.279     444.809    -150.279     77.7321    -150.279     
1 1 1 -10 2  21 o 0 317.6   15.4  ?     ?   358.507   -128.904     482.711    -128.904     120.913    -128.904     
1 1 1 -10 2  20 o 0 124.4   8.7   ?     ?   200.104   -118.856     273.362    -118.856     65.9121    -118.856     
1 1 1 -10 2  19 f 1 169.9   9.6   ?     ?   194.153   106.345      311.054    106.345      130.27     106.345      
1 1 1 -10 2  18 o 0 422.1   13.5  ?     ?   402.915   95.6192      497.145    95.6192      123.982    95.6192      
1 1 1 -10 2  17 f 1 915.7   20.7  ?     ?   427.64    120.104      903.586    120.104      493.726    120.104      
1 1 1 -10 2  16 f 1 300.7   10.2  ?     ?   99.4303   -25.1489     404.409    -25.1489     309.773    -25.1489     
1 1 1 -10 2  15 f 1 2352    41.8  ?     ?   1229.34   -156.336     968.163    -156.336     210.368    23.6636      
1 1 1 -10 2  14 o 0 1204.8  22.9  ?     ?   685.011   -87.5536     862.3      -87.5536     195.836    -87.5536     
1 1 1 -10 2  13 o 0 13.2    4.3   ?     ?   257.601   117.641      179.731    -62.3587     431.949    -62.3587     
1 1 1 -10 2  12 o 0 711.1   15.1  ?     ?   477.914   147.967      740.997    147.967      251.356    147.967      
1 1 1 -10 2  11 o 0 41.8    2.7   ?     ?   67.9609   39.0162      2.43868    39.0162      67.5677    -140.984     
1 1 1 -10 2  10 o 0 111.1   3.5   ?     ?   195.084   -173.485     176.216    -173.485     30.3711    6.51542      
1 1 1 -10 2  9  o 0 613.8   11.6  ?     ?   616.661   -71.9584     543.392    -71.9584     106.861    108.042      
1 1 1 -10 2  8  o 0 645.6   12.1  ?     ?   769.608   -100.558     423.059    -100.558     391.643    79.4423      
1 1 1 -10 2  6  o 0 1600.1  29.9  ?     ?   893.901   -175.716     951.736    -175.716     72.3493    -175.716     
1 1 1 -10 2  5  o 0 3771.3  68.5  ?     ?   1428.92   -63.7161     1373.65    -63.7161     20.142     -63.7161     
1 1 1 -10 2  4  o 0 1109    19.7  ?     ?   606.601   -68.7179     879.327    -68.7179     303.961    -68.7179     
1 1 1 -10 2  3  o 0 1163.4  22.4  ?     ?   926.906   -33.6784     610.23     -33.6784     249.801    146.322      
1 1 1 -10 2  2  o 0 711.1   16.6  ?     ?   598.536   16.5461      576.716    16.5461      21.3541    16.5461      
1 1 1 10  2  0  o 0 3267.8  90.6  ?     ?   1161.67   40.8542      1386.62    40.8542      321.517    40.8542      
1 1 1 10  2  1  o 0 783.9   14.2  ?     ?   668.155   154.154      569.741    154.154      45.3849    -25.8456     
1 1 1 10  2  2  o 0 3176.5  62.4  ?     ?   1183.96   -44.1899     1344.61    -44.1899     249.932    -44.1899     
1 1 1 10  2  3  o 0 221.7   6.8   ?     ?   330.766   -158.813     278.632    -158.813     28.2777    21.1875      
1 1 1 10  2  4  o 0 358.1   7.9   ?     ?   553.339   -14.7966     283.672    -14.7966     242.726    165.203      
1 1 1 10  2  5  o 0 165.7   4     ?     ?   462.242   -142.528     90.1206    -142.528     350.037    37.4721      
1 1 1 10  2  6  o 0 375.6   7.5   ?     ?   560.021   -135.21      310.687    -135.21      244.151    44.7901      
1 1 1 10  2  7  o 0 190.2   5.3   ?     ?   378.445   129.16       207.86     129.16       166.604    -50.8395     
1 1 1 10  2  8  o 0 227.4   5.7   ?     ?   370.167   -5.36117     297.193    -5.36118     98.4885    174.639      
1 1 1 10  2  9  o 0 675.3   13.3  ?     ?   558.747   108.78       667.772    108.78       72.223     108.78       
1 1 1 10  2  10 o 0 1096.4  24    ?     ?   596.423   -18.5541     958.443    -18.5541     333.791    -18.5541     
1 1 1 10  2  11 o 0 258.5   7.8   ?     ?   269.741   43.7546      413.868    43.7546      132.511    43.7546      
1 1 1 10  2  12 o 0 1164.5  22.6  ?     ?   851.782   -168.754     745.942    -168.754     138.435    11.2464      
1 1 1 10  2  13 o 0 1024.2  21.7  ?     ?   642.636   94.9603      795.809    94.9603      157.674    94.9603      
1 1 1 10  2  14 o 0 248.4   10.7  ?     ?   367.497   -134.634     294.238    -134.634     68.6581    45.3661      
1 1 1 10  2  15 f 1 502.8   16.1  ?     ?   532.404   171.083      455.099    171.083      63.3324    -8.91716     
1 1 1 10  2  16 f 1 137.5   12.5  ?     ?   132.455   139.654      199.854    139.654      68.2468    139.654      
1 1 1 10  2  17 f 1 49.7    13.9  ?     ?   353.099   169.045      96.9779    -10.9554     441.246    -10.9554     
1 1 1 10  2  18 o 0 830.3   21.8  ?     ?   565.767   -78.3704     744.769    -78.3704     211.309    -78.3704     
1 1 1 10  2  19 f 1 227.3   14.3  ?     ?   407.659   -88.4144     255.511    -88.4144     131.244    91.5856      
1 1 1 10  2  20 o 0 0.9     11.4  ?     ?   127.315   -111.146     89.7316    68.8538      224.321    68.8538      
1 1 1 10  2  21 o 0 6.6     12.4  ?     ?   34.0845   -127.35      13.5363    52.6496      48.6404    52.6496      
1 1 1 10  2  22 o 0 41.7    16.5  ?     ?   44.5362   -104.668     68.0855    -104.668     23.381     -104.668     
1 1 1 10  2  23 o 0 -3.3    21.4  ?     ?   105.715   15.1135      15.1185    -164.887     117.64     -164.887     
1 1 1 10  2  24 o 0 278.3   21.7  ?     ?   391.007   114.826      409.483    114.826      29.1887    114.826      
1 1 1 10  2  25 o 0 324.8   28.1  ?     ?   439.327   82.1325      425.773    82.1325      33.4698    -97.8675     
1 1 1 10  2  26 o 0 57.5    24.7  ?     ?   176.3     91.675       130.349    91.675       47.234     -88.325      
1 1 1 10  2  27 o 0 43.6    30.9  ?     ?   113.421   175.519      129.257    175.519      18.5775    175.519      
1 1 1 10  2  28 o 0 17.1    26.9  ?     ?   72.9448   109.305      91.2362    109.305      21.5936    109.305      
1 1 1 -10 4  28 < 0 58.7    20.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 4  27 o 0 96.6    18.4  ?     ?   194.103   14.8673      251.737    14.8673      72.4643    14.8673      
1 1 1 -10 4  26 o 0 12.6    17.8  ?     ?   52.1455   -23.1757     28.374     -23.1757     22.0611    156.824      
1 1 1 -10 4  25 o 0 152.8   17    ?     ?   206.255   144.252      359.928    144.252      151.085    144.252      
1 1 1 -10 4  24 o 0 16.4    12.7  ?     ?   56.4707   178.784      18.1359    178.784      34.7344    -1.21591     
1 1 1 -10 4  23 o 0 188.7   14.4  ?     ?   179.354   -80.4498     438.249    -80.4498     269.979    -80.4498     
1 1 1 -10 4  22 f 1 19      11.3  ?     ?   120.519   -10.0356     12.0736    -10.0356     102.34     169.964      
1 1 1 -10 4  21 o 0 12      8.9   ?     ?   131.905   -171.662     51.1242    8.33816      182.369    8.33816      
1 1 1 -10 4  20 o 0 532.1   15.1  ?     ?   384.97    -97.9914     698.907    -97.9914     305.28     -97.9914     
1 1 1 -10 4  19 o 0 15.7    8.5   ?     ?   73.2624   175.694      32.9558    -4.30641     99.917     -4.30641     
1 1 1 -10 4  18 o 0 162.6   8.6   ?     ?   329.734   63.7997      199.458    63.7997      101.953    -116.2       
1 1 1 -10 4  17 o 0 870.5   19.3  ?     ?   517.988   159.155      799.918    159.155      322.412    159.155      
1 1 1 -10 4  16 o 0 806.9   23.1  ?     ?   657.115   149.346      618.615    149.346      5.01554    -30.6541     
1 1 1 -10 4  15 o 0 1036.2  27.8  ?     ?   555.934   159.29       855.527    159.29       331.595    159.29       
1 1 1 -10 4  14 o 0 528.5   12    ?     ?   432.181   -119.368     558.569    -119.368     148.33     -119.368     
1 1 1 -10 4  13 o 0 1115.7  22.8  ?     ?   599.487   78.1375      877.898    78.1375      297.43     78.1375      
1 1 1 -10 4  12 o 0 1096.5  30    ?     ?   720.304   178.487      758.638    178.487      56.7638    178.487      
1 1 1 -10 4  11 o 0 919.1   24.1  ?     ?   531.396   -162.079     861.619    -162.079     319.793    -162.079     
1 1 1 -10 4  10 o 0 107.8   4.1   ?     ?   172.537   19.3263      166.321    19.3263      10.558     -160.674     
1 1 1 -10 4  9  o 0 1013.8  19.1  ?     ?   849.804   48.2519      632.041    48.2519      243.464    -131.748     
1 1 1 -10 4  8  o 0 507.5   10    ?     ?   442.499   -154.881     594.055    -154.881     125.628    -154.881     
1 1 1 -10 4  7  o 0 412.4   9.4   ?     ?   489.881   -7.79707     444.043    -7.79707     72.0779    172.203      
1 1 1 -10 4  6  o 0 684.3   12.5  ?     ?   641.154   152.443      589.393    152.443      88.3667    -27.5574     
1 1 1 -10 4  5  o 0 1601.7  28    ?     ?   1015.79   97.3543      831.786    97.3543      162.778    -82.6457     
1 1 1 -10 4  4  o 0 338.2   6.7   ?     ?   461.881   44.3335      349.32     44.3335      103.849    -135.666     
1 1 1 -10 4  2  o 0 625.9   11.9  ?     ?   521.041   139.653      605.238    139.653      92.9573    139.653      
1 1 1 -10 4  1  f 1 2373.6  56.6  ?     ?   845.343   69.3161      1396.44    69.3161      560.973    69.3161      
1 1 1 10  4  0  o 0 1990    58.9  ?     ?   591.038   102.098      1434.38    102.098      858.81     102.098      
1 1 1 10  4  1  f 1 1132.3  20.2  ?     ?   916.561   151.899      626.342    151.899      273.148    -28.1007     
1 1 1 10  4  3  o 0 366.6   7.8   ?     ?   431.129   79.746       410.63     79.746       12.0215    -100.254     
1 1 1 10  4  4  o 0 502.7   10.8  ?     ?   418.867   -106.173     573.269    -106.173     162.235    -106.173     
1 1 1 10  4  5  o 0 89.3    3.2   ?     ?   260.262   -100.211     84.3722    -100.211     171.053    79.7895      
1 1 1 10  4  6  o 0 30.6    2.3   ?     ?   177.548   -123.342     60.6547    56.6583      249.153    56.6583      
1 1 1 10  4  7  o 0 80.2    3.8   ?     ?   175.454   -120.319     98.444     -120.319     87.5365    59.6815      
1 1 1 10  4  8  o 0 198.3   5.3   ?     ?   216.052   -158.005     353.057    -158.005     122.591    -158.005     
1 1 1 10  4  9  o 0 513.9   10.6  ?     ?   578.158   136.52       461.664    136.52       139.391    -43.4803     
1 1 1 10  4  10 o 0 400.7   9.8   ?     ?   647.985   90.6162      263.429    90.6162      407.746    -89.3838     
1 1 1 10  4  11 o 0 1437.4  26.8  ?     ?   937.799   46.9446      837.376    46.9446      129.859    -133.055     
1 1 1 10  4  12 o 0 1085.1  21.8  ?     ?   634.08    -56.7077     841.527    -56.7077     215.869    -56.7077     
1 1 1 10  4  13 o 0 1421.1  27.8  ?     ?   757.637   -57.9427     937.057    -57.9427     193.435    -57.9427     
1 1 1 10  4  14 o 0 626.6   15.8  ?     ?   358.589   -17.341      718.446    -17.341      373.076    -17.341      
1 1 1 10  4  15 o 0 373.9   13.9  ?     ?   451.51    109.917      393.245    109.917      50.5748    -70.0832     
1 1 1 10  4  16 o 0 584.2   16.8  ?     ?   456.423   57.223       613.179    57.223       172.85     57.223       
1 1 1 10  4  17 o 0 401.3   15.7  ?     ?   352.204   77.4233      519.937    77.4233      189.591    77.4233      
1 1 1 10  4  18 o 0 226.8   15.6  ?     ?   296.432   -151.613     343.846    -151.613     65.4812    -151.613     
1 1 1 10  4  19 o 0 91.4    13.3  ?     ?   239.777   -154.02      129.788    -154.02      93.5927    25.9796      
1 1 1 10  4  20 o 0 92.1    16.8  ?     ?   153.903   103.169      214.856    103.169      54.3136    103.169      
1 1 1 10  4  21 o 0 100.4   17.6  ?     ?   117.126   -100.047     291.155    -100.047     174.142    -100.047     
1 1 1 10  4  22 f 1 620.7   22.9  ?     ?   447.438   -138.954     765.349    -138.954     331.212    -138.954     
1 1 1 10  4  23 o 0 68.7    17.2  ?     ?   288.474   -107.553     90.1765    -107.553     186.695    72.4473      
1 1 1 10  4  24 o 0 39.4    24.2  ?     ?   105.756   -73.478      108.518    -73.478      2.22587    -73.478      
1 1 1 10  4  25 o 0 124.2   28.8  ?     ?   158.443   171.299      333.891    171.299      169.458    171.299      
1 1 1 10  4  26 o 0 131.9   28.7  ?     ?   319.36    -177.268     210.904    -177.268     99.3845    2.73215      
1 1 1 10  4  27 o 0 -22.9   30    ?     ?   67.966    -118.019     28.747     -118.019     35.7182    61.981       
1 1 1 -10 6  27 < 1 -2      16.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 6  26 o 0 20.3    12.6  ?     ?   109.216   -161.323     55.6348    -161.323     44.0054    18.677       
1 1 1 -10 6  25 o 0 2       11.8  ?     ?   69.7172   -53.7384     10.684     126.262      77.2871    126.262      
1 1 1 -10 6  24 o 0 12.3    11.4  ?     ?   78.0064   -11.7274     14.4072    -11.7274     63.6032    168.273      
1 1 1 -10 6  23 o 0 34.4    12.4  ?     ?   110.478   -87.9087     89.8426    -87.9087     12.3059    92.0913      
1 1 1 -10 6  22 o 0 133.9   12.9  ?     ?   160.626   151.651      343.382    151.651      194.569    151.651      
1 1 1 -10 6  21 o 0 3.1     10.2  ?     ?   92.0637   -141.902     36.4871    38.098       122.342    38.098       
1 1 1 -10 6  20 f 1 122.2   11.8  ?     ?   207.107   175.906      283.631    175.906      82.5545    175.906      
1 1 1 -10 6  19 o 0 330.1   12.3  ?     ?   396.871   -151.126     456.562    -151.126     62.9758    -151.126     
1 1 1 -10 6  18 o 0 66.6    8.2   ?     ?   198.909   150.149      120.084    150.149      82.5222    -29.8506     
1 1 1 -10 6  17 o 0 54.7    8.9   ?     ?   182.369   -177.465     55.9065    -177.465     110.051    2.53485      
1 1 1 -10 6  16 o 0 152.9   8.7   ?     ?   108.043   110.768      229.438    110.768      131.161    110.768      
1 1 1 -10 6  15 f 1 43.3    7.3   ?     ?   301.475   -47.9694     79.991     132.031      363.712    132.031      
1 1 1 -10 6  14 f 1 33.4    5.6   ?     ?   273.493   130.484      99.3769    -49.5159     358.681    -49.5159     
1 1 1 -10 6  13 o 0 1627.1  33    ?     ?   1226.55   73.5024      601.07     73.5024      547.12     -106.498     
1 1 1 -10 6  12 o 0 39.4    6.3   ?     ?   190.289   83.9158      37.7271    -96.0842     217.026    -96.0842     
1 1 1 -10 6  11 o 0 2016.3  53.8  ?     ?   1044.62   -128.391     967.883    -128.391     35.4614    51.6088      
1 1 1 -10 6  10 o 0 2072.1  53.5  ?     ?   936.163   94.1451      1103.41    94.1451      199.211    94.1451      
1 1 1 -10 6  9  o 0 2009.6  52.8  ?     ?   1040.25   50.8655      1031.02    50.8655      32.1754    -129.134     
1 1 1 -10 6  8  o 0 2648.5  45.3  ?     ?   1263.47   152.31       1141.75    152.31       140.021    -27.69       
1 1 1 -10 6  7  o 0 3668.1  72.3  ?     ?   1417.47   148.406      1423.61    148.406      20.1629    -31.5936     
1 1 1 -10 6  6  o 0 1004.6  21    ?     ?   729.141   38.6283      739.014    38.6283      6.20989    -141.372     
1 1 1 -10 6  5  o 0 3084.5  52.3  ?     ?   1271.4    -42.4105     1340.06    -42.4105     36.9252    -42.4105     
1 1 1 -10 6  4  o 0 263.9   7     ?     ?   261.76    -46.0406     430.618    -46.0406     155.556    -46.0406     
1 1 1 -10 6  3  o 0 157.1   3.8   ?     ?   60.4969   -40.338      167.147    -40.338      104.025    -40.338      
1 1 1 -10 6  1  o 0 956.7   20.8  ?     ?   580.266   -28.5178     877.214    -28.5178     270.926    -28.5178     
1 1 1 10  6  0  o 0 595     16    ?     ?   454.58    14.5884      671.074    14.5884      198.677    14.5884      
1 1 1 10  6  1  o 0 317.5   13.2  ?     ?   257.075   169.504      510.866    169.504      243.295    169.504      
1 1 1 10  6  2  f 1 1034.5  22.3  ?     ?   617.292   -146.111     896.234    -146.111     249.67     -146.111     
1 1 1 10  6  3  o 0 583.3   11.2  ?     ?   501.96    -124.036     614.008    -124.036     86.0158    -124.036     
1 1 1 10  6  4  o 0 722.2   14.5  ?     ?   535.112   44.7688      716.023    44.7688      153.104    44.7688      
1 1 1 10  6  5  o 0 794.7   18    ?     ?   593.568   115.648      706.9      115.648      96.8362    115.648      
1 1 1 10  6  6  o 0 1149.7  21.4  ?     ?   825.13    95.5123      753.535    95.5123      93.4957    -84.4877     
1 1 1 10  6  7  o 0 1008.8  22.5  ?     ?   755.293   85.2039      718.303    85.2039      55.5723    -94.7961     
1 1 1 10  6  8  o 0 1153.3  23.8  ?     ?   925.013   -75.5366     653.575    -75.5366     291.783    104.463      
1 1 1 10  6  9  o 0 150.1   6.4   ?     ?   239.725   102.215      218.016    102.215      16.749     -77.785      
1 1 1 10  6  10 o 0 405.7   10    ?     ?   307.595   63.3949      535.117    63.3949      235.024    63.3949      
1 1 1 10  6  11 o 0 20.4    6.4   ?     ?   193.297   76.2748      103.324    -103.725     291.088    -103.725     
1 1 1 10  6  12 o 0 30.1    7.9   ?     ?   159.469   -32.6498     54.0981    147.35       206.237    147.35       
1 1 1 10  6  13 o 0 92.9    14.2  ?     ?   134.195   -75.8135     103.93     -75.8135     23.4056    104.187      
1 1 1 10  6  14 f 1 58.3    11.1  ?     ?   152.351   93.7576      27.9913    93.7576      118.582    -86.2424     
1 1 1 10  6  15 f 1 342.4   13.5  ?     ?   486.347   -100.286     321.37     -100.286     143.553    79.7143      
1 1 1 10  6  16 o 0 179     12.1  ?     ?   167.467   -145.594     306.382    -145.594     151.493    -145.594     
1 1 1 10  6  17 o 0 46.4    11.5  ?     ?   165.875   21.5104      34.8875    21.5104      118.747    -158.49      
1 1 1 10  6  18 o 0 3.9     12.8  ?     ?   160.945   -66.8726     100.506    113.127      267.524    113.127      
1 1 1 10  6  19 o 0 39.7    13.5  ?     ?   26.5504   -168.463     30.688     -168.463     3.8366     -168.463     
1 1 1 10  6  20 f 1 16.7    18    ?     ?   100.233   91.7253      11.3329    91.7253      88.0014    -88.2747     
1 1 1 10  6  21 o 0 87      16.3  ?     ?   163.275   -79.2612     239.512    -79.2612     83.9371    -79.2612     
1 1 1 10  6  22 o 0 93.7    22.2  ?     ?   162.784   -70.0647     250.022    -70.0647     95.782     -70.0647     
1 1 1 10  6  23 o 0 126.1   22    ?     ?   154.016   -59.4469     348.083    -59.4469     195.244    -59.4469     
1 1 1 10  6  24 o 0 8.9     30.1  ?     ?   80.9216   101.097      56.249     101.097      26.6778    -78.9035     
1 1 1 10  6  25 o 0 16.4    25.6  ?     ?   91.4497   49.4269      62.3656    49.4269      25.3802    -130.573     
1 1 1 10  6  26 o 0 51.4    29.8  ?     ?   129.278   9.89665      143.869    9.89665      22.7676    9.89665      
1 1 1 -10 8  26 < 0 26.9    20.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 8  25 o 0 69.3    21.6  ?     ?   146.246   -73.5326     199.693    -73.5326     68.686     -73.5326     
1 1 1 -10 8  24 o 0 31.8    15    ?     ?   138.245   -152.548     80.6485    -152.548     46.0272    27.4519      
1 1 1 -10 8  23 o 0 15.8    16.6  ?     ?   75.6244   -167.644     35.1802    -167.644     38.8938    12.3557      
1 1 1 -10 8  22 o 0 13.4    12.4  ?     ?   124.047   177.639      1.92723    -2.36061     123.856    -2.36061     
1 1 1 -10 8  21 o 0 1.8     12    ?     ?   152.474   -158.531     57.5961    21.4689      197.123    21.4689      
1 1 1 -10 8  20 o 0 296.6   13.1  ?     ?   394.818   -1.20388     416.051    -1.20388     54.2405    -1.20388     
1 1 1 -10 8  19 o 0 143.9   12.1  ?     ?   94.7687   53.4777      372.872    53.4777      283.275    53.4777      
1 1 1 -10 8  18 o 0 107.3   10.8  ?     ?   190.373   -18.3436     247.386    -18.3436     62.6313    -18.3436     
1 1 1 -10 8  17 o 0 383     13    ?     ?   370.539   -22.6191     541.53     -22.6191     178.716    -22.6191     
1 1 1 -10 8  16 o 0 87.4    8.6   ?     ?   327.035   -44.2658     78.6406    -44.2658     250.033    135.734      
1 1 1 -10 8  15 f 1 207.8   8.7   ?     ?   290.795   40.2021      304.395    40.2021      42.1356    40.2021      
1 1 1 -10 8  14 o 0 359.6   11.5  ?     ?   407.001   48.2622      409.151    48.2622      44.3891    48.2622      
1 1 1 -10 8  13 o 0 309.8   11.4  ?     ?   461.448   89.6566      309.321    89.6566      107.183    -90.3434     
1 1 1 -10 8  12 o 0 161.5   6.8   ?     ?   197.667   78.2749      245.706    78.2749      62.2852    78.2749      
1 1 1 -10 8  11 o 0 1499.8  29.6  ?     ?   808.507   73.3017      930.339    73.3017      175.479    73.3017      
1 1 1 -10 8  10 o 0 272.5   10    ?     ?   380.594   -170.329     303.265    -170.329     48.9099    9.67148      
1 1 1 -10 8  9  o 0 188.8   5.9   ?     ?   260.271   68.7017      263.675    68.7017      21.6       68.7017      
1 1 1 -10 8  8  o 0 543     14.1  ?     ?   382.329   146.171      601.355    146.171      239.401    146.171      
1 1 1 -10 8  7  o 0 1624.5  29.1  ?     ?   818.805   128.233      966.012    128.233      187.692    128.233      
1 1 1 -10 8  6  o 0 1460.8  26.8  ?     ?   955.267   137.75       751.114    137.75       160.109    -42.25       
1 1 1 -10 8  5  o 0 1343    24.2  ?     ?   758.739   145.641      866.072    145.641      140.183    145.641      
1 1 1 -10 8  4  o 0 2864    56.7  ?     ?   1442.78   86.5793      972.141    86.5793      411.453    -93.4207     
1 1 1 -10 8  3  o 0 743.1   16.9  ?     ?   599.307   -4.28977     630.181    -4.28977     23.9939    -4.28977     
1 1 1 -10 8  2  o 0 1995.6  40.8  ?     ?   937.1     57.8768      1129.07    57.8768      191.327    57.8768      
1 1 1 -10 8  1  o 0 52.7    3.4   ?     ?   252.51    37.6526      15.88      -142.347     268.751    -142.347     
1 1 1 10  8  0  o 0 909.8   17.4  ?     ?   836.958   175.006      547.462    175.006      289.263    -4.99413     
1 1 1 10  8  1  o 0 561     13.9  ?     ?   380.536   7.46716      669.4      7.46716      288.627    7.46716      
1 1 1 10  8  2  o 0 534.6   12.8  ?     ?   632.948   130.864      414.224    130.864      219.419    -49.1355     
1 1 1 10  8  3  o 0 816.2   16.8  ?     ?   650.599   28.5058      643.633    28.5058      15.5473    -151.494     
1 1 1 10  8  4  o 0 1257.4  26.3  ?     ?   678.465   -11.9642     891.748    -11.9642     239.161    -11.9642     
1 1 1 10  8  5  o 0 213.4   6.9   ?     ?   325.647   150.341      266.708    150.341      46.1879    -29.6586     
1 1 1 10  8  6  o 0 158.3   5.3   ?     ?   231.751   -76.5654     232.319    -76.5654     10.0049    -76.5654     
1 1 1 10  8  7  o 0 654.8   17.2  ?     ?   683.392   111.456      446.311    111.456      207.809    -68.5445     
1 1 1 10  8  8  o 0 139.8   7.1   ?     ?   350.019   79.9702      123.318    79.9702      206.425    -100.03      
1 1 1 10  8  9  o 0 1072.9  21.4  ?     ?   719.898   38.9741      732.846    38.9741      56.9283    38.9741      
1 1 1 10  8  10 o 0 43.9    7.3   ?     ?   109.002   17.7919      3.4562     -162.208     105.398    -162.208     
1 1 1 10  8  11 o 0 54      7.7   ?     ?   150.905   -144.184     17.1338    -144.184     125.432    35.8164      
1 1 1 10  8  12 o 0 517.9   14.8  ?     ?   280.088   77.2141      667.326    77.2141      404.037    77.2141      
1 1 1 10  8  13 o 0 179.5   10.1  ?     ?   282.548   -146.772     260.305    -146.772     1.66857    -146.772     
1 1 1 10  8  14 o 0 742.1   18.8  ?     ?   584.139   152.067      633.711    152.067      102.218    152.067      
1 1 1 10  8  15 f 1 417.2   14.8  ?     ?   314.195   -131.735     555.418    -131.735     267.434    -131.735     
1 1 1 10  8  16 o 0 591.1   17.3  ?     ?   531.354   -120.957     619.489    -120.957     76.2042    -120.957     
1 1 1 10  8  17 o 0 154.3   15.2  ?     ?   235.65    -59.0593     320.575    -59.0593     85.5943    -59.0593     
1 1 1 10  8  18 o 0 176.1   15.4  ?     ?   361.976   -43.1079     260.437    -43.1079     91.694     136.892      
1 1 1 10  8  19 o 0 522.3   19.5  ?     ?   541.501   -27.9118     565.008    -27.9118     55.6037    -27.9118     
1 1 1 10  8  20 o 0 82.2    19.4  ?     ?   209.559   34.6831      186.955    34.6831      9.2031     -145.317     
1 1 1 10  8  21 o 0 145.7   17.8  ?     ?   295.861   107.268      260.969    107.268      15.8513    -72.7322     
1 1 1 10  8  22 o 0 36.3    24.9  ?     ?   89.126    60.081       103.481    60.081       13.8202    60.081       
1 1 1 10  8  23 o 0 -25.9   26.1  ?     ?   69.921    3.53557      0.764001   -176.464     68.5672    -176.464     
1 1 1 10  8  24 o 0 94.9    34.7  ?     ?   157.274   108.762      228.815    108.762      81.0224    108.762      
1 1 1 10  8  25 o 0 13.5    33.9  ?     ?   173.06    139.651      33.0375    139.651      126.111    -40.3492     
1 1 1 -10 10 24 < 0 -1.6    17.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 10 23 o 0 31.6    17.7  ?     ?   124.282   174.638      89.4614    174.638      19.7196    -5.36245     
1 1 1 -10 10 22 o 0 153.3   15.6  ?     ?   235.5     -138.553     327.898    -138.553     115.924    -138.553     
1 1 1 -10 10 21 f 1 84.6    16.1  ?     ?   165.752   161.023      229.384    161.023      74.5736    161.023      
1 1 1 -10 10 20 o 0 46.5    14.9  ?     ?   123.001   -47.3466     134.781    -47.3466     16.1656    -47.3466     
1 1 1 -10 10 19 o 0 139.3   14.6  ?     ?   180.117   123.448      329.66     123.448      168.057    123.448      
1 1 1 -10 10 18 o 0 189.5   13.4  ?     ?   257.812   64.4256      363.247    64.4256      131.761    64.4256      
1 1 1 -10 10 17 o 0 415     15.2  ?     ?   506.703   31.3834      459.457    31.3834      2.08828    31.3834      
1 1 1 -10 10 16 o 0 452.3   14.3  ?     ?   514.773   14.0772      484.902    14.0772      4.27513    14.0772      
1 1 1 -10 10 15 o 0 111.6   9.3   ?     ?   315.306   84.5431      157.329    84.5431      144.508    -95.4569     
1 1 1 -10 10 14 o 0 18.3    7.4   ?     ?   70.5379   55.6644      17.2177    -124.336     86.4713    -124.336     
1 1 1 -10 10 13 f 1 867     18.5  ?     ?   441.992   36.3542      923.388    36.3542      484.062    36.3542      
1 1 1 -10 10 12 o 0 88.5    7.4   ?     ?   57.728    -81.8107     94.1339    -81.8107     43.2342    -81.8107     
1 1 1 -10 10 11 o 0 37.7    6.1   ?     ?   264.427   -162.426     39.7108    17.5738      274.316    17.5738      
1 1 1 -10 10 10 o 0 316.3   9.2   ?     ?   477.181   -110.791     298.593    -110.791     123.505    69.2087      
1 1 1 -10 10 9  o 0 902.2   17.6  ?     ?   716.834   -4.11885     628.141    -4.11885     9.25905    175.881      
1 1 1 -10 10 8  o 0 187     6.5   ?     ?   282.785   -61.1224     249.935    -61.1224     8.07316    118.878      
1 1 1 -10 10 7  o 0 739.6   18.3  ?     ?   657.745   -143.082     544.349    -143.082     58.2748    36.9175      
1 1 1 -10 10 6  o 0 441.7   10    ?     ?   477.099   -21.6979     430.312    -21.6979     8.40019    158.302      
1 1 1 -10 10 5  o 0 154.4   5.1   ?     ?   274.798   134.432      197.925    134.432      58.6207    -45.5677     
1 1 1 -10 10 4  o 0 111.2   4.6   ?     ?   306.099   -140.386     92.6055    -140.386     186.375    39.6138      
1 1 1 -10 10 3  o 0 88.8    5.7   ?     ?   260.463   -155.698     68.4538    -155.698     169.426    24.3016      
1 1 1 -10 10 2  o 0 114     6     ?     ?   200.202   -29.8605     145.884    -29.8605     37.2453    150.139      
1 1 1 -10 10 1  o 0 2316.8  41.7  ?     ?   949.811   -2.11736     1170.28    -2.11736     300.538    -2.11736     
1 1 1 10  10 0  o 0 610.9   13.3  ?     ?   611.019   31.998       465.017    31.998       95.2933    -148.002     
1 1 1 10  10 1  o 0 563.9   13.8  ?     ?   564.782   87.7105      462.924    87.7105      55.1947    -92.2895     
1 1 1 10  10 2  o 0 647.9   14.6  ?     ?   543.224   -5.48797     554.491    -5.48797     56.1638    -5.48797     
1 1 1 10  10 3  o 0 294.9   8.2   ?     ?   430.467   -102.14      290.671    -102.14      104.025    77.8604      
1 1 1 10  10 4  o 0 236.7   7.7   ?     ?   440.358   0.298064     211.146    0.298064     203.11     -179.702     
1 1 1 10  10 5  o 0 595.8   12.9  ?     ?   476.209   -66.5729     584.393    -66.5729     142.423    -66.5729     
1 1 1 10  10 6  o 0 167.9   6.9   ?     ?   384.013   -154.022     152.423    -154.022     203.27     25.9782      
1 1 1 10  10 7  o 0 377.1   10.8  ?     ?   302.678   8.23952      494.721    8.23952      215.071    8.23952      
1 1 1 10  10 8  o 0 114.8   7.4   ?     ?   303.462   -92.1792     107.668    -92.1792     171.852    87.8208      
1 1 1 10  10 9  o 0 182.6   8.9   ?     ?   274.546   -78.6234     265.55     -78.6234     18.8198    -78.6234     
1 1 1 10  10 10 o 0 295.2   12.2  ?     ?   353.055   160.105      371.687    160.105      55.7046    160.105      
1 1 1 10  10 11 o 0 288.3   10.7  ?     ?   473.913   126.248      273.489    126.248      152.393    -53.7522     
1 1 1 10  10 12 o 0 897.2   21.1  ?     ?   558.635   -33.4209     757.215    -33.4209     257.777    -33.4209     
1 1 1 10  10 13 f 1 222.2   11.1  ?     ?   341.129   -10.0324     332.225    -10.0324     11.9459    169.968      
1 1 1 10  10 14 o 0 23.5    10.1  ?     ?   127.254   -74.1033     4.94391    -74.1033     119.787    105.897      
1 1 1 10  10 15 o 0 46.8    10.6  ?     ?   186.324   103.678      80.0498    103.678      101.373    -76.3215     
1 1 1 10  10 16 o 0 217.3   14.5  ?     ?   263.621   -34.8297     408.716    -34.8297     158.108    -34.8297     
1 1 1 10  10 17 o 0 23.5    15.1  ?     ?   28.7237   -6.12669     18.9044    -6.12669     7.52069    173.873      
1 1 1 10  10 18 o 0 -0.3    17.6  ?     ?   140.237   142.463      36.7327    -37.5368     165.197    -37.5368     
1 1 1 10  10 19 o 0 12.7    20.9  ?     ?   142.98    11.7821      6.42955    11.7821      124.58     -168.218     
1 1 1 10  10 20 o 0 106.9   20.8  ?     ?   229.754   -109.798     229.654    -109.798     3.15711    -109.798     
1 1 1 10  10 21 < 1 -86.4   23.2  ?     ?   ?         ?            98.0328    -148.862     ?          ?            
1 1 1 10  10 22 o 0 6.5     27.7  ?     ?   13.7328   31.7801      14.9118    31.7801      2.25023    31.7801      
1 1 1 10  10 23 o 0 38.6    25.7  ?     ?   52.9049   -115.212     133.899    -115.212     86.1364    -115.212     
1 1 1 10  10 24 < 0 -34.9   27.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 12 22 < 0 17      22.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 12 21 o 0 19.2    18.9  ?     ?   87.794    -43.5585     71.4304    -43.5585     3.84919    136.441      
1 1 1 -10 12 20 o 0 198.6   20.2  ?     ?   335.691   -20.3378     313.982    -20.3378     23.7506    -20.3378     
1 1 1 -10 12 19 o 0 80.4    16    ?     ?   161.864   -55.405      220.218    -55.405      76.9902    -55.405      
1 1 1 -10 12 18 o 0 65.3    15.4  ?     ?   140.195   47.7056      188.585    47.7056      56.2063    47.7056      
1 1 1 -10 12 17 o 0 24.2    13.6  ?     ?   286.68    151.616      77.9596    -28.3845     349.119    -28.3845     
1 1 1 -10 12 16 o 0 36.7    10.4  ?     ?   187.338   -67.091      62.9674    -67.091      101.696    112.909      
1 1 1 -10 12 15 o 0 197.9   11.6  ?     ?   352.338   -96.0538     294.04     -96.0538     15.5097    83.9462      
1 1 1 -10 12 14 o 0 299.1   11.7  ?     ?   335.438   175.585      455.579    175.585      159.688    175.585      
1 1 1 -10 12 13 o 0 22.2    8     ?     ?   52.9297   -34.0691     26.9717    -34.0691     20.0604    145.931      
1 1 1 -10 12 12 o 0 399.9   13.3  ?     ?   257.356   42.0591      639.345    42.0591      403.219    42.0591      
1 1 1 -10 12 11 o 0 68.5    7.1   ?     ?   90.6298   26.6239      164.3      26.6239      79.1963    26.6239      
1 1 1 -10 12 10 f 1 8       5.5   ?     ?   57.8767   175.611      30.077     -4.38891     85.0248    -4.38891     
1 1 1 -10 12 9  o 0 25.4    6.1   ?     ?   115.875   -94.9058     0.77172    85.0942      112.762    85.0942      
1 1 1 -10 12 8  f 1 239.7   8     ?     ?   190.287   147.453      464.73     147.453      278.979    147.453      
1 1 1 -10 12 7  o 0 417.5   10.8  ?     ?   305.125   94.9427      613.371    94.9427      315.755    94.9427      
1 1 1 -10 12 6  f 1 96.4    5.7   ?     ?   403.268   -22.2485     19.2845    -22.2485     332.218    157.751      
1 1 1 -10 12 5  o 0 283.6   8     ?     ?   511.051   -20.1043     229.183    -20.1043     215.465    159.896      
1 1 1 -10 12 4  o 0 1136.9  23.6  ?     ?   712.097   -53.3487     768.514    -53.3487     147.191    -53.3487     
1 1 1 -10 12 3  o 0 129.3   6     ?     ?   360.987   3.43278      118.891    3.43278      196.814    -176.567     
1 1 1 -10 12 2  o 0 393.6   10.5  ?     ?   438.01    12.1511      409.94     12.1511      29.4993    12.1511      
1 1 1 -10 12 1  o 0 75.3    5.4   ?     ?   195.916   -25.5109     80.7185    -25.5109     89.6801    154.489      
1 1 1 10  12 0  o 0 92.7    5.7   ?     ?   204.228   51.7069      120.281    51.7069      58.0839    -128.293     
1 1 1 10  12 1  o 0 133.7   6.2   ?     ?   429.709   89.219       67.7802    89.219       307.512    -90.781      
1 1 1 10  12 2  o 0 63.4    5.3   ?     ?   389.455   -135.464     56.5428    44.5355      396.532    44.5355      
1 1 1 10  12 3  o 0 526.4   12.7  ?     ?   534.338   62.8326      470.13     62.8326      0.00701462 -117.167     
1 1 1 10  12 4  o 0 249.8   8.5   ?     ?   148.523   90.9345      425.798    90.9345      295.297    90.9345      
1 1 1 10  12 5  o 0 446.7   11.9  ?     ?   623.141   -160.138     318.627    -160.138     227.897    19.8615      
1 1 1 10  12 6  f 1 36.2    6.9   ?     ?   84.3924   85.3635      12.7383    85.3635      61.4854    -94.6365     
1 1 1 10  12 7  o 0 60.2    7.1   ?     ?   12.9413   -2.73832     21.5234    -2.73832     8.7738     -2.73832     
1 1 1 10  12 8  f 1 153.2   8.7   ?     ?   208.255   -51.0117     311.372    -51.0117     105.833    -51.0117     
1 1 1 10  12 9  o 0 141     9.7   ?     ?   358.408   130.629      168.025    130.629      182.554    -49.3712     
1 1 1 10  12 10 f 1 310.5   13.6  ?     ?   398.29    -102.377     411.546    -102.377     28.4554    -102.377     
1 1 1 10  12 11 o 0 160.9   13.5  ?     ?   276.632   -114.395     286.259    -114.395     22.8226    -114.395     
1 1 1 10  12 12 o 0 88.2    12.5  ?     ?   216.614   -107.612     189.332    -107.612     12.4228    72.3878      
1 1 1 10  12 13 o 0 21.4    12.5  ?     ?   147.091   -59.3534     12.1134    -59.3534     120.7      120.647      
1 1 1 10  12 14 o 0 37.3    12.6  ?     ?   209.187   -120.202     43.3998    -120.202     145.001    59.7975      
1 1 1 10  12 15 o 0 58.7    14.6  ?     ?   207.014   15.4528      120.101    15.4528      65.0787    -164.547     
1 1 1 10  12 16 o 0 19.3    15.6  ?     ?   113.686   -22.601      25.7337    -22.601      76.1098    157.399      
1 1 1 10  12 17 o 0 0       17.5  ?     ?   56.9332   -56.0497     0.121587   -56.0497     54.8165    123.95       
1 1 1 10  12 18 o 0 130.3   20.9  ?     ?   247.424   -89.479      256.748    -89.479      18.1664    -89.479      
1 1 1 10  12 19 o 0 263.1   23.1  ?     ?   378.664   -107.338     379.355    -107.338     36.8481    -107.338     
1 1 1 10  12 20 o 0 121.2   29.1  ?     ?   210.757   -116.757     264.166    -116.757     77.7206    -116.757     
1 1 1 10  12 21 o 0 101     26.5  ?     ?   191.679   -88.3683     237.221    -88.3683     68.8824    -88.3683     
1 1 1 10  12 22 < 0 91.1    26.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 14 18 < 0 21.7    17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 14 17 o 0 23.4    14.4  ?     ?   137.665   -88.2176     49.7953    -88.2176     66.0384    91.7824      
1 1 1 -10 14 16 o 0 10.3    14.2  ?     ?   52.1474   -158.836     20.0536    -158.836     24.8       21.1644      
1 1 1 -10 14 15 o 0 -2.5    10.4  ?     ?   44.7529   -120.538     13.7634    59.4618      53.4083    59.4618      
1 1 1 -10 14 14 o 0 98.8    13.1  ?     ?   273.895   -77.3455     165.24     -77.3455     87.848     102.654      
1 1 1 -10 14 13 o 0 137     11.8  ?     ?   167.476   -153.523     335.038    -153.523     179.127    -153.523     
1 1 1 -10 14 12 o 0 241     13    ?     ?   350.327   158.164      355.09     158.164      29.1179    158.164      
1 1 1 -10 14 11 o 0 151.1   10.6  ?     ?   257.766   170.982      283.794    170.982      61.408     170.982      
1 1 1 -10 14 10 f 1 205.8   9.5   ?     ?   214.529   125.231      405.896    125.231      220.366    125.231      
1 1 1 -10 14 9  o 0 79.2    7.6   ?     ?   218.879   175.645      166.756    175.645      22.6095    -4.3554      
1 1 1 -10 14 8  o 0 72.3    7.3   ?     ?   224.359   -128.17      145.841    -128.17      48.5099    51.8302      
1 1 1 -10 14 7  o 0 29.4    6.2   ?     ?   112.72    -86.3873     65.1559    -86.3873     32.9302    93.6127      
1 1 1 -10 14 6  o 0 55      6.9   ?     ?   51.8654   63.8058      124.371    63.8058      79.0563    63.8058      
1 1 1 -10 14 5  o 0 9.2     6     ?     ?   69.3437   148.76       24.428     -31.2397     86.7809    -31.2397     
1 1 1 -10 14 4  o 0 285.5   9.8   ?     ?   444.174   -113.76      335.116    -113.76      65.5036    66.2399      
1 1 1 -10 14 3  o 0 21.5    5.9   ?     ?   149.427   16.5464      8.06582    16.5464      127.057    -163.454     
1 1 1 -10 14 2  o 0 127.1   7.9   ?     ?   290.665   31.9627      213.76     31.9627      49.6347    -148.037     
1 1 1 -10 14 1  o 0 175.7   8.2   ?     ?   227.942   169.635      352.42     169.635      145.526    169.635      
1 1 1 10  14 0  o 0 193.1   8.1   ?     ?   306.936   -148.807     321.071    -148.807     40.6448    -148.807     
1 1 1 10  14 1  o 0 76.1    7.4   ?     ?   107.49    -50.6787     210.152    -50.6787     111.978    -50.6787     
1 1 1 10  14 2  o 0 67.6    8.5   ?     ?   167.962   32.0399      165.516    32.0399      12.2302    32.0399      
1 1 1 10  14 3  o 0 164.8   10.3  ?     ?   314.525   -73.7461     265.605    -73.7461     21.0868    106.254      
1 1 1 10  14 4  o 0 214.5   9.9   ?     ?   372.927   -95.8511     297.85     -95.8511     41.5027    84.1489      
1 1 1 10  14 5  o 0 113     8.5   ?     ?   219.872   43.5641      239.799    43.5641      40.1524    43.5641      
1 1 1 10  14 6  o 0 24.8    9     ?     ?   120.632   81.2603      38.7949    81.2603      67.7334    -98.7397     
1 1 1 10  14 7  o 0 -1.2    8.3   ?     ?   119.269   -159.078     65.741     20.9219      170.738    20.9219      
1 1 1 10  14 8  o 0 4.8     10.4  ?     ?   150.449   -96.8546     58.4335    83.1454      190.404    83.1454      
1 1 1 10  14 9  o 0 126.4   11.1  ?     ?   263.803   130.596      238.546    130.596      7.21845    130.596      
1 1 1 10  14 10 f 1 37.4    12    ?     ?   129.192   177.19       97.587     177.19       16.7574    -2.8096      
1 1 1 10  14 11 o 0 0.2     11.5  ?     ?   126.269   85.0046      47.3733    -94.9954     157.997    -94.9954     
1 1 1 10  14 12 o 0 58.6    13.4  ?     ?   165.011   -65.3331     152.715    -65.3331     3.34769    114.667      
1 1 1 10  14 13 o 0 -5.2    17.4  ?     ?   51.8196   -52.421      1.46479    127.579      50.5454    127.579      
1 1 1 10  14 14 o 0 0.4     11.9  ?     ?   96.462    80.0924      22.5886    -99.9076     110.303    -99.9076     
1 1 1 10  14 15 o 0 39.7    18.8  ?     ?   62.4652   127.857      106.416    127.857      50.0112    127.857      
1 1 1 10  14 16 o 0 119.4   24.6  ?     ?   290.729   -177.192     200.829    -177.192     50.9864    2.80751      
1 1 1 10  14 17 o 0 -0.9    20.4  ?     ?   119.283   -154.301     17.1342    -154.301     85.5986    25.6987      
1 1 1 10  14 18 < 0 11.3    23.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 16 14 < 0 31.7    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 16 13 < 0 17.5    13.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 16 12 o 0 23.1    14.1  ?     ?   98.8502   -119.083     73.8431    -119.083     7.56967    60.9169      
1 1 1 -10 16 11 o 0 34      12.1  ?     ?   131.013   137.362      95.6863    137.362      12.6941    -42.6376     
1 1 1 -10 16 10 f 1 37.8    11.9  ?     ?   66.2432   -30.2378     119.04     -30.2378     62.8849    -30.2378     
1 1 1 -10 16 9  o 0 65.1    11.5  ?     ?   258.928   -163.639     105.3      -163.639     114.32     16.3613      
1 1 1 -10 16 8  o 0 158     13.6  ?     ?   313.96    -130.935     253.052    -130.935     20.3382    49.0654      
1 1 1 -10 16 7  o 0 116.5   12.4  ?     ?   206.341   12.335       261.411    12.335       80.8809    12.335       
1 1 1 -10 16 6  o 0 238.8   14.9  ?     ?   236.566   -14.6263     436.173    -14.6263     221.074    -14.6263     
1 1 1 -10 16 5  o 0 357.6   13.4  ?     ?   363.559   55.7571      482.103    55.7571      150.288    55.7571      
1 1 1 -10 16 4  o 0 89.1    9.1   ?     ?   231.661   -19.3767     180.054    -19.3767     32.0769    160.623      
1 1 1 -10 16 3  o 0 57.4    10    ?     ?   120.84    53.9356      172.268    53.9356      62.1294    53.9356      
1 1 1 -10 16 2  o 0 79.6    9.8   ?     ?   136.973   146.965      225.14     146.965      100.004    146.965      
1 1 1 -10 16 1  o 0 62      9     ?     ?   72.0381   -130.456     191.981    -130.456     126.043    -130.456     
1 1 1 10  16 0  o 0 127.1   9.9   ?     ?   272.278   -80.1134     230.057    -80.1134     21.3542    99.8866      
1 1 1 10  16 1  o 0 165.2   10.5  ?     ?   193.311   -71.515      364.942    -71.515      186.558    -71.515      
1 1 1 10  16 2  o 0 13.8    9.8   ?     ?   64.6872   -142.799     10.9964    -142.799     48.632     37.201       
1 1 1 10  16 3  o 0 236     13.4  ?     ?   280.809   16.7687      403.755    16.7687      145.3      16.7687      
1 1 1 10  16 4  o 0 463.2   16.5  ?     ?   424.256   41.6216      550.001    41.6216      157.367    41.6216      
1 1 1 10  16 5  o 0 194.2   13.3  ?     ?   312.563   16.2503      310.937    16.2503      22.3776    16.2503      
1 1 1 10  16 6  o 0 -0.6    12.6  ?     ?   9.79025   106.005      1.25746    -73.9952     10.2696    -73.9952     
1 1 1 10  16 7  o 0 81.1    14.1  ?     ?   196.699   175.026      190.117    175.026      15.7393    175.026      
1 1 1 10  16 8  o 0 280.8   18.7  ?     ?   365.664   -124.3       395.648    -124.3       72.727     -124.3       
1 1 1 10  16 9  o 0 18.6    11.1  ?     ?   39.4186   111.206      33.6253    111.206      0.312321   -68.7943     
1 1 1 10  16 10 f 1 261.9   19.2  ?     ?   275.974   84.601       443.08     84.601       205.403    84.601       
1 1 1 10  16 11 o 0 249.2   18.6  ?     ?   163.244   141.522      514.53     141.522      377.211    141.522      
1 1 1 10  16 12 o 0 -3.7    21.9  ?     ?   103.716   -50.8306     23.4726    -50.8306     63.4654    129.169      
1 1 1 10  16 13 < 0 23.9    23    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  16 14 < 0 20.3    22.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 18 6  < 0 59.2    14.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 18 5  < 0 129.8   14.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 18 4  < 0 127.8   15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 18 3  < 1 182.8   16.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 18 2  < 0 60.6    15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -10 18 1  < 1 47.4    14.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 0  < 0 192.9   15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 1  < 1 53.2    12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 2  < 0 108.3   15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 3  < 1 17.7    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 4  < 0 7.2     14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 5  < 0 7.8     16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 10  18 6  < 0 84.3    16.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 1  29 < 0 -21     19.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 1  28 o 0 28.8    15.3  ?     ?   207.141   173.705      24.4809    173.705      168.569    -6.29547     
1 1 1 -11 1  27 o 0 116.1   19.6  ?     ?   270.813   -128.554     232.591    -128.554     25.5979    51.4455      
1 1 1 -11 1  26 o 0 174.7   16    ?     ?   330.661   -55.47       288.284    -55.47       48.739     124.53       
1 1 1 -11 1  25 o 0 20.9    14.7  ?     ?   55.0727   -79.6788     41.9292    -79.6788     14.4068    100.321      
1 1 1 -11 1  24 f 1 125.2   14.2  ?     ?   172.888   -77.9544     322.34     -77.9544     158.256    -77.9544     
1 1 1 -11 1  23 o 0 3.6     11.9  ?     ?   82.15     -24.3112     25.9304    155.689      104.009    155.689      
1 1 1 -11 1  22 o 0 190.9   11.7  ?     ?   187.573   171.4        440.001    171.4        255.346    171.4        
1 1 1 -11 1  21 o 0 218     13.1  ?     ?   302.93    30.8467      368.65     30.8467      57.0187    30.8467      
1 1 1 -11 1  20 o 0 298.6   11.4  ?     ?   306.908   -17.1295     427.768    -17.1295     145.579    -17.1295     
1 1 1 -11 1  19 o 0 221.6   9.7   ?     ?   430.086   111.431      219.384    111.431      176.059    -68.5689     
1 1 1 -11 1  18 o 0 89      7.6   ?     ?   63.3075   -127.281     77.7615    -127.281     19.0689    -127.281     
1 1 1 -11 1  17 o 0 1167.8  23.6  ?     ?   707.931   -60.679      837.056    -60.679      161.48     -60.679      
1 1 1 -11 1  16 o 0 73.9    7.8   ?     ?   319.872   -5.62428     1.98623    174.376      305.057    174.376      
1 1 1 -11 1  15 o 0 5492.1  92.1  ?     ?   1643.07   140.674      1726.39    140.674      158.738    140.674      
1 1 1 -11 1  14 o 0 546.5   12.3  ?     ?   337.234   -38.3672     657.403    -38.3672     329.274    -38.3672     
1 1 1 -11 1  13 o 0 1871.6  35.8  ?     ?   1054.72   95.3528      903.443    95.3528      129.009    -84.6472     
1 1 1 -11 1  12 o 0 572     11.5  ?     ?   696.391   175.572      400.116    175.572      312.965    -4.42839     
1 1 1 -11 1  11 o 0 244.3   5.7   ?     ?   339.782   -114.268     333.991    -114.268     15.6901    65.7317      
1 1 1 -11 1  10 o 0 37.5    2.2   ?     ?   281.494   85.5812      92.8159    -94.4188     390.498    -94.4188     
1 1 1 -11 1  9  o 0 188.7   4.4   ?     ?   391.288   38.2875      207.168    38.2875      204.662    -141.712     
1 1 1 -11 1  8  f 1 1880.2  32.4  ?     ?   1076.24   -95.4591     995.034    -95.4591     147.309    84.5409      
1 1 1 -11 1  7  o 0 120.7   3.5   ?     ?   162.498   -72.5526     185.745    -72.5526     26.8214    -72.5526     
1 1 1 -11 1  6  o 0 869.1   16    ?     ?   485.385   -104.089     841.297    -104.089     365.675    -104.089     
1 1 1 -11 1  4  o 0 1504.1  26.6  ?     ?   962.279   166.44       795.489    166.44       111.895    -13.5598     
1 1 1 -11 1  3  o 0 2950.9  63.8  ?     ?   1297.86   -157.353     1147.91    -157.353     48.0708    22.647       
1 1 1 -11 1  2  o 0 2622.1  63.8  ?     ?   1205.66   -65.2639     1095.42    -65.2639     14.796     114.736      
1 1 1 -11 1  1  o 0 3814.3  128   ?     ?   1604.54   -77.8244     1163.19    -77.8244     284.978    102.176      
1 1 1 11  1  1  o 0 1875.2  33    ?     ?   842.6     -122.955     1055.89    -122.955     297.54     -122.955     
1 1 1 11  1  2  o 0 584.2   11    ?     ?   498.714   -30.4046     549.565    -30.4046     89.6804    -30.4046     
1 1 1 11  1  3  o 0 515.1   11.2  ?     ?   743.859   155.081      274.467    155.081      414.307    -24.9192     
1 1 1 11  1  4  o 0 389.6   7.9   ?     ?   524.383   -37.5136     345.091    -37.5136     153        142.486      
1 1 1 11  1  5  o 0 1584    28.5  ?     ?   1020.26   -138.761     794.098    -138.761     176.408    41.2387      
1 1 1 11  1  6  o 0 503.4   10.1  ?     ?   488.017   -117.632     518.572    -117.632     35.3712    -117.632     
1 1 1 11  1  7  o 0 860     16.7  ?     ?   695.782   -169.988     648.014    -169.988     40.2789    10.012       
1 1 1 11  1  8  f 1 1145.4  21.2  ?     ?   714.759   39.3527      904.881    39.3527      136.855    39.3527      
1 1 1 11  1  9  o 0 2659.1  53.3  ?     ?   1108.05   72.5433      1388.56    72.5433      207.05     72.5433      
1 1 1 11  1  10 o 0 1128    29.2  ?     ?   762.933   -24.9692     834.655    -24.9692     16.6936    -24.9692     
1 1 1 11  1  11 o 0 195.5   6.9   ?     ?   317.3     171.923      275.798    171.923      55.4876    -8.07714     
1 1 1 11  1  12 o 0 1589.6  29.7  ?     ?   693.7     117.473      1184.29    117.473      463.157    117.473      
1 1 1 11  1  13 o 0 1507.7  28.5  ?     ?   813.155   125.509      948.287    125.509      139.633    125.509      
1 1 1 11  1  14 o 0 554.2   13.2  ?     ?   901.524   -179.937     159.832    -179.937     731.938    0.0634345    
1 1 1 11  1  15 o 0 622.6   17.6  ?     ?   545.72    76.6767      561.589    76.6767      31.8767    76.6767      
1 1 1 11  1  16 o 0 288.7   15.9  ?     ?   267.566   45.6948      418.2      45.6948      160.094    45.6948      
1 1 1 11  1  17 o 0 1411.4  31.9  ?     ?   663.321   -160.394     1050.01    -160.394     405.047    -160.394     
1 1 1 11  1  18 o 0 796.3   22.1  ?     ?   534.097   -137.946     747.194    -137.946     242.277    -137.946     
1 1 1 11  1  19 o 0 154.6   14    ?     ?   296.065   136.898      226.939    136.898      53.2979    -43.1016     
1 1 1 11  1  20 o 0 25.5    13.3  ?     ?   166.998   -32.2945     26.9833    147.706      204.06     147.706      
1 1 1 11  1  21 o 0 -6.6    15.8  ?     ?   138.27    -75.5714     79.8879    104.429      222.756    104.429      
1 1 1 11  1  22 o 0 373.7   20    ?     ?   394.168   -93.8289     540.948    -93.8289     143.922    -93.8289     
1 1 1 11  1  23 o 0 52.5    20.2  ?     ?   172.046   136.635      121.764    136.635      45.6971    -43.3652     
1 1 1 11  1  24 f 1 218.4   26.2  ?     ?   269.76    94.2321      422.177    94.2321      159.737    94.2321      
1 1 1 11  1  25 o 0 475.6   28.4  ?     ?   474.756   88.7842      586.512    88.7842      88.2076    88.7842      
1 1 1 11  1  26 o 0 29.5    25.1  ?     ?   61.898    45.0421      86.0204    45.0421      21.2222    45.0421      
1 1 1 11  1  27 o 0 292.1   31    ?     ?   360.079   -108.931     461.95     -108.931     108.991    -108.931     
1 1 1 11  1  28 o 0 48.2    29    ?     ?   119.401   -80.7044     147.71     -80.7044     33.1764    -80.7044     
1 1 1 -11 3  28 o 0 76.2    19.7  ?     ?   217.429   -31.7358     176.246    -31.7358     23.8856    148.264      
1 1 1 -11 3  27 o 0 12.6    17.2  ?     ?   99.9998   -77.5501     40.5705    -77.5501     52.3927    102.45       
1 1 1 -11 3  26 o 0 35      17.9  ?     ?   147.899   148.893      84.5933    148.893      59.3717    -31.1072     
1 1 1 -11 3  25 o 0 44.4    13.5  ?     ?   106.081   148.615      147.144    148.615      39.8614    148.615      
1 1 1 -11 3  24 o 0 130.9   13.1  ?     ?   240.167   -176.285     283.094    -176.285     56.8557    -176.285     
1 1 1 -11 3  23 o 0 7.4     11.6  ?     ?   72.8807   -152.81      15.12      27.1905      83.6501    27.1905      
1 1 1 -11 3  22 o 0 97.1    11.9  ?     ?   159.139   124.384      260.734    124.384      105.686    124.384      
1 1 1 -11 3  21 f 1 87.1    10    ?     ?   189.313   -119.291     204.731    -119.291     14.3109    -119.291     
1 1 1 -11 3  20 o 0 193.4   9.9   ?     ?   345.461   -105.069     288.86     -105.069     66.3466    74.9314      
1 1 1 -11 3  19 f 1 242.4   10.1  ?     ?   357.703   -97.3345     311.605    -97.3345     18.8019    82.6655      
1 1 1 -11 3  18 o 0 313.4   12.5  ?     ?   302.756   160.211      441.054    160.211      162.841    160.211      
1 1 1 -11 3  17 o 0 1587.9  34.8  ?     ?   798.712   148.949      1001.59    148.949      245.777    148.949      
1 1 1 -11 3  16 f 1 1369.7  26.3  ?     ?   819.622   -176.503     858.772    -176.503     73.0416    -176.503     
1 1 1 -11 3  15 o 0 616     14.1  ?     ?   578.495   124.463      513.423    124.463      34.3753    -55.5367     
1 1 1 -11 3  14 o 0 870     17.5  ?     ?   498.375   -14.7646     791.91     -14.7646     310.396    -14.7646     
1 1 1 -11 3  13 o 0 381.9   9.6   ?     ?   232.943   88.958       553.651    88.958       327.107    88.958       
1 1 1 -11 3  12 o 0 1732.5  46.2  ?     ?   703.079   64.079       1223.65    64.079       499.352    64.079       
1 1 1 -11 3  11 o 0 436.5   9     ?     ?   387.759   115.61       544.7      115.61       147.764    115.61       
1 1 1 -11 3  10 o 0 38.4    2.8   ?     ?   176.754   -158.952     29.6672    21.0479      211.545    21.0479      
1 1 1 -11 3  9  o 0 312     6.8   ?     ?   418.125   -2.22876     375.101    -2.22876     67.0954    177.771      
1 1 1 -11 3  8  o 0 347.1   7.1   ?     ?   400.2     -109.621     443.353    -109.621     22.0086    -109.621     
1 1 1 -11 3  7  o 0 880.6   15.9  ?     ?   734.707   158.703      670.307    158.703      106.045    -21.2975     
1 1 1 -11 3  6  o 0 1467.6  26.2  ?     ?   889.526   -65.9263     873.281    -65.9263     2.38199    -65.9263     
1 1 1 -11 3  5  o 0 166     3.8   ?     ?   423.818   -78.1835     126.367    -78.1835     289.598    101.816      
1 1 1 -11 3  4  o 0 1656.9  28.9  ?     ?   896.575   26.1572      981.417    26.1572      99.8563    26.1572      
1 1 1 -11 3  3  o 0 1291.8  26.7  ?     ?   685.466   -14.4542     923.925    -14.4542     275.553    -14.4542     
1 1 1 -11 3  2  o 0 1155.3  28.4  ?     ?   467.774   96.8373      1028.54    96.8373      585.836    96.8373      
1 1 1 11  3  0  o 0 5509.4  169.6 ?     ?   1244.7    -165.618     2084.75    -165.618     919.676    -165.618     
1 1 1 11  3  1  o 0 320     6.1   ?     ?   415.13    -128.47      350.506    -128.47      39.3007    51.5296      
1 1 1 11  3  2  o 0 2168.6  37.3  ?     ?   1127.22   -74.1684     988.061    -74.1684     73.6913    105.832      
1 1 1 11  3  3  o 0 1077.1  19.1  ?     ?   936.984   10.7732      554.394    10.7732      330.43     -169.227     
1 1 1 11  3  4  o 0 567.6   11.1  ?     ?   556.806   -44.2265     518.146    -44.2265     29.9985    135.773      
1 1 1 11  3  5  o 0 1628.8  29    ?     ?   1053.73   -84.7641     815.984    -84.7641     222.061    95.2359      
1 1 1 11  3  6  o 0 687.9   14.1  ?     ?   453.161   -79.4753     722.69     -79.4753     276.413    -79.4753     
1 1 1 11  3  7  o 0 249.9   5.9   ?     ?   420.359   -110.437     287.812    -110.437     159.803    69.5634      
1 1 1 11  3  8  o 0 1154.7  26.5  ?     ?   678.621   -54.7002     946.355    -54.7002     225.221    -54.7002     
1 1 1 11  3  9  o 0 286.6   8.9   ?     ?   639.333   123.429      126.02     123.429      557.371    -56.5707     
1 1 1 11  3  10 o 0 474.5   11.4  ?     ?   499.78    51.9382      494.485    51.9382      25.9448    -128.062     
1 1 1 11  3  11 o 0 2725.1  49.2  ?     ?   1026.41   36.1102      1444.63    36.1102      380.124    36.1102      
1 1 1 11  3  12 o 0 1832.5  35.8  ?     ?   894.288   -124.639     1050.54    -124.639     163.047    -124.639     
1 1 1 11  3  13 o 0 1216.1  24.6  ?     ?   617.598   -72.7447     945.488    -72.7447     335.704    -72.7447     
1 1 1 11  3  14 o 0 375.7   14.4  ?     ?   686.319   -118.411     180.43     -118.411     484.655    61.5891      
1 1 1 11  3  15 o 0 502.9   16.5  ?     ?   465.874   35.6105      512.672    35.6105      63.9347    35.6105      
1 1 1 11  3  16 f 1 450.1   15.7  ?     ?   606.745   -103.327     345.33     -103.327     246.879    76.6734      
1 1 1 11  3  17 o 0 61.9    13.3  ?     ?   328.683   -93.0722     39.1347    86.9278      356.1      86.9278      
1 1 1 11  3  18 o 0 48.6    12.9  ?     ?   317.327   -35.5001     56.2241    144.5        353.67     144.5        
1 1 1 11  3  19 f 1 17      12.6  ?     ?   144.951   -56.9462     62.8454    123.054      199.545    123.054      
1 1 1 11  3  20 o 0 83.8    14.4  ?     ?   162.354   91.9748      191.872    91.9748      21.2747    91.9748      
1 1 1 11  3  21 f 1 9.4     17.1  ?     ?   96.6117   -116.625     22.3216    63.3754      121.726    63.3754      
1 1 1 11  3  22 o 0 192.1   18.6  ?     ?   232.752   169.163      409.532    169.163      177.341    169.163      
1 1 1 11  3  23 o 0 66.5    25    ?     ?   196.653   103.324      141.743    103.324      48.4935    -76.6759     
1 1 1 11  3  24 o 0 96.4    21.3  ?     ?   258.907   112.989      187.311    112.989      62.9093    -67.0113     
1 1 1 11  3  25 o 0 149.7   23.6  ?     ?   233.333   120.353      332.939    120.353      90.5917    120.353      
1 1 1 11  3  26 o 0 108.6   24.4  ?     ?   205.513   -125.989     271.301    -125.989     65.6355    -125.989     
1 1 1 11  3  27 o 0 -14.6   27.3  ?     ?   49.7459   -75.4387     26.9853    -75.4387     20.6101    104.561      
1 1 1 11  3  28 < 0 -31.2   26.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 5  28 < 0 195.3   21.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 5  27 o 0 22.6    21.4  ?     ?   142.51    -26.3434     56.2847    -26.3434     73.816     153.657      
1 1 1 -11 5  26 o 0 6.2     17.9  ?     ?   63.7079   -150.851     23.6775    -150.851     35.8369    29.1491      
1 1 1 -11 5  25 o 0 -4.4    15.3  ?     ?   57.0646   -91.8528     6.35139    88.1472      61.4393    88.1472      
1 1 1 -11 5  24 o 0 63.8    13.7  ?     ?   308.748   -82.2426     51.877     -82.2426     257.77     97.7574      
1 1 1 -11 5  23 o 0 191.6   13.1  ?     ?   276.686   -49.3401     363.575    -49.3401     105.12     -49.3401     
1 1 1 -11 5  22 o 0 34.9    11.2  ?     ?   75.173    -102.015     86.1692    -102.015     16.0808    -102.015     
1 1 1 -11 5  21 o 0 39      9     ?     ?   45.2888   -4.34402     66.8699    -4.34402     23.1215    -4.34402     
1 1 1 -11 5  20 o 0 87.1    9.7   ?     ?   239.97    -103.585     166.651    -103.585     71.4222    76.4153      
1 1 1 -11 5  19 o 0 188.9   9     ?     ?   277.905   18.1936      337.554    18.1936      54.2906    18.1936      
1 1 1 -11 5  18 o 0 156.4   9.1   ?     ?   281.787   18.7652      232.256    18.7652      24.4274    -161.235     
1 1 1 -11 5  17 o 0 233     9.8   ?     ?   331.994   91.4374      308.816    91.4374      6.43521    91.4374      
1 1 1 -11 5  16 o 0 259.8   9.1   ?     ?   416.866   154.92       269.859    154.92       121.087    -25.0803     
1 1 1 -11 5  15 f 1 1029    27.3  ?     ?   597.278   -53.3399     830.78     -53.3399     263.373    -53.3399     
1 1 1 -11 5  14 o 0 990.4   20.1  ?     ?   716.935   -18.4719     678.544    -18.4719     5.85238    -18.4719     
1 1 1 -11 5  13 o 0 704.3   18.7  ?     ?   587.282   54.0631      580.534    54.0631      25.6824    54.0631      
1 1 1 -11 5  12 o 0 310.5   11.9  ?     ?   533.539   150.477      229.583    150.477      284.448    -29.5232     
1 1 1 -11 5  11 o 0 66.7    4.9   ?     ?   299.273   -128.712     7.37782    51.2882      297.44     51.2882      
1 1 1 -11 5  10 o 0 1965.4  40.4  ?     ?   1119.47   20.3847      946.762    20.3847      188.188    -159.615     
1 1 1 -11 5  9  o 0 170.5   6.1   ?     ?   256.093   85.554       266.759    85.554       5.81556    85.554       
1 1 1 -11 5  8  o 0 1454.5  26.2  ?     ?   836.051   147.515      942.945    147.515      87.2062    147.515      
1 1 1 -11 5  7  o 0 226.6   5.3   ?     ?   407.201   -177.046     248.322    -177.046     170.128    2.9539       
1 1 1 -11 5  6  o 0 233.9   5.1   ?     ?   451.82    91.1517      225.744    91.1517      250.838    -88.8483     
1 1 1 -11 5  5  o 0 174.5   4.6   ?     ?   189.351   -111.748     311.801    -111.748     113.242    -111.748     
1 1 1 -11 5  4  o 0 1072.1  19.3  ?     ?   815.341   141.399      737.115    141.399      119.738    -38.6006     
1 1 1 -11 5  3  f 1 814.5   14.5  ?     ?   553.235   172.71       788.833    172.71       203.54     172.71       
1 1 1 -11 5  2  o 0 1188.5  21.6  ?     ?   878.428   -151.368     760.581    -151.368     164.845    28.6321      
1 1 1 11  5  0  o 0 230.3   5.3   ?     ?   359.316   -44.6283     281.531    -44.6283     65.6025    135.372      
1 1 1 11  5  1  o 0 71.4    3.7   ?     ?   235.9     94.1357      51.9027    94.1357      195.324    -85.8643     
1 1 1 11  5  2  o 0 1352    24.4  ?     ?   704.134   -147.564     1047.74    -147.564     308.552    -147.564     
1 1 1 11  5  3  f 1 326.7   6.8   ?     ?   446.485   -42.6439     370.712    -42.6439     100.976    137.356      
1 1 1 11  5  4  o 0 68.9    2.8   ?     ?   92.7301   83.089       58.1574    83.089       39.3618    -96.911      
1 1 1 11  5  5  o 0 51.4    3.2   ?     ?   351.062   146.673      90.8585    -33.3273     460.002    -33.3273     
1 1 1 11  5  6  o 0 734.2   15.5  ?     ?   555.964   63.8655      711.845    63.8655      122.668    63.8655      
1 1 1 11  5  7  o 0 905.1   16.5  ?     ?   546.202   -59.8488     848.784    -59.8488     283.855    -59.8488     
1 1 1 11  5  8  o 0 871.8   16.7  ?     ?   618.43    -63.5125     750.241    -63.5125     112.085    -63.5125     
1 1 1 11  5  9  o 0 1060.6  21.9  ?     ?   573.93    163.521      937.204    163.521      346.73     163.521      
1 1 1 11  5  10 o 0 800.3   16.2  ?     ?   648.336   82.0018      647.899    82.0018      24.7492    -97.9982     
1 1 1 11  5  11 o 0 360.8   11.3  ?     ?   477.075   146.327      346.634    146.327      121.528    -33.6733     
1 1 1 11  5  12 o 0 75.6    7.1   ?     ?   276.797   15.5241      31.2367    15.5241      239.105    -164.476     
1 1 1 11  5  13 o 0 475.4   13.9  ?     ?   601.241   26.9009      364.119    26.9009      212.409    -153.099     
1 1 1 11  5  14 o 0 312     14    ?     ?   581.986   -17.2515     193.946    -17.2515     360.916    162.749      
1 1 1 11  5  15 f 1 629     17.8  ?     ?   408.903   41.6161      690.409    41.6161      295.27     41.6161      
1 1 1 11  5  16 o 0 800.6   19.6  ?     ?   683.732   21.9802      611.159    21.9802      28.1924    -158.02      
1 1 1 11  5  17 o 0 785.3   19.6  ?     ?   401.052   37.9961      835.792    37.9961      463.438    37.9961      
1 1 1 11  5  18 o 0 561.9   18.4  ?     ?   647.89    -158.373     429.541    -158.373     172.684    21.6273      
1 1 1 11  5  19 o 0 -5.2    15.5  ?     ?   53.6929   52.1122      34.4449    -127.888     90.3484    -127.888     
1 1 1 11  5  20 o 0 76.1    15.4  ?     ?   186.899   51.4671      176.759    51.4671      12.8395    -128.533     
1 1 1 11  5  21 o 0 368.9   20.8  ?     ?   432.746   -118.228     488.16     -118.228     60.2765    -118.228     
1 1 1 11  5  22 o 0 223     20.1  ?     ?   370.703   -114.043     343.187    -114.043     10.9586    65.957       
1 1 1 11  5  23 o 0 30.7    18.8  ?     ?   113.54    29.0423      73.7074    29.0423      35.0781    -150.958     
1 1 1 11  5  24 o 0 136.4   27.6  ?     ?   195.144   88.8531      330.612    88.8531      129.655    88.8531      
1 1 1 11  5  25 o 0 1.9     24.9  ?     ?   55.8727   17.5155      28.6007    17.5155      26.8416    -162.485     
1 1 1 11  5  26 o 0 49      21.8  ?     ?   150.08    -9.19806     129.507    -9.19806     14.7639    170.802      
1 1 1 11  5  27 o 0 14.2    28.8  ?     ?   82.7734   88.2215      85.5877    88.2215      7.74185    88.2215      
1 1 1 -11 7  26 o 0 22.5    14.5  ?     ?   106.581   -159.214     73.6472    -159.214     22.0762    20.7855      
1 1 1 -11 7  25 o 0 66.2    17.6  ?     ?   128.593   -115.756     208.535    -115.756     90.3632    -115.756     
1 1 1 -11 7  24 o 0 152.7   19.2  ?     ?   117.43    119.948      419.066    119.948      307.56     119.948      
1 1 1 -11 7  23 o 0 54.5    12    ?     ?   196.043   -121.393     122.863    -121.393     70.5091    58.6071      
1 1 1 -11 7  22 f 1 60.2    13.4  ?     ?   149.92    -115.707     168.129    -115.707     29.7045    -115.707     
1 1 1 -11 7  21 o 0 39.5    10.3  ?     ?   137.668   -61.6937     102.578    -61.6937     24.1058    118.306      
1 1 1 -11 7  20 f 1 112.9   11.2  ?     ?   268.605   -74.3114     219.082    -74.3114     30.9377    105.689      
1 1 1 -11 7  19 o 0 41.4    8.5   ?     ?   260.012   -146.971     20.3154    -146.971     229.014    33.0293      
1 1 1 -11 7  18 o 0 53.3    8.8   ?     ?   264.834   -82.5055     47.1546    -82.5055     213.514    97.4945      
1 1 1 -11 7  17 o 0 146.4   9.9   ?     ?   222.542   -99.2985     297.591    -99.2985     72.6804    -99.2985     
1 1 1 -11 7  16 o 0 413.3   12.6  ?     ?   592.268   -61.3289     319.561    -61.3289     215.044    118.671      
1 1 1 -11 7  15 o 0 106     7.7   ?     ?   218.131   -56.4066     149.857    -56.4066     46.8881    123.593      
1 1 1 -11 7  14 o 0 154.6   8.5   ?     ?   303.713   98.4206      185.681    98.4206      96.196     -81.5794     
1 1 1 -11 7  13 o 0 82.6    6.6   ?     ?   239.219   0.878045     68.6847    0.878045     154.909    -179.122     
1 1 1 -11 7  12 o 0 280.3   8.7   ?     ?   399.795   -34.2562     307.455    -34.2562     73.2561    145.744      
1 1 1 -11 7  11 o 0 81.2    5.2   ?     ?   219.645   -107.79      68.5499    -107.79      136.366    72.2098      
1 1 1 -11 7  10 o 0 2109.1  40.6  ?     ?   1023.78   54.0914      1034.44    54.0914      73.9185    54.0914      
1 1 1 -11 7  9  o 0 1468.1  29.2  ?     ?   727.72    76.3231      966.916    76.3231      271.597    76.3231      
1 1 1 -11 7  8  o 0 99.9    3.6   ?     ?   363.335   -127.137     30.9543    -127.137     317.803    52.8632      
1 1 1 -11 7  7  o 0 1171.3  21.7  ?     ?   547.756   124.873      956.969    124.873      429.052    124.873      
1 1 1 -11 7  6  o 0 344.6   7.2   ?     ?   478.228   93.2696      345.794    93.2696      135.351    -86.7304     
1 1 1 -11 7  5  o 0 832.4   15.4  ?     ?   783.457   -15.6175     542.872    -15.6175     247.669    164.383      
1 1 1 -11 7  4  o 0 928.2   22.2  ?     ?   832.022   41.8774      572.869    41.8774      268.64     -138.123     
1 1 1 -11 7  3  o 0 1445    34.4  ?     ?   854.325   2.39381      909.206    2.39381      43.618     2.39381      
1 1 1 -11 7  2  f 1 320.1   9     ?     ?   629.423   -118.354     171.721    -118.354     470.045    61.6456      
1 1 1 -11 7  1  o 0 368.2   7.7   ?     ?   429.976   -5.84323     422.109    -5.84323     14.3422    174.157      
1 1 1 11  7  0  f 1 3274.3  58    ?     ?   1155.82   -139.796     1511.36    -139.796     336.24     -139.796     
1 1 1 11  7  1  o 0 881.2   21.5  ?     ?   653.026   -77.1104     710.521    -77.1104     49.1705    -77.1104     
1 1 1 11  7  2  f 1 267.3   6.2   ?     ?   423.707   -33.7431     290.216    -33.7431     141.457    146.257      
1 1 1 11  7  3  o 0 12.7    2.4   ?     ?   147.352   165.099      102.987    -14.901      252.395    -14.901      
1 1 1 11  7  4  o 0 363.8   8     ?     ?   506.407   106.925      346.755    106.925      166.633    -73.0746     
1 1 1 11  7  5  o 0 1380.6  26.1  ?     ?   1040.22   -142.99      685.172    -142.99      368.605    37.0095      
1 1 1 11  7  6  o 0 124.1   5.4   ?     ?   454.309   134.904      16.8334    134.904      442.776    -45.0959     
1 1 1 11  7  7  o 0 260.3   8.4   ?     ?   303.414   44.112       354.477    44.112       59.9843    44.112       
1 1 1 11  7  8  o 0 356.5   8.8   ?     ?   379.306   -19.5799     419.267    -19.5799     52.0586    -19.5799     
1 1 1 11  7  9  o 0 1093.7  20.8  ?     ?   615.884   55.1609      845.397    55.1609      251.044    55.1609      
1 1 1 11  7  10 o 0 1804.7  38.9  ?     ?   844.869   -145.018     1058.37    -145.018     256.674    -145.018     
1 1 1 11  7  11 o 0 49.1    8.1   ?     ?   327.607   118.842      79.9954    -61.1576     389.522    -61.1576     
1 1 1 11  7  12 o 0 704.4   19    ?     ?   551.131   70.5451      625.571    70.5451      93.3975    70.5451      
1 1 1 11  7  13 o 0 1188.4  29.1  ?     ?   552.626   151.55       983.757    151.55       459.353    151.55       
1 1 1 11  7  14 o 0 90.8    9.7   ?     ?   359.817   126.771      33.6136    126.771      298.753    -53.2292     
1 1 1 11  7  15 o 0 11.2    10.6  ?     ?   132.421   -100.542     81.5702    79.4576      203.112    79.4576      
1 1 1 11  7  16 o 0 226.9   14.2  ?     ?   232.628   -91.4453     379.772    -91.4453     165.853    -91.4453     
1 1 1 11  7  17 o 0 192.9   13.1  ?     ?   185.676   38.8727      416.5      38.8727      225.115    38.8727      
1 1 1 11  7  18 o 0 51.5    14    ?     ?   282.828   -62.7214     24.3905    -62.7214     259.836    117.279      
1 1 1 11  7  19 o 0 19.6    15.5  ?     ?   137.902   -59.7771     3.76252    -59.7771     131.398    120.223      
1 1 1 11  7  20 f 1 139.9   17    ?     ?   216.39    149.025      321.932    149.025      115.838    149.025      
1 1 1 11  7  21 o 0 110.9   16.9  ?     ?   227.337   105.518      248.106    105.518      33.8193    105.518      
1 1 1 11  7  22 f 1 -22.2   20.5  ?     ?   188.388   38.6341      87.4527    -141.366     265.818    -141.366     
1 1 1 11  7  23 o 0 27.1    20.1  ?     ?   152.525   117.173      48.5642    117.173      107.035    -62.8265     
1 1 1 11  7  24 o 0 170.7   35.3  ?     ?   113.339   89.2888      451.536    89.2888      340.938    89.2888      
1 1 1 11  7  25 o 0 47.1    25    ?     ?   132.626   -66.574      132.942    -66.574      9.18677    -66.574      
1 1 1 11  7  26 o 0 0.9     25.8  ?     ?   115.257   -4.99619     39.0405    -4.99619     67.5774    175.004      
1 1 1 -11 9  25 < 0 63.9    21.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 9  24 o 0 43.9    14.9  ?     ?   182.874   179.112      103.769    179.112      58.4048    -0.887973    
1 1 1 -11 9  23 o 0 275.1   21.3  ?     ?   325.684   -150.384     445.105    -150.384     149.745    -150.384     
1 1 1 -11 9  22 o 0 16.3    12.7  ?     ?   142.121   -45.0944     8.69534    -45.0944     124.408    134.906      
1 1 1 -11 9  21 o 0 15.9    14.1  ?     ?   95.3883   -7.85298     22.1464    -7.85298     70.6012    172.147      
1 1 1 -11 9  20 o 0 288.4   16.2  ?     ?   428.74    25.3692      364.35     25.3692      23.644     -154.631     
1 1 1 -11 9  19 o 0 144.7   12.3  ?     ?   263.989   149.39       282        149.39       42.8273    149.39       
1 1 1 -11 9  18 o 0 2.8     9.9   ?     ?   56.3263   -106.541     21.5361    73.459       72.8576    73.459       
1 1 1 -11 9  17 o 0 123.9   9.8   ?     ?   337.769   -23.9047     174.962    -23.9047     143.505    156.095      
1 1 1 -11 9  16 o 0 19.8    9     ?     ?   164.004   -26.7052     28.6803    153.295      187.291    153.295      
1 1 1 -11 9  15 f 1 593.3   15.5  ?     ?   503.12    114.777      627.83     114.777      126.014    114.777      
1 1 1 -11 9  14 o 0 121.8   7.1   ?     ?   386.059   89.5068      86.659     89.5068      255.232    -90.4932     
1 1 1 -11 9  13 o 0 103     6.9   ?     ?   7.42731   55.2487      16.9796    55.2487      10.3547    55.2487      
1 1 1 -11 9  12 o 0 176.9   7.7   ?     ?   452.616   129.634      126.367    129.634      276.539    -50.366      
1 1 1 -11 9  11 o 0 22.6    5.5   ?     ?   119.411   -35.0724     43.5801    144.928      150.539    144.928      
1 1 1 -11 9  10 o 0 61.1    5.2   ?     ?   203.092   -68.797      24.1648    -68.797      162.683    111.203      
1 1 1 -11 9  9  o 0 730     17.8  ?     ?   607.491   -40.8385     585.414    -40.8385     23.5997    -40.8385     
1 1 1 -11 9  8  o 0 807.8   26.1  ?     ?   908.239   151.487      372.082    151.487      482.025    -28.513      
1 1 1 -11 9  7  o 0 248.7   8.5   ?     ?   316.813   172.34       315.204    172.34       23.8952    172.34       
1 1 1 -11 9  6  o 0 71.7    3.6   ?     ?   236.226   -54.7297     37.4987    -54.7297     180.497    125.27       
1 1 1 -11 9  5  o 0 1737.4  31.5  ?     ?   856.361   -167.05      987.801    -167.05      195.099    -167.05      
1 1 1 -11 9  4  o 0 417.7   13.6  ?     ?   290.954   100.175      539.913    100.175      266.341    100.175      
1 1 1 -11 9  3  o 0 881     19.5  ?     ?   545.712   79.3005      739.377    79.3005      225.241    79.3005      
1 1 1 -11 9  2  o 0 1990.5  36.2  ?     ?   1034.68   14.0351      948.263    14.0351      27.9874    -165.965     
1 1 1 -11 9  1  o 0 310.1   10.9  ?     ?   617.756   -6.51293     150.642    -6.51293     432.798    173.487      
1 1 1 11  9  0  o 0 26.1    3     ?     ?   174.718   51.3511      70.2973    -128.649     235.321    -128.649     
1 1 1 11  9  1  o 0 7.9     2.9   ?     ?   207.036   -168.621     160.904    11.3789      356.582    11.3789      
1 1 1 11  9  2  o 0 579     14.7  ?     ?   516.44    84.2505      521.807    84.2505      33.5784    84.2505      
1 1 1 11  9  3  o 0 363.6   9.7   ?     ?   380.37    -140.851     416.658    -140.851     57.143     -140.851     
1 1 1 11  9  4  o 0 339.4   10    ?     ?   247.871   143.878      480.461    143.878      246.346    143.878      
1 1 1 11  9  5  o 0 706.9   21    ?     ?   461.359   -114.03      680.875    -114.03      251.317    -114.03      
1 1 1 11  9  6  o 0 426.3   14.2  ?     ?   302.645   155.997      541.687    155.997      260.397    155.997      
1 1 1 11  9  7  o 0 1289.5  29.7  ?     ?   635.663   52.4684      934.457    52.4684      345.005    52.4684      
1 1 1 11  9  8  o 0 49.3    6.7   ?     ?   305.123   -33.1742     65.0761    146.826      354.825    146.826      
1 1 1 11  9  9  o 0 78.4    7.5   ?     ?   299.749   -24.8423     26.4828    -24.8423     253.804    155.158      
1 1 1 11  9  10 o 0 232.7   9.1   ?     ?   133.51    91.7181      350.738    91.7181      226.388    91.7181      
1 1 1 11  9  11 o 0 300.8   11.9  ?     ?   515.356   -140.159     255.448    -140.159     212.45     39.8407      
1 1 1 11  9  12 o 0 1799.9  36.3  ?     ?   1213.02   -45.8447     741.221    -45.8447     354.593    134.155      
1 1 1 11  9  13 o 0 829.4   21    ?     ?   676.796   -47.6097     615.318    -47.6097     1.95239    -47.6097     
1 1 1 11  9  14 o 0 10.1    10.2  ?     ?   18.904    146.698      10.3327    -33.302      27.3623    -33.302      
1 1 1 11  9  15 f 1 279.2   13.1  ?     ?   393.174   -123.367     373.825    -123.367     25.5409    56.6332      
1 1 1 11  9  16 o 0 72.8    12.4  ?     ?   324.935   -96.8187     54.3236    -96.8187     266.064    83.1813      
1 1 1 11  9  17 o 0 69.6    14.5  ?     ?   126.976   -95.8606     196.409    -95.8606     74.2136    -95.8606     
1 1 1 11  9  18 o 0 222.7   16.8  ?     ?   260.371   2.8845       429.794    2.8845       187.384    2.8845       
1 1 1 11  9  19 o 0 222.1   18.9  ?     ?   338.625   -26.3339     357.626    -26.3339     43.7991    -26.3339     
1 1 1 11  9  20 o 0 125.7   21.2  ?     ?   186.152   -117.599     302.902    -117.599     130.389    -117.599     
1 1 1 11  9  21 o 0 -2.5    26.1  ?     ?   39.8076   149.609      15.757     149.609      23.9233    -30.3912     
1 1 1 11  9  22 o 0 -39.4   29.6  ?     ?   27.2385   -152.914     1.92894    -152.914     24.2525    27.0863      
1 1 1 11  9  23 o 0 46      32.5  ?     ?   118.813   146.358      127.555    146.358      16.8473    146.358      
1 1 1 11  9  24 o 0 193.6   31.6  ?     ?   241.99    146.059      383.435    146.059      162.7      146.059      
1 1 1 -11 11 23 < 1 -9.2    22.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 11 22 o 0 76.1    15.9  ?     ?   204.545   -157.852     182.949    -157.852     5.46979    -157.852     
1 1 1 -11 11 21 o 0 49.7    15.6  ?     ?   127.049   78.8119      149.469    78.8119      36.8042    78.8119      
1 1 1 -11 11 20 o 0 106.3   20.9  ?     ?   95.5855   -75.0622     318.299    -75.0622     230.82     -75.0622     
1 1 1 -11 11 19 o 0 1.7     14.4  ?     ?   62.8498   -160.451     2.09297    19.5491      62.2169    19.5491      
1 1 1 -11 11 18 f 1 229.2   14.8  ?     ?   405.578   121.177      294.644    121.177      96.1643    -58.8235     
1 1 1 -11 11 17 o 0 13.3    10.2  ?     ?   127.261   -15.3068     9.96501    164.693      123.384    164.693      
1 1 1 -11 11 16 o 0 7.3     9.7   ?     ?   76.7517   -76.9978     19.4713    103.002      87.8727    103.002      
1 1 1 -11 11 15 o 0 99.6    9.9   ?     ?   210.617   -60.9992     227.607    -60.9992     39.0635    -60.9992     
1 1 1 -11 11 14 o 0 11.9    8     ?     ?   94.3882   -138.125     22.3464    41.8745      109.675    41.8745      
1 1 1 -11 11 13 f 1 135.6   8.4   ?     ?   236.451   39.7854      268.794    39.7854      43.5322    39.7854      
1 1 1 -11 11 12 o 0 -1      6.2   ?     ?   152.777   125.332      115.305    -54.668      261.097    -54.668      
1 1 1 -11 11 11 o 0 271.3   9.3   ?     ?   438.631   -100.299     311.774    -100.299     116.94     79.7015      
1 1 1 -11 11 10 f 1 41.2    5.5   ?     ?   380.338   -158.895     107.104    21.1045      439.963    21.1045      
1 1 1 -11 11 9  o 0 347.6   9.6   ?     ?   356.644   -17.1436     428.511    -17.1436     116.329    -17.1436     
1 1 1 -11 11 8  o 0 275.3   7.7   ?     ?   389.748   -138.679     318.533    -138.679     24.2698    41.3214      
1 1 1 -11 11 7  o 0 129     5.7   ?     ?   384.079   139.329      93.341     139.329      242.984    -40.6714     
1 1 1 -11 11 6  o 0 158.4   5.5   ?     ?   321.941   31.0094      190.197    31.0094      92.7827    -148.991     
1 1 1 -11 11 5  o 0 28.9    4.2   ?     ?   154.95    -51.8372     38.3184    128.163      174.962    128.163      
1 1 1 -11 11 4  o 0 854     17.2  ?     ?   709.889   -138.128     595.773    -138.128     31.9751    41.8718      
1 1 1 -11 11 3  o 0 876.1   19.6  ?     ?   678.358   -106.605     623.197    -106.605     9.18721    -106.605     
1 1 1 -11 11 2  o 0 204.9   6.8   ?     ?   428.37    22.6567      174.227    22.6567      214.191    -157.343     
1 1 1 -11 11 1  f 1 157.5   6.2   ?     ?   130.253   -139.699     222.316    -139.699     103.452    -139.699     
1 1 1 11  11 0  f 1 1379.1  27.2  ?     ?   803.527   45.0705      839.564    45.0705      103.978    45.0705      
1 1 1 11  11 1  f 1 666.2   14.5  ?     ?   541.683   119.743      577.773    119.743      81.7768    119.743      
1 1 1 11  11 2  o 0 223.6   6.9   ?     ?   330.647   -138.156     274.983    -138.156     26.167     41.8443      
1 1 1 11  11 3  o 0 249.3   7.9   ?     ?   311       -56.2922     324.297    -56.2922     41.2267    -56.2922     
1 1 1 11  11 4  o 0 154.9   6.6   ?     ?   210.562   36.602       246.503    36.602       59.0546    36.602       
1 1 1 11  11 5  o 0 91.5    6.4   ?     ?   147.897   -159.603     124.961    -159.603     6.48836    20.3967      
1 1 1 11  11 6  o 0 57.1    6.3   ?     ?   101.964   168.835      39.8845    168.835      50.5494    -11.1649     
1 1 1 11  11 7  o 0 748.1   16.9  ?     ?   799.428   -137.789     439.415    -137.789     267.755    42.2115      
1 1 1 11  11 8  o 0 28.5    6.8   ?     ?   82.3882   -9.49897     4.61236    170.501      77.9007    170.501      
1 1 1 11  11 9  o 0 797.5   19.2  ?     ?   548.664   176.966      686.401    176.966      200.115    176.966      
1 1 1 11  11 10 f 1 93.6    8.5   ?     ?   117.704   107.154      214.029    107.154      96.1251    107.154      
1 1 1 11  11 11 o 0 182.7   10.8  ?     ?   252.713   -29.305      337.374    -29.305      86.7016    -29.305      
1 1 1 11  11 12 o 0 25.9    9.9   ?     ?   110.345   37.8624      19.9928    37.8624      86.9938    -142.138     
1 1 1 11  11 13 f 1 29.2    11.1  ?     ?   150.245   5.56341      21.3916    5.56341      124.201    -174.437     
1 1 1 11  11 14 o 0 31.4    13.4  ?     ?   100.902   -98.9378     57.8905    -98.9378     37.1732    81.0622      
1 1 1 11  11 15 o 0 33.3    18.2  ?     ?   104.855   6.08911      72.5732    6.08911      23.1167    -173.911     
1 1 1 11  11 16 o 0 160.1   17    ?     ?   276.577   -84.0389     299.261    -84.0389     47.7069    -84.0389     
1 1 1 11  11 17 o 0 16.8    18.4  ?     ?   231.32    -142.315     45.3474    37.6847      255.977    37.6847      
1 1 1 11  11 18 f 1 120.4   17.7  ?     ?   227.449   -143.475     263.642    -143.475     39.4794    -143.475     
1 1 1 11  11 19 o 0 50.8    22.6  ?     ?   200.294   -97.607      86.4424    -97.607      109.747    82.393       
1 1 1 11  11 20 o 0 72      26.1  ?     ?   179.116   -106.715     167.094    -106.715     0.935238   73.2851      
1 1 1 11  11 21 o 0 42      27    ?     ?   104.69    -158.003     127.902    -158.003     33.8785    -158.003     
1 1 1 11  11 22 o 0 8.2     26.1  ?     ?   98.8472   140.548      59.0629    140.548      29.0458    -39.4519     
1 1 1 -11 13 20 < 0 24.4    20.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 13 19 o 0 142.7   17.5  ?     ?   215.64    107.314      313.087    107.314      129.844    107.314      
1 1 1 -11 13 18 o 0 30.3    15.8  ?     ?   127.521   140.081      74.4566    140.081      36.1646    -39.9187     
1 1 1 -11 13 17 o 0 106.8   15.5  ?     ?   227.498   128.073      226.03     128.073      22.5968    128.073      
1 1 1 -11 13 16 o 0 29      11.6  ?     ?   164.332   45.6733      44.2424    45.6734      109.176    -134.327     
1 1 1 -11 13 15 o 0 5.8     11.3  ?     ?   14.8687   -171.474     1.00576    8.52624      14.8994    8.52624      
1 1 1 -11 13 14 o 0 115.8   11.4  ?     ?   147.885   -171.153     308.997    -171.153     174.478    -171.153     
1 1 1 -11 13 13 o 0 15.6    8.6   ?     ?   94.0373   -50.3931     9.33026    -50.3931     72.8667    129.607      
1 1 1 -11 13 12 o 0 58      8     ?     ?   190.877   136.591      130.004    136.591      36.5421    -43.4086     
1 1 1 -11 13 11 o 0 168.9   9.3   ?     ?   284.271   -153.161     302.081    -153.161     53.3781    -153.161     
1 1 1 -11 13 10 o 0 187.8   8.8   ?     ?   263.386   134.556      352.114    134.556      120.304    134.556      
1 1 1 -11 13 9  o 0 59.3    6.9   ?     ?   183.494   136.957      131.891    136.957      34.6361    -43.0434     
1 1 1 -11 13 8  o 0 80.9    6.9   ?     ?   220.209   -151.537     166.734    -151.537     34.1086    28.4634      
1 1 1 -11 13 7  o 0 19.6    5.2   ?     ?   149.308   -14.5601     16.1831    165.44       155.295    165.44       
1 1 1 -11 13 6  o 0 332.6   10    ?     ?   398.701   41.5288      432.483    41.5288      59.5299    41.5288      
1 1 1 -11 13 5  o 0 35.4    5.4   ?     ?   58.0168   -123.253     48.9068    -123.253     5.55259    56.7474      
1 1 1 -11 13 4  o 0 127.3   6.4   ?     ?   299.486   -154.38      187.063    -154.38      99.9118    25.6197      
1 1 1 -11 13 3  o 0 54.5    6     ?     ?   275.421   115.436      25.3987    115.436      239.178    -64.5643     
1 1 1 -11 13 2  o 0 500.6   12.7  ?     ?   384.664   52.1274      626.637    52.1274      256.371    52.1274      
1 1 1 -11 13 1  f 1 6.6     5.6   ?     ?   194.486   -46.6711     135.341    133.329      323.802    133.329      
1 1 1 11  13 0  o 0 55.3    5.7   ?     ?   43.2005   171.361      57.6579    171.361      15.7631    171.361      
1 1 1 11  13 1  f 1 375.5   10.5  ?     ?   338.609   6.88011      530.998    6.88011      200.979    6.88011      
1 1 1 11  13 2  o 0 109.4   7.1   ?     ?   216.331   66.7688      212.941    66.7688      3.296      66.7688      
1 1 1 11  13 3  o 0 588.2   14.4  ?     ?   345.503   -157.893     751.266    -157.893     416.782    -157.893     
1 1 1 11  13 4  o 0 435.4   15.8  ?     ?   422.072   -120.669     525.661    -120.669     117.656    -120.669     
1 1 1 11  13 5  o 0 30      6.9   ?     ?   140.889   79.6569      34.9798    79.6569      98.5747    -100.343     
1 1 1 11  13 6  o 0 26.3    7.2   ?     ?   67.4077   -143.823     25.5352    -143.823     38.2078    36.1775      
1 1 1 11  13 7  o 0 54.4    9.7   ?     ?   53.8275   -54.5047     93.0779    -54.5047     42.3254    -54.5047     
1 1 1 11  13 8  o 0 138.6   10.1  ?     ?   172.746   10.8042      328.893    10.8042      169.282    10.8042      
1 1 1 11  13 9  o 0 38.2    10.8  ?     ?   201.726   138.315      49.028     138.315      136.633    -41.6851     
1 1 1 11  13 10 o 0 11.2    9.8   ?     ?   127.953   -122.817     26.7574    57.1826      141.084    57.1826      
1 1 1 11  13 11 o 0 197.6   13    ?     ?   306.303   -99.6033     336.205    -99.6033     63.8574    -99.6033     
1 1 1 11  13 12 o 0 10.7    12.9  ?     ?   161.451   -119.108     35.477     60.8921      178.797    60.8921      
1 1 1 11  13 13 o 0 109.1   16    ?     ?   134.862   -133.32      292.893    -133.32      172.834    -133.32      
1 1 1 11  13 14 o 0 103.4   16.4  ?     ?   175.209   -142.927     264.631    -142.927     96.3845    -142.927     
1 1 1 11  13 15 o 0 37.5    16.8  ?     ?   47.5833   63.117       84.7164    63.117       39.3353    63.117       
1 1 1 11  13 16 o 0 94.2    20.7  ?     ?   199.785   146.031      214.741    146.031      24.1692    146.031      
1 1 1 11  13 17 o 0 59.3    18.7  ?     ?   135.872   151.572      169.328    151.572      47.647     151.572      
1 1 1 11  13 18 o 0 49.6    19.8  ?     ?   170.487   -167.512     116.353    -167.512     33.1038    12.4881      
1 1 1 11  13 19 o 0 23.3    22.8  ?     ?   106.564   -77.5964     78.9779    -77.5964     13.8418    102.404      
1 1 1 11  13 20 < 0 86.5    26.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 15 16 < 0 157.1   17.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 15 15 o 0 29.9    15.4  ?     ?   155.963   -97.4866     63.1102    -97.4866     66.3361    82.5134      
1 1 1 -11 15 14 o 0 1.1     14.1  ?     ?   46.8851   130.847      8.52639    130.847      30.614     -49.153      
1 1 1 -11 15 13 f 1 51.8    13.1  ?     ?   153.143   125.394      143.228    125.394      12.0366    125.394      
1 1 1 -11 15 12 o 0 334.3   18.5  ?     ?   290.088   -158.704     521.776    -158.704     267.476    -158.704     
1 1 1 -11 15 11 f 1 144.8   12.8  ?     ?   148.048   141.451      355.162    141.451      219.27     141.451      
1 1 1 -11 15 10 o 0 -6.4    10.2  ?     ?   84.0459   -94.1256     38.5882    85.8744      115.811    85.8744      
1 1 1 -11 15 9  o 0 201.7   10.4  ?     ?   317.223   -112.817     320.637    -112.817     29.7023    -112.817     
1 1 1 -11 15 8  o 0 126.1   9.1   ?     ?   187.612   -16.2581     296.899    -16.2581     123.944    -16.2581     
1 1 1 -11 15 7  o 0 5.7     8.1   ?     ?   41.4652   -70.5384     11.3857    109.462      46.7642    109.462      
1 1 1 -11 15 6  o 0 2.8     7.4   ?     ?   105.675   -61.2155     46.5094    118.785      137.051    118.785      
1 1 1 -11 15 5  f 1 17.3    7.1   ?     ?   199.99    -104.109     32.7622    75.891       205.632    75.891       
1 1 1 -11 15 4  o 0 87.9    7.4   ?     ?   372.707   -112.735     67.5149    -112.735     251.242    67.2646      
1 1 1 -11 15 3  o 0 70.3    8     ?     ?   130.952   1.43487      193.944    1.43487      81.6397    1.43487      
1 1 1 -11 15 2  o 0 30.7    8.2   ?     ?   186.676   75.7681      38.119     75.7681      122.339    -104.232     
1 1 1 -11 15 1  f 1 9.4     8.6   ?     ?   83.7932   -109.338     17.9393    70.6619      90.4653    70.6619      
1 1 1 11  15 0  f 1 133.5   9.6   ?     ?   176.513   -87.3176     312.28     -87.3176     158.214    -87.3176     
1 1 1 11  15 1  f 1 48.8    7.6   ?     ?   33.7969   -44.9779     80.6725    -44.9779     51.1868    -44.9779     
1 1 1 11  15 2  o 0 31.8    7.6   ?     ?   130.703   -1.56827     71.3953    -1.56827     41.9511    178.432      
1 1 1 11  15 3  o 0 61.1    8.8   ?     ?   234.848   27.1643      107.037    27.1643      96.352     -152.836     
1 1 1 11  15 4  o 0 36      9.3   ?     ?   50.6241   -107.618     70.8857    -107.618     27.1215    -107.618     
1 1 1 11  15 5  f 1 47.6    8.9   ?     ?   134.203   14.8447      132.111    14.8447      14.7416    14.8447      
1 1 1 11  15 6  o 0 27.4    10.8  ?     ?   118.54    -37.7792     55.7881    -37.7792     47.0718    142.221      
1 1 1 11  15 7  o 0 99.7    11.2  ?     ?   303.049   -137.096     147.742    -137.096     114.38     42.904       
1 1 1 11  15 8  o 0 28.2    12.2  ?     ?   205.063   -153.015     8.41809    -153.015     183.414    26.9846      
1 1 1 11  15 9  o 0 172.8   14.9  ?     ?   258.692   20.4933      326.142    20.4933      85.1461    20.4933      
1 1 1 11  15 10 o 0 95.8    15.3  ?     ?   213.467   76.3306      210.348    76.3306      10.9198    76.3306      
1 1 1 11  15 11 f 1 20.4    16.7  ?     ?   125.387   -81.5074     36.2041    -81.5074     76.9926    98.4926      
1 1 1 11  15 12 o 0 -26.3   19.1  ?     ?   151.048   -34.2757     60.543     145.724      195.45     145.724      
1 1 1 11  15 13 f 1 2.3     18.6  ?     ?   115.287   -5.92631     4.41352    -5.92631     96.3102    174.074      
1 1 1 11  15 14 o 0 82.9    18.3  ?     ?   165.786   179.52       220.172    179.52       78.8773    179.52       
1 1 1 11  15 15 o 0 78.7    26.4  ?     ?   181.257   -106.824     174.51     -106.824     20.7683    -106.824     
1 1 1 11  15 16 < 0 -13.7   21.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 17 11 < 0 0.1     14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 17 10 < 0 35.5    14.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -11 17 9  o 0 60.1    15.8  ?     ?   128.596   -90.9626     181.827    -90.9626     77.7927    -90.9626     
1 1 1 -11 17 8  o 0 27.1    12.1  ?     ?   61.8882   69.6797      95.9031    69.6797      45.5667    69.6797      
1 1 1 -11 17 7  o 0 206.3   14.3  ?     ?   406.13    32.9619      257.838    32.9619      73.356     -147.038     
1 1 1 -11 17 6  o 0 113.7   12.9  ?     ?   149.352   59.1037      296.366    59.1037      174.035    59.1037      
1 1 1 -11 17 5  o 0 66.2    11.9  ?     ?   91.0185   28.4086      219.888    28.4086      145.044    28.4086      
1 1 1 -11 17 4  o 0 40.3    11.2  ?     ?   157.701   0.161013     102.713    0.161013     29.1305    -179.839     
1 1 1 -11 17 3  o 0 34.6    12.6  ?     ?   118.301   166.336      98.2888    166.336      0.910356   -13.6642     
1 1 1 -11 17 2  o 0 88.5    12.5  ?     ?   266.317   167.314      156.418    167.314      67.4576    -12.6863     
1 1 1 -11 17 1  o 0 12      11.3  ?     ?   173.142   -134.421     23.663     45.5792      169.511    45.5792      
1 1 1 11  17 0  o 0 24.8    10.8  ?     ?   62.228    68.5506      68.1057    68.5506      15.1246    68.5506      
1 1 1 11  17 1  o 0 75.3    12    ?     ?   203.581   79.336       174.977    79.336       1.77371    79.336       
1 1 1 11  17 2  o 0 68.4    12.7  ?     ?   205.186   57.6672      154.926    57.6672      19.4382    -122.333     
1 1 1 11  17 3  o 0 230     15    ?     ?   240.189   44.9004      426.966    44.9004      223.187    44.9004      
1 1 1 11  17 4  o 0 299.6   16.9  ?     ?   329.859   -8.33518     446.413    -8.33518     167.138    -8.33518     
1 1 1 11  17 5  o 0 275.2   16.5  ?     ?   326.833   -47.6867     421.79     -47.6867     149.378    -47.6867     
1 1 1 11  17 6  o 0 -5.8    11.1  ?     ?   25.1951   -35.3396     4.29175    144.66       25.2287    144.66       
1 1 1 11  17 7  o 0 25.2    15.2  ?     ?   116.265   119.937      67.1381    119.937      29.1422    -60.0628     
1 1 1 11  17 8  o 0 19.9    16.9  ?     ?   82.6265   9.53482      69.7263    9.53482      1.41867    9.53482      
1 1 1 11  17 9  < 0 67.4    16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 11  17 10 < 0 23.9    13.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 11  17 11 < 0 36.5    21.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 0  29 < 0 -24.5   23.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 0  28 o 0 -10.3   22.2  ?     ?   131.574   180          42.1026    180          80.581     3.66615e-15  
1 1 1 -12 0  27 o 0 104.9   30.2  ?     ?   138.288   180          227.893    180          96.0043    180          
1 1 1 -12 0  26 o 0 201.7   22.3  ?     ?   186.861   0            343.498    0            153.001    0            
1 1 1 -12 0  25 o 0 48.2    24.9  ?     ?   137.072   180          130.668    180          9.55908    9.59152e-14  
1 1 1 -12 0  24 o 0 23.8    14.2  ?     ?   57.7078   0            34.5519    0            19.9332    180          
1 1 1 -12 0  23 o 0 19.6    11.5  ?     ?   94.7071   180          44.1661    180          45.828     6.76226e-15  
1 1 1 -12 0  22 o 0 -19.8   11    ?     ?   33.6665   180          1.74559    180          31.3848    3.90263e-16  
1 1 1 -12 0  21 f 1 15.7    10    ?     ?   135.159   0            31.7679    0            107.912    180          
1 1 1 -12 0  20 o 0 74.1    12    ?     ?   85.5694   0            90.3592    0            11.738     0            
1 1 1 -12 0  19 o 0 337.7   16    ?     ?   504.079   180          407.882    180          59.2323    4.83181e-14  
1 1 1 -12 0  18 o 0 -1      9.1   ?     ?   185.67    0            6.63189    0            165.315    180          
1 1 1 -12 0  17 o 0 4.6     8.1   ?     ?   169.592   0            7.63746    0            153.993    180          
1 1 1 -12 0  16 f 1 139     10.5  ?     ?   34.5984   180          52.6329    180          19.7336    180          
1 1 1 -12 0  15 o 0 432.9   14.3  ?     ?   530.277   180          463.636    180          41.4007    7.85784e-14  
1 1 1 -12 0  14 o 0 2856.7  81    ?     ?   1164.05   0            1198.08    0            67.7855    0            
1 1 1 -12 0  13 o 0 103.4   6.4   ?     ?   177.272   0            169.306    0            3.81435    180          
1 1 1 -12 0  12 o 0 671.8   27.5  ?     ?   622.895   180          618.396    180          17.7097    2.45014e-13  
1 1 1 -12 0  11 o 0 21.9    5.7   ?     ?   143.831   0            37.1039    0            110.462    180          
1 1 1 -12 0  10 o 0 28.3    3.8   ?     ?   108.021   0            39.1745    0            74.6583    180          
1 1 1 -12 0  9  f 1 1032.9  31.3  ?     ?   917.986   180          794.096    180          173.168    3.21765e-14  
1 1 1 -12 0  8  o 0 313.4   10.8  ?     ?   411.876   180          438.316    180          5.35904    180          
1 1 1 -12 0  7  f 1 63.4    3     ?     ?   69.0566   0            52.0649    0            15.4681    180          
1 1 1 -12 0  6  o 0 32.9    1.9   ?     ?   290.571   0            93.2562    0            189.796    180          
1 1 1 -12 0  5  o 0 1731.1  43    ?     ?   679.178   180          918.454    180          282.482    180          
1 1 1 -12 0  4  o 0 1512.2  37.4  ?     ?   764.994   180          858.164    180          142.103    180          
1 1 1 -12 0  3  o 0 285.1   11    ?     ?   345.475   180          362.394    180          46.5511    180          
1 1 1 -12 0  2  o 0 59.6    2     ?     ?   31.5029   180          21.3497    180          7.42447    2.01772e-14  
1 1 1 -12 0  1  o 0 1534.6  37.7  ?     ?   720.812   180          843.52     180          185.221    180          
1 1 1 12  0  0  o 0 465.5   12.2  ?     ?   865.33    -180         456.279    180          319.789    4.76951e-14  
1 1 1 12  0  1  o 0 254.4   7.4   ?     ?   515.294   180          344.878    180          127.8      1.89351e-14  
1 1 1 12  0  2  o 0 418.6   12.2  ?     ?   577.08    0            444.166    0            87.1653    180          
1 1 1 12  0  3  o 0 3737.1  90.3  ?     ?   1317.69   0            1331.15    0            113.709    0            
1 1 1 12  0  4  o 0 1033.9  26.9  ?     ?   960.191   0            718.307    0            191.471    180          
1 1 1 12  0  5  o 0 1324.9  33    ?     ?   972.681   180          814.238    180          108.661    5.25787e-14  
1 1 1 12  0  6  o 0 229     8.5   ?     ?   351.77    0            349.888    0            2.43454    0            
1 1 1 12  0  7  f 1 302     9.6   ?     ?   561.993   180          404.382    180          153.176    1.8524e-14   
1 1 1 12  0  8  o 0 2116.1  53.2  ?     ?   998.945   0            1156.74    0            90.9657    0            
1 1 1 12  0  9  f 1 516.5   21.3  ?     ?   595.39    0            570.046    0            66.9728    180          
1 1 1 12  0  10 o 0 -0.2    9.2   ?     ?   141.816   180          5.66942    180          142.743    2.78688e-16  
1 1 1 12  0  11 o 0 1811.7  47.6  ?     ?   770.69    180          1037.3     180          233.617    180          
1 1 1 12  0  12 o 0 406.1   15    ?     ?   221.694   180          481.579    180          251.341    180          
1 1 1 12  0  13 o 0 1167.8  36.5  ?     ?   711.142   180          784.156    180          77.4625    180          
1 1 1 12  0  14 o 0 826.2   27.1  ?     ?   685.988   0            656.22     0            22.0143    180          
1 1 1 12  0  15 o 0 703     27.8  ?     ?   433.079   0            601.792    0            181.525    0            
1 1 1 12  0  16 f 1 275.7   23.2  ?     ?   307.504   0            379.218    0            73.0266    0            
1 1 1 12  0  17 o 0 304.5   24.7  ?     ?   752.254   180          400.688    180          330.887    8.49687e-15  
1 1 1 12  0  18 o 0 829.7   32.6  ?     ?   388.505   0            658.328    0            290.901    0            
1 1 1 12  0  19 o 0 5.3     18.7  ?     ?   222.626   0            25.4483    0            185.405    180          
1 1 1 12  0  20 o 0 60.8    18.9  ?     ?   209.858   0            167.34     0            55.3673    180          
1 1 1 12  0  21 f 1 147.7   27.4  ?     ?   474.215   180          299.391    180          193.624    1.08496e-14  
1 1 1 12  0  22 o 0 -25.1   28.8  ?     ?   67.7166   0            13.3344    0            54.9577    180          
1 1 1 12  0  23 o 0 -52.2   22.8  ?     ?   50.4115   0            4.99739    0            44.1417    180          
1 1 1 12  0  24 o 0 70.3    26.6  ?     ?   314.53    0            182.68     0            122.253    180          
1 1 1 12  0  25 o 0 134.3   42.6  ?     ?   126.141   0            263.31     0            130.666    0            
1 1 1 12  0  26 o 0 -12.7   46.5  ?     ?   36.4745   0            22.6784    0            14.2958    180          
1 1 1 12  0  27 o 0 52.1    40    ?     ?   111.609   180          117.728    180          8.07614    180          
1 1 1 -12 2  28 o 0 12.6    12.8  ?     ?   167.915   -89.1663     6.71457    90.8337      161.969    90.8337      
1 1 1 -12 2  27 o 0 -7.7    14.9  ?     ?   93.4008   -70.6254     20.1152    109.375      108.477    109.375      
1 1 1 -12 2  26 o 0 -13.4   14.5  ?     ?   24.3043   -56.6951     7.57106    123.305      31.3295    123.305      
1 1 1 -12 2  25 o 0 14.3    13.1  ?     ?   62.6949   -165.62      19.0765    -165.62      44.5892    14.3801      
1 1 1 -12 2  24 o 0 262.8   15.1  ?     ?   270.656   -167.479     485.313    -167.479     229.341    -167.479     
1 1 1 -12 2  23 o 0 82.4    11.4  ?     ?   151.166   100.527      235.359    100.527      92.6724    100.527      
1 1 1 -12 2  22 o 0 203     11.3  ?     ?   280.366   88.3085      383.147    88.3085      108.985    88.3085      
1 1 1 -12 2  21 o 0 46.2    8.4   ?     ?   159.935   61.7339      95.684     61.7339      64.9274    -118.266     
1 1 1 -12 2  20 o 0 140.4   10.5  ?     ?   317.147   165.987      213.334    165.987      113.854    -14.0132     
1 1 1 -12 2  19 o 0 216     11.5  ?     ?   484.333   125.681      170.447    125.681      276.057    -54.3189     
1 1 1 -12 2  18 o 0 16.8    7     ?     ?   150.298   157.327      80.4701    -22.6731     219        -22.6731     
1 1 1 -12 2  17 o 0 174.4   9.1   ?     ?   168.787   13.5977      275.525    13.5977      115.355    13.5977      
1 1 1 -12 2  16 f 1 174.6   7.6   ?     ?   134.122   -83.1095     263.991    -83.1095     133.519    -83.1095     
1 1 1 -12 2  15 f 1 1044.5  20.9  ?     ?   535.398   110.686      883.316    110.686      372.506    110.686      
1 1 1 -12 2  14 f 1 343.5   11    ?     ?   250.745   21.8627      495.146    21.8627      251.117    21.8627      
1 1 1 -12 2  13 o 0 499.6   11.2  ?     ?   650.057   110.44       339.471    110.44       293.914    -69.56       
1 1 1 -12 2  12 o 0 575.3   13.4  ?     ?   646.11    -169.045     450.36     -169.045     208.355    10.9549      
1 1 1 -12 2  11 o 0 461.2   10.6  ?     ?   483.104   -31.3766     487.495    -31.3766     7.66884    148.623      
1 1 1 -12 2  9  o 0 324.6   6.7   ?     ?   292.02    -128.622     500.885    -128.622     194.563    -128.622     
1 1 1 -12 2  8  o 0 272     5.7   ?     ?   355.041   2.92189      376.217    2.92189      2.39149    2.92189      
1 1 1 -12 2  7  o 0 112.4   3.8   ?     ?   181.229   -108.207     166.873    -108.207     9.94115    71.7927      
1 1 1 -12 2  6  o 0 425.8   9.6   ?     ?   474.381   -92.5082     441.017    -92.5082     22.9784    87.4918      
1 1 1 -12 2  5  f 1 377.4   11    ?     ?   508.657   -63.3052     353.207    -63.3052     147.811    116.695      
1 1 1 -12 2  4  f 1 1104    19.9  ?     ?   551.894   170.767      916.208    170.767      393.233    170.767      
1 1 1 -12 2  3  o 0 1748.4  35.1  ?     ?   948.554   -140.514     943.01     -140.514     48.1965    -140.514     
1 1 1 -12 2  2  o 0 3714.8  89.6  ?     ?   1509.11   -58.0661     1271.56    -58.0661     152.315    121.934      
1 1 1 -12 2  1  o 0 3186.6  77.4  ?     ?   1344.44   59.8982      1198.3     59.8982      41.7972    -120.102     
1 1 1 12  2  1  o 0 642.5   11.8  ?     ?   702.585   147.159      422.502    147.159      221.36     -32.8408     
1 1 1 12  2  2  o 0 3982.9  67.1  ?     ?   1352.97   -47.2762     1511.06    -47.2762     237.933    -47.2762     
1 1 1 12  2  3  o 0 1027.5  18.4  ?     ?   666.599   54.0962      766.279    54.0962      136.92     54.0962      
1 1 1 12  2  5  f 1 1322.7  24    ?     ?   705.248   -126.823     961.26     -126.823     262.184    -126.823     
1 1 1 12  2  6  o 0 1699.5  29.6  ?     ?   877.256   -87.5006     1027.11    -87.5006     161.849    -87.5006     
1 1 1 12  2  7  o 0 490.4   10.1  ?     ?   388.821   -67.0474     636.78     -67.0474     221.948    -67.0474     
1 1 1 12  2  8  o 0 818.6   16.2  ?     ?   550.279   -30.6468     807.439    -30.6468     221.362    -30.6468     
1 1 1 12  2  9  o 0 540.9   12.7  ?     ?   529.59    156.247      553.506    156.247      14.0256    -23.7528     
1 1 1 12  2  10 o 0 125.2   5.1   ?     ?   350.561   17.812       111.028    17.812       255.047    -162.188     
1 1 1 12  2  11 o 0 270.1   8.4   ?     ?   427.15    92.8811      300.839    92.8811      143.525    -87.1189     
1 1 1 12  2  12 o 0 157.7   6.8   ?     ?   221.114   -133.361     264.683    -133.361     35.6581    -133.361     
1 1 1 12  2  13 o 0 976.2   21    ?     ?   806.185   -113.806     604.289    -113.806     194.511    66.1936      
1 1 1 12  2  14 f 1 830.8   18.9  ?     ?   593.823   -153.935     687.426    -153.935     99.1817    -153.935     
1 1 1 12  2  15 f 1 1292.6  27.1  ?     ?   572.938   47.5674      1030.67    47.5674      473.764    47.5674      
1 1 1 12  2  16 f 1 529.2   17.3  ?     ?   127.306   -25.8088     732.919    -25.8088     608.143    -25.8088     
1 1 1 12  2  17 o 0 1772.8  37.1  ?     ?   916.069   -137.208     1018.71    -137.208     131.419    -137.208     
1 1 1 12  2  18 o 0 53.3    13.5  ?     ?   225.381   -97.6515     11.5238    -97.6515     200.71     82.3485      
1 1 1 12  2  19 o 0 132.7   15.3  ?     ?   437.032   147.55       70.2174    147.55       341.802    -32.4495     
1 1 1 12  2  20 o 0 25.8    11    ?     ?   192.975   61.1152      39.5402    -118.885     243.33     -118.885     
1 1 1 12  2  21 o 0 5.5     12.5  ?     ?   158.633   84.4416      80.5788    -95.5584     243.809    -95.5584     
1 1 1 12  2  22 o 0 113.6   17.9  ?     ?   192.68    -61.1767     283.114    -61.1767     89.8561    -61.1767     
1 1 1 12  2  23 o 0 303     22.9  ?     ?   315.619   92.1345      519.228    92.1346      213.342    92.1346      
1 1 1 12  2  24 o 0 67.5    22.4  ?     ?   253.166   99.9792      105.806    99.9792      140.293    -80.0208     
1 1 1 12  2  25 o 0 65.5    27.6  ?     ?   94.325    158.976      201.072    158.976      102.511    158.976      
1 1 1 12  2  26 o 0 110.2   27.2  ?     ?   225.141   -100.596     251.859    -100.596     25.1432    -100.596     
1 1 1 12  2  27 o 0 108.2   32.3  ?     ?   149.887   174.007      289.991    174.007      145.657    174.007      
1 1 1 12  2  28 o 0 31.3    27.2  ?     ?   92.8404   68.5941      118.039    68.5941      29.4046    68.5941      
1 1 1 -12 4  28 < 0 37.3    19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 4  27 o 0 -4.4    16.1  ?     ?   74.1078   -125.252     4.61907    -125.252     63.4592    54.7476      
1 1 1 -12 4  26 o 0 39.1    16    ?     ?   140.853   151.866      107.98     151.866      24.7075    -28.1342     
1 1 1 -12 4  25 o 0 0.7     13.9  ?     ?   79.2918   -131.64      10.5603    48.3601      90.4282    48.3601      
1 1 1 -12 4  24 o 0 14.8    13.6  ?     ?   101.928   -100.475     11.5898    -100.475     87.943     79.5253      
1 1 1 -12 4  23 o 0 17      12.5  ?     ?   112.083   114.607      8.33       114.607      96.2915    -65.3934     
1 1 1 -12 4  22 o 0 11.8    10.3  ?     ?   12.3117   -75.7859     0.225264   104.214      11.7949    104.214      
1 1 1 -12 4  21 o 0 241.6   11    ?     ?   409.943   -124.583     327.956    -124.583     71.1221    55.4169      
1 1 1 -12 4  20 o 0 590.7   16.3  ?     ?   630.308   -71.4582     519.213    -71.4582     122.089    108.542      
1 1 1 -12 4  19 o 0 112.4   8.9   ?     ?   117.084   164.28       198.636    164.28       92.1455    164.28       
1 1 1 -12 4  18 o 0 194.8   9     ?     ?   340.82    -176.72      254.677    -176.72      58.0688    3.27955      
1 1 1 -12 4  17 o 0 273.7   10.7  ?     ?   385.036   -175.252     328.442    -175.252     24.7869    4.74832      
1 1 1 -12 4  16 o 0 106.2   7     ?     ?   496.001   174.84       55.0823    -5.15983     523.544    -5.15983     
1 1 1 -12 4  15 o 0 718.9   16.9  ?     ?   723.017   -16.9115     480.867    -16.9115     215.556    163.088      
1 1 1 -12 4  14 o 0 1802.2  41.8  ?     ?   993.801   -15.5407     915.44     -15.5407     23.3764    164.459      
1 1 1 -12 4  13 o 0 1237.9  33.4  ?     ?   617.266   77.6595      936.521    77.6595      341.714    77.6595      
1 1 1 -12 4  12 o 0 2484.3  61.5  ?     ?   1193.91   76.7449      1056.23    76.7449      101.515    -103.255     
1 1 1 -12 4  11 o 0 771.8   21.3  ?     ?   668.335   -84.3986     606.827    -84.3986     71.3067    95.6014      
1 1 1 -12 4  10 o 0 3652.7  71.1  ?     ?   1451.74   11.4003      1385.31    11.4003      95.6363    -168.6       
1 1 1 -12 4  9  o 0 111.9   4.3   ?     ?   226.189   -78.0835     161.633    -78.0835     70.2354    101.917      
1 1 1 -12 4  8  o 0 1567.1  31.4  ?     ?   981.938   142.276      871.654    142.276      139.345    -37.7244     
1 1 1 -12 4  7  o 0 326.3   6.7   ?     ?   582.114   46.3551      242.01     46.3551      368.132    -133.645     
1 1 1 -12 4  6  o 0 167.4   3.9   ?     ?   304.216   126.546      238.567    126.546      81.3394    -53.4537     
1 1 1 -12 4  5  f 1 920.2   16.8  ?     ?   826.541   -81.0648     604.112    -81.0648     271.868    98.9352      
1 1 1 -12 4  4  o 0 284.3   5.7   ?     ?   362.471   -99.2858     359.923    -99.2858     6.17047    -99.2858     
1 1 1 -12 4  1  o 0 143.3   4     ?     ?   341.485   102.114      149.62     102.114      184.514    -77.8865     
1 1 1 12  4  0  f 1 1587.6  39.1  ?     ?   675.487   -73.7971     1130.58    -73.7971     472.485    -73.7971     
1 1 1 12  4  1  o 0 1425.3  25.2  ?     ?   847.583   -76.3673     880.831    -76.3672     57.2464    -76.3672     
1 1 1 12  4  2  o 0 307.9   7.2   ?     ?   357.763   -79.6568     394.508    -79.6569     46.0807    -79.6569     
1 1 1 12  4  3  o 0 170.2   4.3   ?     ?   138.045   -31.295      275.399    -31.295      140.712    -31.295      
1 1 1 12  4  4  o 0 937.6   17.1  ?     ?   693.72    -12.0766     701.432    -12.0766     23.8113    -12.0766     
1 1 1 12  4  5  f 1 68.3    2.6   ?     ?   45.46     179.734      32.7585    179.734      15.5791    -0.265766    
1 1 1 12  4  6  o 0 497.5   9.9   ?     ?   517.042   -162.345     519.307    -162.345     27.3962    17.6552      
1 1 1 12  4  7  o 0 667.1   12.9  ?     ?   460.647   -86.941      748.037    -86.941      261.585    -86.941      
1 1 1 12  4  8  o 0 1488.1  27.6  ?     ?   905.134   -108.586     908.716    -108.586     31.8876    71.4141      
1 1 1 12  4  9  o 0 318.9   8.1   ?     ?   419.905   106.482      375.403    106.482      59.7614    -73.5177     
1 1 1 12  4  10 o 0 723     14.3  ?     ?   428.683   20.2269      803.042    20.2269      360.285    20.2269      
1 1 1 12  4  11 o 0 173.5   7.4   ?     ?   204.926   53.216       292.132    53.216       78.7775    53.216       
1 1 1 12  4  12 o 0 629.9   14    ?     ?   593.775   164.485      520.053    164.485      64.4532    -15.5152     
1 1 1 12  4  13 o 0 267.5   9.9   ?     ?   341.002   -3.865       339.787    -3.865       5.81034    -3.865       
1 1 1 12  4  14 o 0 984.3   21.7  ?     ?   886.928   44.3178      533.5      44.3178      319.074    -135.682     
1 1 1 12  4  15 o 0 672.7   17.8  ?     ?   459.59    -13.1773     694.811    -13.1773     249.236    -13.1773     
1 1 1 12  4  16 o 0 526.2   16    ?     ?   714.489   -59.9003     326.101    -59.9003     362.104    120.1        
1 1 1 12  4  17 o 0 4.7     11.7  ?     ?   65.3563   155.765      45.1175    -24.2353     106.331    -24.2353     
1 1 1 12  4  18 o 0 61.2    13.4  ?     ?   164.532   -16.3482     81.083     -16.3482     73.2254    163.652      
1 1 1 12  4  19 o 0 209.6   14.4  ?     ?   281.647   111.595      380.745    111.595      84.8158    111.595      
1 1 1 12  4  20 o 0 80.6    15.9  ?     ?   244.673   86.7922      147.816    86.7922      102.71     -93.2078     
1 1 1 12  4  21 o 0 99.5    17.5  ?     ?   242.546   -130.054     208.509    -130.054     33.598     49.9464      
1 1 1 12  4  22 o 0 32.2    18.4  ?     ?   197.749   139.81       28.6625    139.81       162.091    -40.1902     
1 1 1 12  4  23 o 0 70.1    19.4  ?     ?   187.28    58.5904      174.124    58.5904      5.51918    -121.41      
1 1 1 12  4  24 o 0 144.5   24.7  ?     ?   158.466   87.7995      387.735    87.7995      222.898    87.7995      
1 1 1 12  4  25 o 0 -44.9   29.3  ?     ?   103.104   77.0013      19.2614    -102.999     126.227    -102.999     
1 1 1 12  4  26 o 0 45      29.1  ?     ?   161.198   24.9596      105.583    24.9596      51.0052    -155.04      
1 1 1 12  4  27 o 0 48.6    30.2  ?     ?   207.409   39.3623      79.3493    39.3623      117.803    -140.638     
1 1 1 -12 6  27 < 0 8.2     14.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 6  26 o 0 60.7    15.5  ?     ?   156.405   -140.469     182.846    -140.469     40.92      -140.469     
1 1 1 -12 6  25 o 0 124.9   16.7  ?     ?   211.052   -21.2279     299.166    -21.2279     102.79     -21.2279     
1 1 1 -12 6  24 f 1 51.5    12.8  ?     ?   184.676   -15.0824     122.832    -15.0824     61.8337    164.918      
1 1 1 -12 6  23 o 0 136     13.4  ?     ?   241.562   -53.2493     293.863    -53.2493     52.6585    -53.2493     
1 1 1 -12 6  22 o 0 35.6    11.9  ?     ?   128.371   -50.1217     84.9689    -50.1217     33.3561    129.878      
1 1 1 -12 6  21 o 0 17.5    9.2   ?     ?   112.556   -123.719     5.7823     -123.719     98.6547    56.281       
1 1 1 -12 6  20 o 0 170.6   10.8  ?     ?   351.126   -36.1819     258.358    -36.1819     79.1131    143.818      
1 1 1 -12 6  19 o 0 322.9   11.5  ?     ?   316.725   51.3676      517.295    51.3676      204.737    51.3676      
1 1 1 -12 6  18 o 0 425.3   12.5  ?     ?   335.053   21.7387      620.036    21.7387      280.418    21.7387      
1 1 1 -12 6  17 o 0 307.9   10.9  ?     ?   314.244   -105.475     427.756    -105.475     143.172    -105.475     
1 1 1 -12 6  16 o 0 261.8   9.5   ?     ?   283.613   -10.8207     380.005    -10.8207     123.263    -10.8207     
1 1 1 -12 6  15 o 0 774.8   17.5  ?     ?   478.933   -16.8965     735.647    -16.8965     289.358    -16.8965     
1 1 1 -12 6  14 o 0 430     11.4  ?     ?   345.891   -101.766     531.073    -101.766     206.347    -101.766     
1 1 1 -12 6  13 o 0 87.9    6     ?     ?   270.099   -7.72        62.7258    -7.72        188.928    172.28       
1 1 1 -12 6  12 o 0 908.7   21.4  ?     ?   572.59    -124.756     747.419    -124.756     210.425    -124.756     
1 1 1 -12 6  11 f 1 379.6   10.1  ?     ?   306.178   -117.531     494.991    -117.531     200.78     -117.531     
1 1 1 -12 6  10 o 0 3446.6  58.8  ?     ?   1295.51   62.6459      1345.06    62.6459      99.6145    62.6459      
1 1 1 -12 6  9  f 1 460.7   9.4   ?     ?   444.358   17.4581      478.013    17.4581      46.4354    17.4581      
1 1 1 -12 6  8  o 0 45.1    2.7   ?     ?   308.489   -141.014     78.2223    38.9863      389.731    38.9863      
1 1 1 -12 6  7  o 0 1632.5  29.2  ?     ?   1032.23   -67.6593     847.602    -67.6593     198.946    112.341      
1 1 1 -12 6  6  o 0 2750.8  54.8  ?     ?   974.039   -28.6254     1480.52    -28.6254     489.54     -28.6254     
1 1 1 -12 6  5  o 0 251.6   6.3   ?     ?   469.744   145.274      229.254    145.274      250.042    -34.7263     
1 1 1 -12 6  4  o 0 778.7   14.7  ?     ?   546.089   88.1857      735.09     88.1857      176.616    88.1857      
1 1 1 -12 6  3  f 1 140.4   3.8   ?     ?   275.377   -112.565     200.47     -112.565     89.5943    67.4348      
1 1 1 -12 6  2  o 0 96.4    3     ?     ?   432.424   -175.558     27.906     4.44196      481.576    4.44196      
1 1 1 -12 6  1  o 0 603.1   12    ?     ?   573.219   179.435      567.893    179.435      28.6458    -0.564565    
1 1 1 12  6  0  o 0 172.5   5     ?     ?   164.872   -117.241     304.747    -117.241     134.111    -117.241     
1 1 1 12  6  1  o 0 1007.5  19    ?     ?   765.598   -155.501     727.819    -155.501     65.8128    24.4986      
1 1 1 12  6  3  f 1 858.6   18.8  ?     ?   722.662   -31.9416     643.02     -31.9416     118.047    148.058      
1 1 1 12  6  4  o 0 90      3.8   ?     ?   250.043   101.458      95.4841    101.458      160.678    -78.5416     
1 1 1 12  6  5  o 0 566.1   11.4  ?     ?   471.67    -179.693     608.708    -179.693     125.679    -179.693     
1 1 1 12  6  6  o 0 773.8   15    ?     ?   650.796   -96.5255     630.746    -96.5255     35.0372    83.4745      
1 1 1 12  6  7  o 0 233.4   8.6   ?     ?   377.496   38.7468      283.149    38.7468      102.391    -141.253     
1 1 1 12  6  8  o 0 2199.8  44    ?     ?   1249.64   -71.055      943.265    -71.055      330.027    108.945      
1 1 1 12  6  9  f 1 1443.7  26.5  ?     ?   716.349   135.02       981.163    135.02       277.994    135.02       
1 1 1 12  6  10 o 0 176.2   6.8   ?     ?   275.104   -99.6089     244.02     -99.6089     23.6834    80.3911      
1 1 1 12  6  11 f 1 690.3   17.1  ?     ?   681.691   139.59       480.857    139.59       183.145    -40.41       
1 1 1 12  6  12 o 0 412.8   13.2  ?     ?   506.757   79.2766      377.865    79.2766      104.548    -100.723     
1 1 1 12  6  13 o 0 527.2   15    ?     ?   522.994   -170.622     492.129    -170.622     16.5101    9.37777      
1 1 1 12  6  14 o 0 494.8   15.5  ?     ?   273.357   0.485177     659.106    0.485177     397.933    0.485177     
1 1 1 12  6  15 o 0 50.9    11    ?     ?   303.022   -1.20289     38.066     178.797      319.793    178.797      
1 1 1 12  6  16 o 0 553.4   17.2  ?     ?   636.083   80.7973      431.907    80.7973      155.534    -99.2027     
1 1 1 12  6  17 o 0 425.2   17.3  ?     ?   483.258   133.171      434.525    133.171      12.4825    -46.8291     
1 1 1 12  6  18 o 0 207.6   14.2  ?     ?   288.706   -159.528     366.096    -159.528     66.8474    -159.528     
1 1 1 12  6  19 o 0 45.9    17    ?     ?   213.749   96.4404      51.2142    96.4404      164.736    -83.5596     
1 1 1 12  6  20 o 0 42.1    18.2  ?     ?   61.4721   -65.6207     83.177     -65.6207     22.6217    -65.6207     
1 1 1 12  6  21 o 0 83.5    19.1  ?     ?   235.826   -114.851     175.205    -114.851     49.3285    65.1495      
1 1 1 12  6  22 o 0 272.9   24.4  ?     ?   292.536   23.8736      480.666    23.8736      203.657    23.8736      
1 1 1 12  6  23 o 0 102.3   22.7  ?     ?   311.481   71.6811      150.031    71.6811      169.859    -108.319     
1 1 1 12  6  24 f 1 19.8    26.2  ?     ?   10.4668   18.703       15.6499    18.703       4.87257    18.703       
1 1 1 12  6  25 o 0 160.1   29.5  ?     ?   260.279   -33.895      323.181    -33.895      73.5035    -33.895      
1 1 1 12  6  26 o 0 -15.8   28    ?     ?   80.3262   -117.042     41.3342    -117.042     34.0727    62.9582      
1 1 1 -12 8  26 < 1 149.9   22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 8  25 o 0 129.4   20.6  ?     ?   246.249   -146.014     271.116    -146.014     51.7076    -146.014     
1 1 1 -12 8  24 o 0 26.9    15.1  ?     ?   146.562   174.976      54.7368    174.976      78.8504    -5.02351     
1 1 1 -12 8  23 o 0 27.9    16    ?     ?   228.975   -108.144     12.1686    71.8563      227.769    71.8563      
1 1 1 -12 8  22 o 0 11.2    12.8  ?     ?   83.576    -37.8846     6.27863    -37.8846     75.4483    142.115      
1 1 1 -12 8  21 o 0 171.5   12.3  ?     ?   280.655   -54.0169     316.921    -54.0169     61.3982    -54.0169     
1 1 1 -12 8  20 o 0 270.8   14    ?     ?   333.812   -60.1616     430.404    -60.1616     126.029    -60.1616     
1 1 1 -12 8  19 o 0 90.9    10.5  ?     ?   305.603   -140.653     136.788    -140.653     143.553    39.3475      
1 1 1 -12 8  18 o 0 32.8    10.6  ?     ?   151.325   -150.24      58.6641    -150.24      85.0377    29.7596      
1 1 1 -12 8  17 o 0 106.5   8.9   ?     ?   157.053   163.104      266.321    163.104      113.282    163.104      
1 1 1 -12 8  16 o 0 422.8   12.2  ?     ?   306.919   -162.694     633.471    -162.694     326.483    -162.694     
1 1 1 -12 8  15 o 0 170.9   9.2   ?     ?   317.84    137.568      226.728    137.568      57.1141    -42.4324     
1 1 1 -12 8  14 o 0 7.2     5.7   ?     ?   15.5121   111.462      10.9855    -68.5383     24.823     -68.5383     
1 1 1 -12 8  13 o 0 195.3   7.7   ?     ?   262.752   -142.871     292.778    -142.871     56.7097    -142.871     
1 1 1 -12 8  12 o 0 433.4   12.2  ?     ?   307.643   158.109      552.815    158.109      268.643    158.109      
1 1 1 -12 8  11 o 0 20.6    6.1   ?     ?   127.216   23.3117      62.6221    -156.688     180.863    -156.688     
1 1 1 -12 8  10 o 0 937.9   21    ?     ?   779.822   -122.232     589.688    -122.232     148.082    57.768       
1 1 1 -12 8  9  o 0 2242.4  39.6  ?     ?   1064.94   44.5448      1045.66    44.5448      59.5213    44.5448      
1 1 1 -12 8  8  o 0 445.2   9.2   ?     ?   543.067   43.4403      372.774    43.4403      132.462    -136.56      
1 1 1 -12 8  7  o 0 190.2   5.1   ?     ?   447.569   73.1683      131.023    73.1683      292.608    -106.832     
1 1 1 -12 8  6  o 0 276.2   8.3   ?     ?   281.576   -15.5858     383.007    -15.5858     115.534    -15.5858     
1 1 1 -12 8  5  o 0 529.9   10.9  ?     ?   632.973   -48.0227     376.771    -48.0227     226.326    131.977      
1 1 1 -12 8  4  o 0 2147.6  38.3  ?     ?   1145.52   91.309       932.333    91.309       161.832    -88.691      
1 1 1 -12 8  3  o 0 843     16.8  ?     ?   648.863   -17.2082     630.11     -17.2082     9.13733    -17.2082     
1 1 1 -12 8  2  o 0 297.1   9     ?     ?   715.933   -114.555     49.6685    -114.555     672.7      65.445       
1 1 1 -12 8  1  o 0 1644.8  32.7  ?     ?   831.61    -128.926     1025.44    -128.926     185.614    -128.926     
1 1 1 12  8  0  f 1 212     5.6   ?     ?   212.962   -121.898     346.536    -121.898     130.702    -121.898     
1 1 1 12  8  1  o 0 3355.9  68.9  ?     ?   1202.52   -46.6473     1467.87    -46.6473     254.212    -46.6473     
1 1 1 12  8  2  o 0 114.9   4.5   ?     ?   379.261   96.8859      53.9673    96.8859      329.019    -83.1141     
1 1 1 12  8  3  o 0 4392.9  87.3  ?     ?   1653.45   -159.041     1336.76    -159.041     249.297    20.9591      
1 1 1 12  8  4  o 0 1793.4  39.9  ?     ?   972.842   -117.819     921.117    -117.819     11.6993    62.181       
1 1 1 12  8  5  o 0 329.3   9.2   ?     ?   304.172   -110.497     439.07     -110.497     147.685    -110.497     
1 1 1 12  8  6  o 0 1221.4  31.6  ?     ?   731.208   62.4177      815.781    62.4177      116.354    62.4177      
1 1 1 12  8  7  o 0 3097.6  58.2  ?     ?   1284.71   48.0863      1210.88    48.0863      15.4601    -131.914     
1 1 1 12  8  8  o 0 420.6   11.6  ?     ?   479.935   -31.1611     404.103    -31.1611     46.8714    148.839      
1 1 1 12  8  9  o 0 1198.6  23.1  ?     ?   811.205   -49.9208     730.828    -49.9208     28.9897    130.079      
1 1 1 12  8  10 o 0 350.5   10.7  ?     ?   485.077   -118.197     327.364    -118.197     137.492    61.8033      
1 1 1 12  8  11 o 0 502.6   15.8  ?     ?   445.791   -96.6946     529.701    -96.6946     109.42     -96.6946     
1 1 1 12  8  12 o 0 185.9   9.3   ?     ?   304.591   -3.96255     241.436    -3.96255     44.3368    176.037      
1 1 1 12  8  13 o 0 4.8     9     ?     ?   91.1316   95.1221      65.2363    -84.8779     148.508    -84.8779     
1 1 1 12  8  14 o 0 110.6   10.1  ?     ?   277.881   176.619      147.651    176.619      106.989    -3.38118     
1 1 1 12  8  15 o 0 281.6   12.9  ?     ?   326.563   -126.028     386.914    -126.028     89.5612    -126.028     
1 1 1 12  8  16 o 0 97.8    14.3  ?     ?   284.604   136.643      141.627    136.643      148.984    -43.3566     
1 1 1 12  8  17 o 0 494.4   17.5  ?     ?   324.703   64.7082      720.937    64.7082      397.538    64.7082      
1 1 1 12  8  18 o 0 192.1   15.9  ?     ?   247.126   -120.009     388.619    -120.009     148.464    -120.009     
1 1 1 12  8  19 o 0 -0.1    18.1  ?     ?   185.815   -121.45      63.0775    58.5501      237.72     58.5501      
1 1 1 12  8  20 o 0 371.4   23.6  ?     ?   382.176   -170.417     528.236    -170.417     170.776    -170.417     
1 1 1 12  8  21 o 0 121.2   20.4  ?     ?   346.994   139.95       162.868    139.95       161.587    -40.0504     
1 1 1 12  8  22 o 0 170.5   25.2  ?     ?   299.09    140.477      301.16     140.477      1.82784    -39.5229     
1 1 1 12  8  23 o 0 190.8   29    ?     ?   291.855   127.563      348.844    127.563      65.9372    127.563      
1 1 1 12  8  24 o 0 1.8     27.9  ?     ?   141.292   132.134      17.3571    132.134      115.383    -47.8658     
1 1 1 12  8  25 o 0 7.3     31.4  ?     ?   91.5526   -9.74637     74.314     -9.74637     9.86816    170.254      
1 1 1 -12 10 23 f 1 48.9    16.5  ?     ?   113.154   -158.539     164.185    -158.539     64.5715    -158.539     
1 1 1 -12 10 22 o 0 190.9   17.6  ?     ?   218.371   26.4922      404.024    26.4922      208.486    26.4922      
1 1 1 -12 10 21 o 0 152.7   17.6  ?     ?   315.265   79.8973      252.254    79.8973      39.199     -100.103     
1 1 1 -12 10 20 o 0 -4.3    13.1  ?     ?   147.919   -157.563     64.8013    22.4372      206.729    22.4372      
1 1 1 -12 10 19 o 0 72.2    12.5  ?     ?   179.242   130.078      179.586    130.078      19.5656    130.078      
1 1 1 -12 10 18 o 0 19.9    10.3  ?     ?   81.6641   53.4336      23.0759    53.4336      49.8909    -126.566     
1 1 1 -12 10 17 o 0 246.8   11.4  ?     ?   393.081   -2.22251     343.2      -2.22251     9.90047    177.777      
1 1 1 -12 10 16 o 0 28.8    8.2   ?     ?   101.595   -164.572     54.4991    -164.572     39.9061    15.4276      
1 1 1 -12 10 15 o 0 346     11.7  ?     ?   363.72    -163.393     488.009    -163.393     141.456    -163.393     
1 1 1 -12 10 14 o 0 126.1   7.7   ?     ?   222.777   166.225      264.189    166.225      50.2784    166.225      
1 1 1 -12 10 13 f 1 129.4   7.6   ?     ?   188.147   -171.893     276.746    -171.893     90.5836    -171.893     
1 1 1 -12 10 12 o 0 460.1   12.1  ?     ?   364.095   172.96       542.151    172.96       222.558    172.96       
1 1 1 -12 10 11 o 0 460.1   11.1  ?     ?   539.294   170.937      404.648    170.937      71.7182    -9.06312     
1 1 1 -12 10 10 o 0 623     16.2  ?     ?   658.221   81.9008      454.766    81.9008      124.954    -98.0992     
1 1 1 -12 10 9  o 0 270.6   7.8   ?     ?   477.288   52.0989      241.581    52.0989      181.014    -127.901     
1 1 1 -12 10 8  o 0 427.4   12    ?     ?   520.404   -164.182     374.848    -164.182     97.9785    15.8181      
1 1 1 -12 10 7  o 0 528.5   11.1  ?     ?   412.403   120.074      563.92     120.074      187.621    120.074      
1 1 1 -12 10 6  o 0 325     9.4   ?     ?   363.021   34.5657      387.672    34.5657      55.1914    34.5657      
1 1 1 -12 10 5  o 0 300.1   8.1   ?     ?   355.014   130.142      364.034    130.142      37.8412    130.142      
1 1 1 -12 10 4  o 0 324.2   7.9   ?     ?   466.96    165.562      302.31     165.562      133.106    -14.4383     
1 1 1 -12 10 3  o 0 34.5    3.4   ?     ?   127.429   -86.7982     28.958     93.2018      148.038    93.2018      
1 1 1 -12 10 2  o 0 834.3   17.3  ?     ?   454.277   -26.5015     770.437    -26.5015     356.383    -26.5015     
1 1 1 -12 10 1  o 0 901.6   19.2  ?     ?   639.526   6.50581      665.176    6.50581      81.5839    6.50581      
1 1 1 12  10 0  o 0 1078.1  24.5  ?     ?   915.374   82.9885      544.598    82.9885      292.324    -97.0115     
1 1 1 12  10 1  o 0 3024.3  59    ?     ?   1061.8    155.145      1361.96    155.145      390.698    155.145      
1 1 1 12  10 2  o 0 257.7   8.1   ?     ?   186.938   174.19       386.117    174.19       215.112    174.19       
1 1 1 12  10 3  o 0 284     7.9   ?     ?   351.166   -172.527     345.315    -172.527     15.5438    -172.527     
1 1 1 12  10 4  o 0 1168.6  22.6  ?     ?   891.506   134.612      639.959    134.612      196.495    -45.3876     
1 1 1 12  10 5  o 0 139.5   6.4   ?     ?   180.949   88.8172      206.077    88.8172      38.5625    88.8172      
1 1 1 12  10 6  o 0 255.8   10.7  ?     ?   383.819   -108.293     285.912    -108.293     68.7407    71.7067      
1 1 1 12  10 7  o 0 27.3    6.5   ?     ?   287.013   -62.9561     128.279    117.044      392.845    117.044      
1 1 1 12  10 8  o 0 62      7.1   ?     ?   278.799   -167.801     11.4556    -167.801     239.449    12.1989      
1 1 1 12  10 9  o 0 101.8   7.8   ?     ?   332.22    79.1407      76.8831    79.1407      221.064    -100.859     
1 1 1 12  10 10 o 0 80.1    7.7   ?     ?   177.882   94.5637      98.2229    94.5637      60.6738    -85.4363     
1 1 1 12  10 11 o 0 712.8   19.5  ?     ?   658.564   -49.2741     534.405    -49.2741     56.3527    130.726      
1 1 1 12  10 12 o 0 82.2    10.5  ?     ?   438.672   -46.2777     40.0345    133.722      431.57     133.722      
1 1 1 12  10 13 f 1 433.1   17.7  ?     ?   179.322   152.697      741.573    152.697      560.928    152.697      
1 1 1 12  10 14 o 0 7.1     11    ?     ?   180.488   -87.2188     91.7325    92.7812      268.395    92.7812      
1 1 1 12  10 15 o 0 11.4    12.7  ?     ?   176.201   112.26       53.6072    -67.7399     222.093    -67.7399     
1 1 1 12  10 16 o 0 305.8   15.5  ?     ?   277.458   -33.9676     526.007    -33.9676     262.545    -33.9676     
1 1 1 12  10 17 o 0 -2.1    14    ?     ?   170.602   -178.723     74.598     1.27666      231.389    1.27666      
1 1 1 12  10 18 o 0 20      15.8  ?     ?   181.256   -17.9242     7.8024     162.076      173.696    162.076      
1 1 1 12  10 19 o 0 -0.4    17.2  ?     ?   201.515   -49.3737     75.91      130.626      269.344    130.626      
1 1 1 12  10 20 o 0 43      26.9  ?     ?   181.368   -143.055     75.4575    -143.055     104.568    36.945       
1 1 1 12  10 21 o 0 222.8   34.3  ?     ?   202.341   58.9713      468.819    58.9713      276.519    58.9713      
1 1 1 12  10 22 o 0 34      29.7  ?     ?   149.185   91.8978      77.7281    91.8978      59.7668    -88.1022     
1 1 1 12  10 23 f 1 5.7     30.6  ?     ?   107.333   157.813      60.5112    157.813      36.8609    -22.1869     
1 1 1 12  10 24 < 0 91.1    26    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 12 21 o 0 61      18.3  ?     ?   211.159   125.384      124.026    125.384      56.1019    -54.6158     
1 1 1 -12 12 20 o 0 19.1    15.9  ?     ?   144.136   115.901      31.7316    115.901      92.2533    -64.0986     
1 1 1 -12 12 19 o 0 114.7   15.1  ?     ?   157.863   -168.775     304.222    -168.775     165.231    -168.775     
1 1 1 -12 12 18 o 0 96.4    14.6  ?     ?   148.534   128.551      267.093    128.551      132.228    128.551      
1 1 1 -12 12 17 o 0 30.2    11.9  ?     ?   105.341   -87.7367     77.4194    -87.7367     21.7369    92.2633      
1 1 1 -12 12 16 o 0 374.7   15    ?     ?   356.441   51.7258      542.494    51.7258      215.595    51.7258      
1 1 1 -12 12 15 o 0 25.7    9.7   ?     ?   233.201   29.7885      17.5172    -150.212     223.225    -150.212     
1 1 1 -12 12 14 o 0 39.4    9.2   ?     ?   189.168   -5.65307     70.7319    -5.65307     95.9913    174.347      
1 1 1 -12 12 13 o 0 192.4   10    ?     ?   314.654   -30.0533     320.162    -30.0533     41.8338    -30.0533     
1 1 1 -12 12 12 o 0 90.1    8     ?     ?   207.049   -154.436     198.749    -154.436     9.62544    -154.436     
1 1 1 -12 12 11 o 0 219.2   8.6   ?     ?   267.046   -136.241     397.094    -136.241     151.596    -136.241     
1 1 1 -12 12 10 o 0 78.3    6.5   ?     ?   210.37    -141.623     157.631    -141.623     40.2183    38.3772      
1 1 1 -12 12 9  o 0 57.4    6.1   ?     ?   317.54    -146.931     15.9322    -146.931     284.335    33.0689      
1 1 1 -12 12 8  o 0 179.6   6.5   ?     ?   457.87    178.032      149.233    178.032      293.601    -1.96825     
1 1 1 -12 12 7  o 0 150.1   6.5   ?     ?   37.7863   -83.0882     190.173    -83.0882     153.466    -83.0882     
1 1 1 -12 12 6  o 0 19.4    4.8   ?     ?   237.769   95.5714      96.3588    -84.4286     301.733    -84.4286     
1 1 1 -12 12 5  o 0 378.5   9.6   ?     ?   506.054   -133.159     341.05     -133.159     97.5541    46.8408      
1 1 1 -12 12 4  o 0 2713    50.6  ?     ?   1082.02   -158.989     1214.74    -158.989     274.2      -158.989     
1 1 1 -12 12 3  o 0 683.9   15.8  ?     ?   578.872   126.522      562.929    126.522      58.5215    126.522      
1 1 1 -12 12 2  o 0 31.4    6.3   ?     ?   131.083   33.6964      4.99551    -146.304     119.438    -146.304     
1 1 1 -12 12 1  o 0 929.8   19    ?     ?   726.28    -137.692     623.105    -137.692     11.9105    42.3077      
1 1 1 12  12 0  o 0 66.2    5.2   ?     ?   214.268   -75.8192     74.6724    -75.8192     113.613    104.181      
1 1 1 12  12 1  o 0 210.5   7.5   ?     ?   437.661   -3.42446     192.485    -3.42446     192.134    176.576      
1 1 1 12  12 2  o 0 63.2    5.7   ?     ?   215.724   -54.4087     65.7942    -54.4087     123.718    125.591      
1 1 1 12  12 3  o 0 103.2   6.3   ?     ?   413.389   166.267      27.669     166.268      335.198    -13.7325     
1 1 1 12  12 4  o 0 56.2    5.9   ?     ?   50.8631   -107.634     39.0372    -107.634     5.55317    72.3664      
1 1 1 12  12 5  o 0 13.3    6.1   ?     ?   177.988   106.817      93.729     -73.183      249.495    -73.183      
1 1 1 12  12 6  o 0 134.2   7.5   ?     ?   243.792   -42.8515     207.287    -42.8515     5.59118    137.148      
1 1 1 12  12 7  o 0 14.6    7.2   ?     ?   83.8032   -88.222      33.1514    91.778       115.551    91.778       
1 1 1 12  12 8  o 0 6.8     7.9   ?     ?   81.9201   -59.4603     51.2447    120.54       131.533    120.54       
1 1 1 12  12 9  o 0 100.5   9.1   ?     ?   55.9168   53.3518      205.167    53.3517      151.521    53.3517      
1 1 1 12  12 10 o 0 25      8.6   ?     ?   103.563   -83.9955     18.0765    -83.9955     80.8618    96.0045      
1 1 1 12  12 11 o 0 90      10.3  ?     ?   338.251   147.267      96.4903    147.267      219.76     -32.7329     
1 1 1 12  12 12 o 0 139.1   14.9  ?     ?   216.457   95.2625      299.883    95.2625      98.5594    95.2625      
1 1 1 12  12 13 o 0 40.3    11    ?     ?   85.7626   -58.8646     106.988    -58.8646     29.6501    -58.8646     
1 1 1 12  12 14 o 0 18.5    17.3  ?     ?   58.2334   -40.6847     22.9433    -40.6847     29.4413    139.315      
1 1 1 12  12 15 o 0 109.4   16.3  ?     ?   181.381   -60.0403     268.296    -60.0403     104.798    -60.0403     
1 1 1 12  12 16 o 0 108.4   18.7  ?     ?   295.479   -86.4939     174.869    -86.4939     112.197    93.5061      
1 1 1 12  12 17 o 0 43.9    20.2  ?     ?   161.063   175.438      96.7951    175.438      59.659     -4.56202     
1 1 1 12  12 18 < 0 -91.5   19.6  ?     ?   ?         ?            63.3903    -121.848     ?          ?            
1 1 1 12  12 19 o 0 25.3    23.5  ?     ?   99.3599   -22.6902     77.7619    -22.6902     12.0566    157.31       
1 1 1 12  12 20 o 0 6.6     26    ?     ?   54.6404   66.5476      49.5515    66.5476      1.23735    66.5476      
1 1 1 12  12 21 < 0 36.2    25.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 14 18 < 1 -10.5   16.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 14 17 o 0 19.8    15.5  ?     ?   66.1369   129.765      71.2654    129.765      15.7634    129.765      
1 1 1 -12 14 16 o 0 13.8    14    ?     ?   44.8168   134.079      33.3661    134.079      4.49721    -45.9205     
1 1 1 -12 14 15 o 0 35.7    12.7  ?     ?   109.16    -46.5053     108.619    -46.5053     14.3808    -46.5053     
1 1 1 -12 14 14 o 0 -10.8   11.7  ?     ?   97.1327   28.8095      42.9918    -151.191     129.321    -151.191     
1 1 1 -12 14 13 o 0 44.4    11.1  ?     ?   111.725   159.571      140.444    159.571      36.908     159.571      
1 1 1 -12 14 12 o 0 -0.8    9.5   ?     ?   119.041   -40.496      55.0874    139.504      165.357    139.504      
1 1 1 -12 14 11 o 0 47.6    9.5   ?     ?   144.235   -81.2492     125        -81.2492     1.10791    -81.2492     
1 1 1 -12 14 10 o 0 70.3    7.2   ?     ?   288.3     28.4564      91.7464    28.4564      157.403    -151.544     
1 1 1 -12 14 9  o 0 272.7   10.3  ?     ?   369.426   -53.3212     381.72     -53.3212     63.4594    -53.3212     
1 1 1 -12 14 8  f 1 46.9    6.5   ?     ?   71.1759   -90.4107     123.398    -90.4107     61.4495    -90.4107     
1 1 1 -12 14 7  f 1 101.4   7.1   ?     ?   250.669   144.098      195.24     144.098      23.1186    -35.9018     
1 1 1 -12 14 6  o 0 50.2    6.4   ?     ?   145.705   112.395      131.354    112.395      4.55705    112.395      
1 1 1 -12 14 5  o 0 62.1    6.3   ?     ?   43.8827   75.6702      128.527    75.6702      90.1995    75.6702      
1 1 1 -12 14 4  f 1 30.1    5.5   ?     ?   161.126   -156.363     41.5134    -156.363     104.007    23.6374      
1 1 1 -12 14 3  o 0 195.8   8.2   ?     ?   211.919   74.8312      394.43     74.8312      203.506    74.8312      
1 1 1 -12 14 2  o 0 7.9     5.9   ?     ?   68.5199   63.5824      28.2624    -116.418     90.1297    -116.418     
1 1 1 -12 14 1  o 0 14.8    6.5   ?     ?   74.4517   -74.8258     5.49784    105.174      72.8374    105.174      
1 1 1 12  14 0  o 0 58.3    6.8   ?     ?   127.061   44.9713      156.276    44.9713      40.4517    44.9713      
1 1 1 12  14 1  o 0 5.8     5.7   ?     ?   108.527   132.161      56.8257    -47.8391     155.729    -47.8391     
1 1 1 12  14 2  o 0 38.2    6.8   ?     ?   137.562   127.651      84.7381    127.651      40.5387    -52.3495     
1 1 1 12  14 3  o 0 53.9    7.2   ?     ?   296.45    139.805      31.9799    139.805      237.686    -40.1955     
1 1 1 12  14 4  f 1 20.5    8.7   ?     ?   205.341   67.7749      34.9685    -112.225     222.417    -112.225     
1 1 1 12  14 5  o 0 126.3   8.8   ?     ?   355.54    72.6163      168.498    72.6163      145.711    -107.384     
1 1 1 12  14 6  o 0 304.3   14.4  ?     ?   431.816   -157.959     381.114    -157.959     0.464059   -157.959     
1 1 1 12  14 7  f 1 -8      8.7   ?     ?   41.4408   114.521      25.6195    -65.4794     62.2272    -65.4794     
1 1 1 12  14 8  f 1 79      11.1  ?     ?   279.846   88.2788      119.894    88.2788      127.379    -91.7212     
1 1 1 12  14 9  o 0 89.2    11.3  ?     ?   139.134   74.8894      241.176    74.8895      119.353    74.8895      
1 1 1 12  14 10 o 0 130.6   12.7  ?     ?   233.105   -101.799     269.279    -101.799     64.3071    -101.799     
1 1 1 12  14 11 o 0 5.8     12.2  ?     ?   53.5064   -10.1403     6.66967    169.86       55.7517    169.86       
1 1 1 12  14 12 o 0 26.2    12.7  ?     ?   144.518   -86.0662     41.3149    -86.0662     95.2035    93.9338      
1 1 1 12  14 13 o 0 -29.4   16.1  ?     ?   108.542   130.422      54.371     -49.578      157.064    -49.578      
1 1 1 12  14 14 o 0 -3.9    13    ?     ?   145.201   -172.994     52.8927    7.00577      184.796    7.00577      
1 1 1 12  14 15 o 0 91.6    18.8  ?     ?   200.879   158.32       217.244    158.32       39.791     158.32       
1 1 1 12  14 16 o 0 22      19.3  ?     ?   147.924   123.445      42.2026    123.445      85.8233    -56.5548     
1 1 1 12  14 17 o 0 -13.8   20.8  ?     ?   51.8451   -155.248     18.6371    -155.248     25.9851    24.7515      
1 1 1 12  14 18 < 1 92.8    28.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 16 14 < 0 12.4    14.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 16 13 < 1 -3.6    14.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 16 12 o 0 59.6    13.6  ?     ?   167.131   174.825      160.146    174.825      23.1204    174.825      
1 1 1 -12 16 11 o 0 13.1    12.7  ?     ?   67.7051   173.866      33.0243    173.866      22.7357    -6.134       
1 1 1 -12 16 10 o 0 46      12.5  ?     ?   152.65    -79.8799     123.656    -79.8799     4.52353    100.12       
1 1 1 -12 16 9  o 0 121.4   11.4  ?     ?   168.583   -96.5272     300.805    -96.5272     158.426    -96.5272     
1 1 1 -12 16 8  o 0 97.1    11.2  ?     ?   197.065   41.4211      226.352    41.4211      55.472     41.4211      
1 1 1 -12 16 7  o 0 124.1   10.4  ?     ?   201.391   43.2411      280.649    43.2411      105.175    43.2411      
1 1 1 -12 16 6  o 0 14      9.5   ?     ?   98.3062   -89.7688     10.8464    -89.7688     78.1785    90.2312      
1 1 1 -12 16 5  f 1 143.7   11.6  ?     ?   174.197   -107.318     334.059    -107.318     174.885    -107.318     
1 1 1 -12 16 4  o 0 255.4   12.4  ?     ?   304.039   -146.311     405.064    -146.311     127.732    -146.311     
1 1 1 -12 16 3  o 0 222.3   13.3  ?     ?   290.941   168.635      369.872    168.635      103.715    168.635      
1 1 1 -12 16 2  o 0 76.3    10.2  ?     ?   264.98    131.321      120.097    131.321      121.092    -48.6792     
1 1 1 -12 16 1  f 1 126.7   9.8   ?     ?   162.143   -59.1123     312.253    -59.1123     163.616    -59.1123     
1 1 1 12  16 0  o 0 190.3   11.4  ?     ?   270.574   66.3381      343.505    66.3381      94.1674    66.3381      
1 1 1 12  16 1  f 1 555.8   17.9  ?     ?   528.626   76.4769      548.349    76.4769      58.9804    76.4769      
1 1 1 12  16 2  o 0 81.5    10.1  ?     ?   257.371   74.3563      140.972    74.3563      95.831     -105.644     
1 1 1 12  16 3  o 0 24.3    10.8  ?     ?   138.58    7.29128      41.361     7.29128      86.9156    -172.709     
1 1 1 12  16 4  o 0 155.3   12.5  ?     ?   233.607   -73.958      313.348    -73.958      97.52      -73.958      
1 1 1 12  16 5  f 1 362.3   16.3  ?     ?   252.436   -134.578     586.594    -134.578     352.724    -134.578     
1 1 1 12  16 6  o 0 49.4    13.3  ?     ?   117.524   -175.163     150.225    -175.163     42.2071    -175.163     
1 1 1 12  16 7  o 0 17.3    14.1  ?     ?   93.9979   -119.956     35.4156    -119.956     47.7951    60.0437      
1 1 1 12  16 8  o 0 146.1   18.2  ?     ?   233.378   -30.999      293.73     -30.999      87.912     -30.999      
1 1 1 12  16 9  o 0 327.3   20.8  ?     ?   355.593   17.1762      464.43     17.1762      158.668    17.1762      
1 1 1 12  16 10 o 0 14.2    17.8  ?     ?   7.55391   -22.6382     8.42832    -22.6382     2.04786    -22.6382     
1 1 1 12  16 11 o 0 50.7    18.9  ?     ?   87.7016   -87.0174     162.423    -87.0174     88.7297    -87.0174     
1 1 1 12  16 12 o 0 288.8   21.8  ?     ?   277.944   -37.3584     475.636    -37.3584     242.885    -37.3584     
1 1 1 12  16 13 < 1 42.9    22.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  16 14 < 0 75.5    23.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 18 5  < 0 121.8   13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 18 4  < 0 117     14.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 18 3  < 0 48.3    14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 18 2  < 0 48.6    12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -12 18 1  < 0 27.9    13.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  18 0  < 1 -0.9    12.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  18 1  < 0 36.7    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  18 2  < 0 -13.8   14    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  18 3  < 0 52.7    14.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  18 4  < 0 21.1    15.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 12  18 5  < 0 42.5    18.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 1  28 o 0 44.7    18.6  ?     ?   186.424   -57.6082     97.1218    -57.6082     75.6604    122.392      
1 1 1 -13 1  27 o 0 8.3     17.8  ?     ?   152.632   -12.0148     5.27551    167.985      149.999    167.985      
1 1 1 -13 1  26 o 0 76.4    15.3  ?     ?   145.054   28.9036      231.171    28.9036      84.1217    28.9036      
1 1 1 -13 1  25 f 1 191.9   13.7  ?     ?   345.06    129.008      308.437    129.008      44.467     -50.9919     
1 1 1 -13 1  24 o 0 346.9   14.5  ?     ?   399.217   126.024      488.965    126.024      113.998    126.024      
1 1 1 -13 1  23 o 0 42.5    10.4  ?     ?   190.008   127.832      86.1825    127.832      93.47      -52.1683     
1 1 1 -13 1  22 o 0 514.6   18.6  ?     ?   489.275   134.223      600.58     134.223      121.399    134.223      
1 1 1 -13 1  21 o 0 74.4    10.6  ?     ?   325.862   118.775      59.9602    118.775      267.725    -61.2251     
1 1 1 -13 1  20 o 0 146.1   8.7   ?     ?   228.629   -153.403     299.254    -153.403     63.105     -153.403     
1 1 1 -13 1  19 o 0 318.5   10.8  ?     ?   518.445   176.163      281.097    176.163      197.336    -3.83679     
1 1 1 -13 1  18 o 0 189.3   8     ?     ?   188.723   38.2252      321.675    38.2252      147.588    38.2252      
1 1 1 -13 1  17 o 0 65.6    6.6   ?     ?   93.7274   -102.409     40.8808    -102.409     48.1148    77.5908      
1 1 1 -13 1  16 f 1 17.9    6     ?     ?   295.628   118.076      188.779    -61.9236     476.469    -61.9236     
1 1 1 -13 1  15 o 0 259.4   9.1   ?     ?   326.577   -93.1416     333.619    -93.1416     23.5958    -93.1416     
1 1 1 -13 1  14 o 0 1869.7  34.1  ?     ?   986.793   -34.6175     956.852    -34.6175     1.54105    -34.6175     
1 1 1 -13 1  13 o 0 20.1    3.7   ?     ?   283.114   164.993      164.142    -15.0074     439.872    -15.0074     
1 1 1 -13 1  12 f 1 1166.2  21.1  ?     ?   672.391   102.679      905.542    102.679      217.047    102.679      
1 1 1 -13 1  11 o 0 1038.4  18.5  ?     ?   733.201   -21.5342     761.728    -21.5342     11.0924    -21.5342     
1 1 1 -13 1  10 o 0 194.3   4.7   ?     ?   421.866   -82.1935     181.678    -82.1935     252.125    97.8065      
1 1 1 -13 1  9  o 0 1602.9  30.4  ?     ?   1061.99   -146.962     842.503    -146.962     269.2      33.0376      
1 1 1 -13 1  7  o 0 161.3   3.6   ?     ?   182.423   25.6293      265.809    25.6293      88.4066    25.6293      
1 1 1 -13 1  6  o 0 761.2   13.9  ?     ?   529.935   -152.89      710.033    -152.89      193.742    -152.89      
1 1 1 -13 1  5  o 0 1874.9  32.4  ?     ?   977.293   -161.865     976.361    -161.865     60.4637    -161.865     
1 1 1 -13 1  4  o 0 865.6   15.7  ?     ?   581.352   149.008      719.725    149.008      174.654    149.008      
1 1 1 -13 1  3  o 0 1257    22.2  ?     ?   656.642   -158.533     920.093    -158.533     304.467    -158.533     
1 1 1 -13 1  2  o 0 3226    77.8  ?     ?   1213.53   -49.2591     1323.76    -49.2591     211.784    -49.2591     
1 1 1 -13 1  1  o 0 536.6   9.8   ?     ?   475.561   172.959      521.759    172.959      85.9686    172.959      
1 1 1 13  1  0  o 0 1340    23.7  ?     ?   692.337   -176.135     913.132    -176.135     282.09     -176.135     
1 1 1 13  1  1  o 0 1188.6  21.6  ?     ?   958.098   -136.957     589.574    -136.957     286.65     43.0433      
1 1 1 13  1  2  o 0 623.4   11.7  ?     ?   570.645   -127.971     521.047    -127.971     2.87536    52.0287      
1 1 1 13  1  3  o 0 1007.1  18.8  ?     ?   673.391   50.0779      744.686    50.0779      109.98     50.0779      
1 1 1 13  1  4  o 0 227     6.3   ?     ?   440.19    103.42       205.987    103.42       210.047    -76.5799     
1 1 1 13  1  5  o 0 492.3   9.8   ?     ?   604.573   -13.4442     398.618    -13.4442     196.999    166.556      
1 1 1 13  1  6  o 0 3683.5  63.4  ?     ?   1326      -49.9495     1496.28    -49.9495     189.293    -49.9495     
1 1 1 13  1  7  o 0 1020.9  19.4  ?     ?   902.864   22.7104      570.638    22.7104      318.803    -157.29      
1 1 1 13  1  8  o 0 244     6.5   ?     ?   461.287   28.1253      240.209    28.1253      251.052    -151.875     
1 1 1 13  1  9  o 0 1172.6  26.9  ?     ?   731.579   -147.637     905.796    -147.637     128.408    -147.637     
1 1 1 13  1  10 o 0 425.2   9.7   ?     ?   194.586   166.211      679.532    166.211      476.236    166.211      
1 1 1 13  1  11 o 0 293.9   8.5   ?     ?   469.459   157.744      296.694    157.744      192.046    -22.2558     
1 1 1 13  1  12 f 1 705.1   16.3  ?     ?   666.918   -113.66      558.687    -113.66      136.332    66.3404      
1 1 1 13  1  13 o 0 1789.5  33.6  ?     ?   776.305   -114.133     1140.38    -114.133     370.237    -114.133     
1 1 1 13  1  14 o 0 21.8    8.8   ?     ?   83.5468   22.3047      41.3516    -157.695     123.81     -157.695     
1 1 1 13  1  15 o 0 1564.4  30.8  ?     ?   661.865   42.4946      1117.57    42.4946      476.433    42.4946      
1 1 1 13  1  16 f 1 174.6   12.5  ?     ?   122.897   103.372      261.511    103.372      139.366    103.372      
1 1 1 13  1  17 o 0 727.2   21.4  ?     ?   514.856   -146.941     694.642    -146.941     194.899    -146.941     
1 1 1 13  1  18 o 0 670.8   21.1  ?     ?   524.516   63.8526      648.272    63.8526      153.198    63.8526      
1 1 1 13  1  19 o 0 476.1   19.3  ?     ?   506.13    87.0232      478.296    87.0232      0.0819643  -92.9768     
1 1 1 13  1  20 o 0 17.3    14.1  ?     ?   105.939   -139.09      30.0404    40.91        142.225    40.91        
1 1 1 13  1  21 o 0 663.9   24.1  ?     ?   522.311   -158.705     731.726    -158.705     192.683    -158.705     
1 1 1 13  1  22 o 0 38.2    18.3  ?     ?   165.555   -171.651     65.4353    -171.651     101.143    8.34921      
1 1 1 13  1  23 o 0 112.5   22.2  ?     ?   190.748   84.9318      285.958    84.9318      100.467    84.9318      
1 1 1 13  1  24 o 0 19.3    24.1  ?     ?   105.222   35.6649      49.1552    35.6649      53.4968    -144.335     
1 1 1 13  1  25 f 1 103.6   24.4  ?     ?   69.5873   162.319      325.096    162.319      251.732    162.319      
1 1 1 13  1  26 o 0 30.2    29.3  ?     ?   178.417   -48.3096     46.808     -48.3096     133.576    131.69       
1 1 1 13  1  27 o 0 34.7    24.2  ?     ?   50.497    14.7473      112.457    14.7473      63.6256    14.7473      
1 1 1 13  1  28 o 0 64.8    26.8  ?     ?   253.794   87.9773      88.9556    87.9773      154.412    -92.0227     
1 1 1 -13 3  28 < 0 8       16.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 3  27 o 0 60.6    17.6  ?     ?   133.819   116.832      197.549    116.832      73.8367    116.832      
1 1 1 -13 3  26 o 0 80.5    15    ?     ?   145.443   70.9589      247.817    70.9589      107.02     70.9589      
1 1 1 -13 3  25 o 0 156     15.7  ?     ?   230.009   -67.364      346.409    -67.364      113.32     -67.364      
1 1 1 -13 3  24 o 0 45.2    11    ?     ?   24.8948   -47.7291     67.0718    -47.7291     43.7465    -47.7291     
1 1 1 -13 3  23 o 0 67      11.5  ?     ?   95.9398   49.6907      206.61     49.6907      116.537    49.6907      
1 1 1 -13 3  22 o 0 54.9    9.9   ?     ?   57.6551   -78.0387     127.131    -78.0387     71.2524    -78.0387     
1 1 1 -13 3  21 o 0 547.2   17    ?     ?   554.926   -131.09      560.933    -131.09      8.50512    -131.09      
1 1 1 -13 3  20 o 0 303.5   11.7  ?     ?   453.555   -178.124     358.244    -178.124     105.699    1.87603      
1 1 1 -13 3  19 o 0 171.7   10.4  ?     ?   285.607   120.816      256.685    120.816      4.43243    -59.1838     
1 1 1 -13 3  18 o 0 150.7   7.6   ?     ?   397.996   102.446      127.575    102.446      236.294    -77.554      
1 1 1 -13 3  17 o 0 48.3    7.3   ?     ?   166.875   -66.85       1.54065    113.15       158.649    113.15       
1 1 1 -13 3  16 o 0 23.3    7.3   ?     ?   321.827   -133.473     173.07     46.5274      478.455    46.5274      
1 1 1 -13 3  15 o 0 640.7   18.4  ?     ?   546.394   18.5967      560.31     18.5967      45.5342    18.5967      
1 1 1 -13 3  14 o 0 458     14.4  ?     ?   438.465   1.08333      482.338    1.08333      66.3515    1.08333      
1 1 1 -13 3  13 o 0 273     11    ?     ?   287.681   -37.7477     381.636    -37.7477     103.29     -37.7477     
1 1 1 -13 3  12 o 0 801.5   16.1  ?     ?   662.689   135.856      595.616    135.856      49.4724    -44.1438     
1 1 1 -13 3  11 o 0 4996.5  90.1  ?     ?   1444.64   -84.1383     1877.46    -84.1383     406.349    -84.1383     
1 1 1 -13 3  10 o 0 1504.8  26.8  ?     ?   961.087   -71.3589     849.731    -71.3589     133.976    108.641      
1 1 1 -13 3  9  o 0 344.2   8.1   ?     ?   558.976   21.1752      276.846    21.1752      297.923    -158.825     
1 1 1 -13 3  8  o 0 582.9   12.5  ?     ?   494.75    82.8788      626.291    82.8788      108.269    82.8788      
1 1 1 -13 3  7  o 0 939     17    ?     ?   659.034   48.4333      790.258    48.4333      97.7929    48.4333      
1 1 1 -13 3  6  o 0 487.4   9.2   ?     ?   552.729   19.635       471.728    19.635       110.752    -160.365     
1 1 1 -13 3  4  o 0 412.3   8     ?     ?   320.355   -175.788     552.398    -175.788     239.277    -175.788     
1 1 1 -13 3  3  o 0 859.2   16.3  ?     ?   545.277   -147.35      778.857    -147.35      245.261    -147.35      
1 1 1 -13 3  2  o 0 610.3   14.1  ?     ?   693.648   -106.223     413.144    -106.223     239.537    73.7767      
1 1 1 -13 3  1  o 0 2505.9  62.1  ?     ?   882.322   -31.2118     1366.16    -31.2118     535.694    -31.2118     
1 1 1 13  3  0  o 0 297.5   7.8   ?     ?   506.628   -138.463     243.934    -138.463     228.1      41.5371      
1 1 1 13  3  1  o 0 284.6   8.3   ?     ?   199.232   -103.401     441.908    -103.401     255.739    -103.401     
1 1 1 13  3  2  o 0 322.8   8.3   ?     ?   548.782   71.4945      241        71.4945      273.288    -108.506     
1 1 1 13  3  4  o 0 176.5   3.9   ?     ?   386.268   155.47       175.908    155.47       202.434    -24.5304     
1 1 1 13  3  5  o 0 467.1   9.5   ?     ?   456.819   141.134      502.674    141.134      54.8215    141.134      
1 1 1 13  3  7  o 0 128.4   4.7   ?     ?   247.991   -139.319     195.47     -139.319     67.4975    40.6805      
1 1 1 13  3  8  o 0 1021.1  18.6  ?     ?   648.588   25.5208      867.046    25.5208      174.491    25.5208      
1 1 1 13  3  9  o 0 2182.9  38.8  ?     ?   1026.05   141.297      1183.88    141.297      115.514    141.297      
1 1 1 13  3  10 o 0 283.4   7.4   ?     ?   663.44    -9.57719     94.1616    -9.57719     594.471    170.423      
1 1 1 13  3  11 o 0 830.6   16.7  ?     ?   586.037   -56.0963     749.15     -56.0963     143.148    -56.0963     
1 1 1 13  3  12 o 0 1955.8  35.6  ?     ?   1017.23   -153.38      993.842    -153.38      12.9371    26.6199      
1 1 1 13  3  13 o 0 590.5   14.6  ?     ?   605.824   -19.8646     472.855    -19.8646     123.832    160.135      
1 1 1 13  3  14 o 0 526.6   15.7  ?     ?   393.668   34.1259      598.755    34.1259      218.126    34.1259      
1 1 1 13  3  15 o 0 208.7   13.9  ?     ?   92.6009   -159.972     270.851    -159.972     181.84     -159.972     
1 1 1 13  3  16 o 0 814     22.8  ?     ?   551.52    -46.2491     733.013    -46.2491     198.47     -46.2491     
1 1 1 13  3  17 o 0 150.2   14.7  ?     ?   378.37    -132.027     145.565    -132.027     211.099    47.9733      
1 1 1 13  3  18 o 0 102.4   12.4  ?     ?   157.218   51.572       156.727    51.572       9.58897    51.572       
1 1 1 13  3  19 o 0 100.7   16.4  ?     ?   149.487   51.2664      183.813    51.2664      43.7547    51.2664      
1 1 1 13  3  20 o 0 84.2    13.1  ?     ?   230.343   113.105      153.236    113.105      88.4935    -66.8947     
1 1 1 13  3  21 o 0 3.4     19.5  ?     ?   42.5198   120.587      9.71744    -59.413      53.1929    -59.413      
1 1 1 13  3  22 o 0 20.9    18.5  ?     ?   120.994   140.241      30.6823    140.241      86.8967    -39.7592     
1 1 1 13  3  23 o 0 39.9    22.3  ?     ?   53.852    58.1015      80.4503    58.1015      28.401     58.1015      
1 1 1 13  3  24 o 0 242.4   23.1  ?     ?   347.076   -145.325     389.786    -145.325     54.6053    -145.325     
1 1 1 13  3  25 o 0 65.8    23.3  ?     ?   92.1977   33.606       217.572    33.606       121.153    33.606       
1 1 1 13  3  26 o 0 -5.6    26.2  ?     ?   72.3614   42.5082      19.3508    42.5082      53.0284    -137.492     
1 1 1 13  3  27 o 0 113.2   31.5  ?     ?   224.011   119.705      249.351    119.705      35.1025    119.705      
1 1 1 -13 5  27 o 0 141     19.4  ?     ?   236.545   146.329      310.803    146.329      96.0755    146.329      
1 1 1 -13 5  26 o 0 87.5    16.6  ?     ?   149.591   135.906      258.443    135.906      119.477    135.906      
1 1 1 -13 5  25 o 0 25.5    14.9  ?     ?   134.62    -91.1361     52.6114    -91.1361     76.63      88.8639      
1 1 1 -13 5  24 f 1 124.1   13    ?     ?   257.377   -169.258     252.691    -169.258     5.35237    10.7425      
1 1 1 -13 5  23 o 0 92.7    13.9  ?     ?   208.139   -136.493     218.75     -136.493     25.3697    -136.493     
1 1 1 -13 5  22 o 0 66.4    10.4  ?     ?   171.044   -115.233     175.231    -115.233     16.6038    -115.233     
1 1 1 -13 5  21 o 0 330     12.9  ?     ?   417.057   -88.2957     441.594    -88.2957     40.8414    -88.2957     
1 1 1 -13 5  20 o 0 9.2     7.5   ?     ?   161.568   27.1358      83.904     -152.864     243.36     -152.864     
1 1 1 -13 5  19 o 0 257.7   10.9  ?     ?   263.078   84.1716      460.143    84.1716      193.378    84.1716      
1 1 1 -13 5  18 o 0 325.3   10.5  ?     ?   429.532   -166.179     358.526    -166.179     30.7318    13.8205      
1 1 1 -13 5  17 o 0 74.6    6.5   ?     ?   334.789   -123.711     10.7277    -123.711     292.644    56.2892      
1 1 1 -13 5  16 f 1 41.2    7.3   ?     ?   196.709   -58.1438     15.4021    121.856      196.045    121.856      
1 1 1 -13 5  15 o 0 330     9.6   ?     ?   267.2     -48.9445     469.565    -48.9445     218.303    -48.9445     
1 1 1 -13 5  14 o 0 344     10.3  ?     ?   458.901   129.222      341.96     129.222      98.0099    -50.778      
1 1 1 -13 5  13 o 0 579.4   15.4  ?     ?   862.437   144.332      222.666    144.332      588.041    -35.6685     
1 1 1 -13 5  12 o 0 302.8   13.4  ?     ?   392.953   141.876      338.204    141.876      38.4715    -38.124      
1 1 1 -13 5  11 o 0 1157.2  21.1  ?     ?   473.54    150.121      1013.64    150.121      556.993    150.121      
1 1 1 -13 5  10 o 0 3121.4  67.6  ?     ?   1369.98   42.0853      1157.71    42.0853      170.673    -137.915     
1 1 1 -13 5  9  o 0 128.2   6.8   ?     ?   106.739   6.47942      185.484    6.47942      77.2771    6.47942      
1 1 1 -13 5  8  o 0 432.3   8.6   ?     ?   678.673   57.3796      266.248    57.3796      424.848    -122.62      
1 1 1 -13 5  7  o 0 1272.6  26.9  ?     ?   614.788   -126.046     1040.43    -126.046     411.912    -126.046     
1 1 1 -13 5  6  o 0 177.5   4.3   ?     ?   232.774   139.243      294.51     139.243      55.7283    139.243      
1 1 1 -13 5  4  o 0 644.6   13.9  ?     ?   706.367   3.68126      480.137    3.68126      258.411    -176.319     
1 1 1 -13 5  3  f 1 398.8   7.7   ?     ?   533.303   -66.8368     380.707    -66.8368     180.677    113.163      
1 1 1 -13 5  2  o 0 337.2   7.4   ?     ?   165.736   112.003      576.167    112.003      402.411    112.003      
1 1 1 -13 5  1  o 0 1775.7  43    ?     ?   918.435   37.0967      1094.49    37.0967      131.09     37.0967      
1 1 1 13  5  0  o 0 918.9   37.8  ?     ?   713.561   103.158      711.224    103.158      31.708     -76.8423     
1 1 1 13  5  1  o 0 30.4    2.8   ?     ?   307.831   -107.527     141.388    72.4729      462.526    72.4729      
1 1 1 13  5  2  o 0 330.4   7     ?     ?   420.031   106.332      399.859    106.332      39.0758    -73.6679     
1 1 1 13  5  3  f 1 1871.5  33.2  ?     ?   1007.13   0.342511     1052.03    0.342511     7.17475    -179.657     
1 1 1 13  5  4  o 0 233.6   6.4   ?     ?   334.756   37.2927      330.81     37.2927      19.6974    -142.707     
1 1 1 13  5  5  o 0 190.3   5.1   ?     ?   178.902   179.242      345.172    179.242      156.212    179.242      
1 1 1 13  5  6  o 0 697.7   14.1  ?     ?   690.505   -60.3383     529.411    -60.3383     183.073    119.662      
1 1 1 13  5  7  o 0 1674.6  30.6  ?     ?   1040.47   -97.281      877.901    -97.281      194.213    82.719       
1 1 1 13  5  8  o 0 705.1   15.2  ?     ?   558.526   -82.8652     662.289    -82.8652     87.9623    -82.8652     
1 1 1 13  5  9  o 0 679.9   14    ?     ?   621.001   -77.5068     577.586    -77.5068     59.2406    102.493      
1 1 1 13  5  10 o 0 573.8   12.8  ?     ?   169.188   26.0898      783.261    26.0898      617.038    26.0898      
1 1 1 13  5  11 o 0 1433.2  30.1  ?     ?   820.131   173.522      882.52     173.522      79.9455    173.522      
1 1 1 13  5  12 o 0 654.9   16.5  ?     ?   521.332   33.971       602.158    33.971       94.2888    33.971       
1 1 1 13  5  13 o 0 233.6   10.9  ?     ?   556.505   149.474      110.477    149.474      421.898    -30.5256     
1 1 1 13  5  14 o 0 541.7   15.8  ?     ?   455.802   20.9712      567.575    20.9712      122.257    20.9712      
1 1 1 13  5  15 o 0 552.2   16.7  ?     ?   383.961   90.2153      638.889    90.2153      270.482    90.2153      
1 1 1 13  5  16 f 1 127.2   12    ?     ?   260.992   160.206      179.689    160.206      65.1727    -19.7944     
1 1 1 13  5  17 o 0 570.7   17.8  ?     ?   422.329   71.9887      638.349    71.9887      243.459    71.9887      
1 1 1 13  5  18 o 0 35.5    12.8  ?     ?   162.77    -29.2636     6.22297    150.736      157.295    150.736      
1 1 1 13  5  19 o 0 342.2   16.9  ?     ?   357.639   -5.33144     508.37     -5.33144     136.507    -5.33144     
1 1 1 13  5  20 o 0 101.5   16.2  ?     ?   135.33    -9.7825      270.241    -9.7825      133.122    -9.7825      
1 1 1 13  5  21 o 0 47.1    18.7  ?     ?   159.111   10.7753      101.508    10.7753      55.6483    -169.225     
1 1 1 13  5  22 o 0 474     25.4  ?     ?   478.51    28.5222      573.688    28.5222      115.254    28.5222      
1 1 1 13  5  23 o 0 294.2   23.6  ?     ?   400.989   52.9493      414.536    52.9493      30.6439    52.9493      
1 1 1 13  5  24 f 1 13      27.4  ?     ?   114.792   54.9254      41.8159    54.9254      76.9248    -125.075     
1 1 1 13  5  25 o 0 112.3   25.5  ?     ?   118.444   55.099       344.366    55.099       226.897    55.099       
1 1 1 13  5  26 o 0 15.3    26.8  ?     ?   151.893   163.987      39.0047    163.987      105.047    -16.0126     
1 1 1 13  5  27 < 0 118.9   30.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 7  26 o 0 221.1   19.4  ?     ?   274.066   -106.49      414.228    -106.49      169.47     -106.49      
1 1 1 -13 7  25 o 0 3.2     14.7  ?     ?   148.063   -34.6429     19.8701    145.357      153.412    145.357      
1 1 1 -13 7  24 o 0 34      17.1  ?     ?   151.729   79.383       77.7513    79.383       65.53      -100.617     
1 1 1 -13 7  23 o 0 49.8    14.3  ?     ?   118.485   -91.3878     162.49     -91.3877     45.3811    -91.3877     
1 1 1 -13 7  22 o 0 -0.5    12.7  ?     ?   27.7223   112.633      7.19644    -67.3671     32.5256    -67.3671     
1 1 1 -13 7  21 o 0 23.9    10.1  ?     ?   146.627   -15.9113     25.6457    -15.9113     108.568    164.089      
1 1 1 -13 7  20 o 0 396.2   14.5  ?     ?   388.037   -62.8843     552.102    -62.8843     194.646    -62.8843     
1 1 1 -13 7  19 o 0 52.6    11    ?     ?   259.408   60.2355      58.6807    60.2355      188.779    -119.765     
1 1 1 -13 7  18 o 0 142.2   10.4  ?     ?   297.216   91.2053      241.492    91.2053      49.5466    -88.7947     
1 1 1 -13 7  17 o 0 179.8   10    ?     ?   282.527   54.7594      312.825    54.7594      28.7431    54.7594      
1 1 1 -13 7  16 o 0 793.9   17.3  ?     ?   625.103   85.8506      627.722    85.8506      66.3238    85.8506      
1 1 1 -13 7  15 o 0 198.5   8.5   ?     ?   405.995   65.7081      198.249    65.7081      166.112    -114.292     
1 1 1 -13 7  14 o 0 257.3   8.9   ?     ?   429.333   158.226      267.267    158.226      120.961    -21.7738     
1 1 1 -13 7  13 f 1 237.9   7.9   ?     ?   466.155   -26.6895     195.248    -26.6895     240.543    153.311      
1 1 1 -13 7  12 o 0 50.9    5.4   ?     ?   48.2025   13.1465      8.83007    13.1465      36.3006    -166.853     
1 1 1 -13 7  11 o 0 220.8   7.1   ?     ?   127.925   -102.708     321.297    -102.708     202.53     -102.708     
1 1 1 -13 7  10 o 0 516.6   10.8  ?     ?   474.285   167.615      503.48     167.615      60.6477    167.615      
1 1 1 -13 7  9  o 0 8.5     3     ?     ?   147.361   -89.5946     112.763    90.4054      252.888    90.4054      
1 1 1 -13 7  8  o 0 817.4   15.5  ?     ?   606.73    -73.2361     647.337    -73.2361     67.7157    -73.2361     
1 1 1 -13 7  7  f 1 421.2   8.5   ?     ?   541.676   -41.896      347.88     -41.896      174.394    138.104      
1 1 1 -13 7  6  f 1 1837.7  32.4  ?     ?   997.97    -15.136      968.308    -15.136      48.3571    164.864      
1 1 1 -13 7  5  o 0 574.7   11.3  ?     ?   269.255   -9.5547      772.099    -9.5547      501.65     -9.5547      
1 1 1 -13 7  4  o 0 104.2   4.2   ?     ?   216.702   122.006      144.545    122.006      73.6486    -57.994      
1 1 1 -13 7  3  o 0 664.3   12.5  ?     ?   672.127   113.812      505.154    113.812      172.87     -66.1883     
1 1 1 -13 7  2  o 0 945.9   20.7  ?     ?   633.149   -173.753     778.366    -173.753     138.81     -173.753     
1 1 1 -13 7  1  o 0 721.2   18.9  ?     ?   862.297   161.431      372.218    161.431      499.515    -18.5685     
1 1 1 13  7  0  o 0 329.1   7.3   ?     ?   564.161   -123.156     247.042    -123.156     321.353    56.8444      
1 1 1 13  7  1  o 0 422.4   10.7  ?     ?   337.791   -64.8134     562.14     -64.8134     221.382    -64.8134     
1 1 1 13  7  2  o 0 270.2   6.1   ?     ?   501.208   137.07       225.477    137.07       280.584    -42.9298     
1 1 1 13  7  3  o 0 1774.4  31.5  ?     ?   1016.04   -123.486     941.667    -123.486     84.6637    56.514       
1 1 1 13  7  4  o 0 173.4   5.1   ?     ?   332.674   -14.841      216.18     -14.841      119.844    165.159      
1 1 1 13  7  5  o 0 1374.4  24.9  ?     ?   647.518   -86.6408     1062.43    -86.6408     408.794    -86.6408     
1 1 1 13  7  6  f 1 178.4   6.1   ?     ?   606.978   33.3244      30.6798    -146.676     653.236    -146.676     
1 1 1 13  7  7  f 1 1662.3  34.7  ?     ?   1199.39   19.4416      638.159    19.4416      528.192    -160.558     
1 1 1 13  7  8  o 0 2367.1  42.8  ?     ?   1301.29   -98.6816     896.863    -98.6816     359.091    81.3184      
1 1 1 13  7  9  o 0 208.3   7.9   ?     ?   530.819   -70.8462     89.7163    -70.8462     421.079    109.154      
1 1 1 13  7  10 o 0 359.7   10.5  ?     ?   229.723   -139.987     518.801    -139.987     301.401    -139.987     
1 1 1 13  7  11 o 0 94      8.3   ?     ?   163.285   149.288      109.743    149.288      44.1447    -30.7117     
1 1 1 13  7  12 o 0 1359.6  29.6  ?     ?   525.293   83.025       1119.05    83.025       619.059    83.025       
1 1 1 13  7  13 f 1 393.1   14.1  ?     ?   207.012   -71.0137     575.82     -71.0137     378.795    -71.0137     
1 1 1 13  7  14 o 0 336.2   13.7  ?     ?   321.243   -43.3464     457.91     -43.3464     161.763    -43.3464     
1 1 1 13  7  15 o 0 49.2    11.5  ?     ?   202.607   88.8357      7.46775    88.8357      178.156    -91.1643     
1 1 1 13  7  16 o 0 47.9    10.9  ?     ?   263.516   144.281      5.94655    -35.7195     247.865    -35.7195     
1 1 1 13  7  17 o 0 286.6   16.3  ?     ?   468.018   163.776      321.369    163.776      160.307    -16.2242     
1 1 1 13  7  18 o 0 302.2   17.6  ?     ?   385.462   -135.268     432.873    -135.268     46.0363    -135.268     
1 1 1 13  7  19 o 0 9       17.6  ?     ?   165.506   179.273      39.6407    -0.726953    201.657    -0.726953    
1 1 1 13  7  20 o 0 165.2   21.4  ?     ?   329.671   -145.42      274.617    -145.42      37.4205    34.5796      
1 1 1 13  7  21 o 0 156.5   21.4  ?     ?   301.215   75.4484      279.202    75.4484      4.45033    -104.552     
1 1 1 13  7  22 o 0 75.6    19.9  ?     ?   220.969   69.1367      167.985    69.1367      50.0519    -110.863     
1 1 1 13  7  23 o 0 1.4     26.3  ?     ?   92.8918   134.655      30.3563    134.655      64.3421    -45.3454     
1 1 1 13  7  24 o 0 -30.8   23.8  ?     ?   128.044   17.3082      38.778     -162.692     163.656    -162.692     
1 1 1 13  7  25 o 0 27.4    25.5  ?     ?   149.701   -16.2255     65.0436    -16.2255     74.5838    163.774      
1 1 1 13  7  26 < 0 22.7    28.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 9  24 o 0 38.3    15.9  ?     ?   121.919   17.6483      121.529    17.6483      14.0115    17.6483      
1 1 1 -13 9  23 o 0 149.7   16.8  ?     ?   240.516   -15.3544     316.128    -15.3544     99.201     -15.3544     
1 1 1 -13 9  22 o 0 172.1   14.5  ?     ?   325.478   4.45204      283.361    4.45204      19.8183    -175.548     
1 1 1 -13 9  21 o 0 30.6    12.8  ?     ?   31.7379   -77.6265     49.4897    -77.6265     18.7952    -77.6265     
1 1 1 -13 9  20 o 0 11.2    12    ?     ?   137.212   161.287      19.3891    -18.7126     142.907    -18.7126     
1 1 1 -13 9  19 o 0 46.9    9.7   ?     ?   71.4423   -82.5268     126.678    -82.5268     62.2886    -82.5268     
1 1 1 -13 9  18 o 0 71.7    9.4   ?     ?   52.3537   -116.406     173.386    -116.406     125.929    -116.406     
1 1 1 -13 9  17 o 0 210.1   10.3  ?     ?   283.042   25.2773      377.08     25.2773      111.567    25.2773      
1 1 1 -13 9  16 o 0 246.4   10.8  ?     ?   320.973   -179.118     394.195    -179.118     85.3353    -179.118     
1 1 1 -13 9  15 o 0 81.8    6.9   ?     ?   180.937   -56.7175     169.144    -56.7175     9.51097    123.283      
1 1 1 -13 9  14 o 0 63      7.1   ?     ?   177.431   -89.3093     117.555    -89.3093     58.9927    90.6907      
1 1 1 -13 9  13 o 0 743.8   18.4  ?     ?   524.048   -142.741     666.933    -142.741     201.759    -142.741     
1 1 1 -13 9  12 o 0 1054.9  21.3  ?     ?   772.625   157.464      682.65     157.464      1.8331     -22.5357     
1 1 1 -13 9  11 o 0 117.5   5.6   ?     ?   128.895   -96.0395     174.507    -96.0395     59.598     -96.0395     
1 1 1 -13 9  10 o 0 275.5   9.3   ?     ?   448.058   67.6183      259.774    67.6183      150.527    -112.382     
1 1 1 -13 9  9  o 0 849.2   19.5  ?     ?   801.448   75.1126      505.594    75.1126      232.194    -104.887     
1 1 1 -13 9  8  o 0 491.4   10.3  ?     ?   561.806   108.54       412.252    108.54       107.391    -71.4602     
1 1 1 -13 9  7  o 0 667.5   14.8  ?     ?   665.436   27.4045      465.308    27.4045      143.843    -152.596     
1 1 1 -13 9  6  o 0 466     9.9   ?     ?   384.077   39.1646      517.817    39.1646      164.924    39.1646      
1 1 1 -13 9  5  o 0 112.7   5.2   ?     ?   283.948   -145.638     109.981    -145.638     151.739    34.3619      
1 1 1 -13 9  4  o 0 1331.9  24.3  ?     ?   768.19    41.5532      840.451    41.5532      130.527    41.5532      
1 1 1 -13 9  3  f 1 260.8   9.9   ?     ?   358.383   -94.829      302.111    -94.829      35.8977    85.171       
1 1 1 -13 9  2  o 0 1328.5  24.9  ?     ?   972.897   -135.256     646.893    -135.256     267.462    44.7436      
1 1 1 -13 9  1  o 0 1119.5  21.8  ?     ?   728.253   -124.497     740.608    -124.497     55.4195    -124.497     
1 1 1 13  9  0  o 0 1409.1  28.7  ?     ?   914.382   126.44       748.871    126.44       111.815    -53.5595     
1 1 1 13  9  1  o 0 300.8   8.5   ?     ?   308.455   156.201      393.587    156.201      103.034    156.201      
1 1 1 13  9  2  o 0 33.9    3.6   ?     ?   137.768   -42.1741     31.259     137.826      161.072    137.826      
1 1 1 13  9  3  f 1 685.8   17.4  ?     ?   700.341   -137.186     446.911    -137.186     216.301    42.8138      
1 1 1 13  9  4  o 0 105.5   5.1   ?     ?   270.694   52.0976      102.693    52.0976      148.864    -127.902     
1 1 1 13  9  5  o 0 730.8   20.7  ?     ?   742.96    -17.1022     455.291    -17.1022     234.378    162.898      
1 1 1 13  9  6  o 0 273     10    ?     ?   339.869   -166.771     334.505    -166.771     19.5297    -166.771     
1 1 1 13  9  7  o 0 897     21.5  ?     ?   605.548   -109.4       700.098    -109.4       140.121    -109.4       
1 1 1 13  9  8  o 0 227.6   9.1   ?     ?   231.412   138.597      346.505    138.597      129.952    138.597      
1 1 1 13  9  9  o 0 294.6   10.7  ?     ?   366.291   25.8305      353.922    25.8305      12.266     25.8305      
1 1 1 13  9  10 o 0 436.7   16    ?     ?   287.151   -46.382      572.76     -46.382      305.938    -46.382      
1 1 1 13  9  11 o 0 322.9   10.7  ?     ?   322.549   -15.9397     433.116    -15.9397     140.915    -15.9397     
1 1 1 13  9  12 o 0 87      9.3   ?     ?   273.668   123.95       79.6513    123.95       167.066    -56.0501     
1 1 1 13  9  13 o 0 720.1   18.9  ?     ?   558.588   146.221      631.06     146.221      125.791    146.221      
1 1 1 13  9  14 o 0 40.6    10.5  ?     ?   61.1933   160.53       43.1857    160.53       18.9466    -19.4697     
1 1 1 13  9  15 o 0 50.5    11.1  ?     ?   122.897   172.603      89.8314    172.603      34.1606    -7.39689     
1 1 1 13  9  16 o 0 158.1   14    ?     ?   206.415   81.9565      346.312    81.9565      143.089    81.9565      
1 1 1 13  9  17 o 0 12.1    13.5  ?     ?   151.705   -4.16707     35.1822    175.833      180.978    175.833      
1 1 1 13  9  18 o 0 60.1    16.8  ?     ?   204.876   -13.136      129.357    -13.136      61.1529    166.864      
1 1 1 13  9  19 o 0 19.3    17.1  ?     ?   169.794   -148.26      1.32434    31.74        158.513    31.74        
1 1 1 13  9  20 o 0 261.3   22.4  ?     ?   382.466   -174.54      371.162    -174.54      17.0579    -174.54      
1 1 1 13  9  21 o 0 145.2   24.3  ?     ?   195.998   125.37       343.21     125.37       146.536    125.37       
1 1 1 13  9  22 o 0 240.7   29.1  ?     ?   281.311   156.889      439.505    156.889      169.299    156.889      
1 1 1 13  9  23 o 0 44.2    24.9  ?     ?   304.215   129.368      20.5553    -50.632      303.856    -50.632      
1 1 1 -13 11 23 < 0 1.6     24.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 11 22 o 0 29.6    13.3  ?     ?   137.117   137.7        80.8016    137.7        37.5242    -42.3004     
1 1 1 -13 11 21 o 0 38.4    15.5  ?     ?   108.54    71.5802      123.504    71.5802      29.0188    71.5802      
1 1 1 -13 11 20 o 0 36.1    15.7  ?     ?   139.676   -133.525     87.9269    -133.525     39.2262    46.475       
1 1 1 -13 11 19 o 0 22.5    13.4  ?     ?   120.511   134.884      43.4916    134.884      71.1904    -45.1162     
1 1 1 -13 11 18 o 0 121.3   12    ?     ?   247.272   126.927      246.242    126.927      10.415     126.927      
1 1 1 -13 11 17 o 0 8.5     10.3  ?     ?   23.5963   -41.1667     1.51399    138.833      22.437     138.833      
1 1 1 -13 11 16 o 0 369.6   14.2  ?     ?   393.855   94.8159      493.06     94.8159      143.813    94.8159      
1 1 1 -13 11 15 o 0 29.9    8.7   ?     ?   102.328   51.0091      68.5272    51.0091      22.6239    -128.991     
1 1 1 -13 11 14 o 0 69.1    8.4   ?     ?   180.078   166.649      163.876    166.649      1.9223     -13.3509     
1 1 1 -13 11 13 o 0 5       6.4   ?     ?   70.8429   -174.892     42.5263    5.10825      109.35     5.10825      
1 1 1 -13 11 12 f 1 334.3   10.1  ?     ?   343.452   -96.6511     488.195    -96.6511     160.316    -96.6511     
1 1 1 -13 11 11 o 0 224.4   8.2   ?     ?   219.784   163.295      423.648    163.295      209.832    163.295      
1 1 1 -13 11 10 o 0 459.4   11.3  ?     ?   526.84    127.034      463.036    127.034      52.529     -52.9655     
1 1 1 -13 11 9  o 0 189.8   6.8   ?     ?   589.982   86.1322      36.505     86.1322      477.604    -93.8678     
1 1 1 -13 11 8  o 0 513.8   11.8  ?     ?   614.869   139.27       389.506    139.27       148.916    -40.7302     
1 1 1 -13 11 7  o 0 444.5   11    ?     ?   483.501   49.3694      428.575    49.3694      7.02129    49.3694      
1 1 1 -13 11 6  o 0 206.5   8.1   ?     ?   174.884   117.525      333.648    117.525      180.579    117.525      
1 1 1 -13 11 5  o 0 248.9   8.4   ?     ?   338.575   -135.694     315.266    -135.694     17.9281    -135.694     
1 1 1 -13 11 4  o 0 1809    44.5  ?     ?   803.884   159.486      1079.3     159.486      371.306    159.486      
1 1 1 -13 11 3  f 1 93.5    6     ?     ?   461.263   -42.2242     39.2429    137.776      448.536    137.776      
1 1 1 -13 11 2  o 0 577.2   21.2  ?     ?   333.079   88.8514      660.56     88.8514      359.704    88.8514      
1 1 1 -13 11 1  o 0 1314.8  27    ?     ?   884.351   152.517      729.16     152.517      70.7439    -27.4829     
1 1 1 13  11 0  o 0 272.6   7.5   ?     ?   364.867   133.422      317.455    133.422      13.8553    -46.5784     
1 1 1 13  11 1  o 0 333.8   9.1   ?     ?   538.019   -113.025     256.67     -113.025     232.015    66.9746      
1 1 1 13  11 2  o 0 413.8   10.3  ?     ?   323.185   -70.2716     512.594    -70.2716     219.081    -70.2716     
1 1 1 13  11 3  f 1 14.1    4.8   ?     ?   164.164   -117.242     94.5361    62.7583      241.188    62.7583      
1 1 1 13  11 4  o 0 171.6   7     ?     ?   452.051   72.564       117.903    72.564       283.444    -107.436     
1 1 1 13  11 5  o 0 534.5   13.1  ?     ?   614.726   -3.99091     415.505    -3.99091     129.443    176.009      
1 1 1 13  11 6  o 0 266.4   9.3   ?     ?   479.211   -58.6511     234.219    -58.6511     189.743    121.349      
1 1 1 13  11 7  o 0 82.2    7     ?     ?   92.5391   11.4483      85.1426    11.4483      3.47797    11.4483      
1 1 1 13  11 8  o 0 123.7   8.4   ?     ?   293.147   -0.880596    159.13     -0.880596    101.047    179.119      
1 1 1 13  11 9  o 0 122.8   8.3   ?     ?   184.843   -85.6039     215.504    -85.6039     52.0287    -85.6039     
1 1 1 13  11 10 o 0 131     9.1   ?     ?   196.253   54.4724      278.619    54.4724      83.4372    54.4724      
1 1 1 13  11 11 o 0 111.5   9.8   ?     ?   163.128   96.1237      250.623    96.1237      89.1221    96.1237      
1 1 1 13  11 12 f 1 180     12.2  ?     ?   261.907   124.362      337.089    124.362      82.3042    124.362      
1 1 1 13  11 13 o 0 235.4   15.1  ?     ?   181.276   -106.089     498.28     -106.089     326.723    -106.089     
1 1 1 13  11 14 o 0 43.9    12.6  ?     ?   236.63    -109.855     44.7679    -109.855     177.826    70.1447      
1 1 1 13  11 15 o 0 25.6    12.3  ?     ?   143.716   179.42       32.3418    179.42       98.6257    -0.580017    
1 1 1 13  11 16 o 0 6.2     15.4  ?     ?   233.378   179.939      88.9258    -0.0614133   300.913    -0.0614133   
1 1 1 13  11 17 o 0 132.9   19.8  ?     ?   303.182   157.744      220.749    157.744      54.9903    -22.2555     
1 1 1 13  11 18 o 0 -11.4   18.8  ?     ?   24.8317   -89.1631     3.37614    90.8369      27.6982    90.8369      
1 1 1 13  11 19 o 0 74.2    23.6  ?     ?   147.034   17.9466      199.039    17.9466      55.1513    17.9466      
1 1 1 13  11 20 o 0 36.2    30.6  ?     ?   130.256   72.5027      92.0501    72.5027      27.4988    -107.497     
1 1 1 13  11 21 o 0 68.6    34.8  ?     ?   159.765   80.7409      152.344    80.7409      8.95432    80.7409      
1 1 1 13  11 22 o 0 59      32.5  ?     ?   155.28    110.242      134.937    110.242      3.39549    -69.7578     
1 1 1 -13 13 20 < 0 240.9   26.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 13 19 f 1 77.9    18.6  ?     ?   140.62    -38.7541     225.038    -38.7541     105.562    -38.7541     
1 1 1 -13 13 18 o 0 22.7    15.3  ?     ?   89.314    106.963      68.486     106.963      7.5853     -73.0369     
1 1 1 -13 13 17 o 0 19.2    11.6  ?     ?   160.824   78.6104      12.5317    78.6104      127.563    -101.39      
1 1 1 -13 13 16 o 0 125.8   13.2  ?     ?   123.828   35.9156      344.291    35.9156      233.141    35.9156      
1 1 1 -13 13 15 o 0 76.5    12.1  ?     ?   177.993   -116.729     194.311    -116.729     27.5721    -116.729     
1 1 1 -13 13 14 o 0 93.9    10.5  ?     ?   143.646   -14.6153     262.219    -14.6153     127.588    -14.6153     
1 1 1 -13 13 13 o 0 74.5    8.9   ?     ?   263.092   -21.6297     122.233    -21.6297     106.629    158.37       
1 1 1 -13 13 12 o 0 5.1     7.5   ?     ?   91.0013   157.939      36.6252    -22.0614     115.652    -22.0614     
1 1 1 -13 13 11 f 1 152.3   8.6   ?     ?   231.605   21.4589      310.766    21.4589      108.042    21.4589      
1 1 1 -13 13 10 o 0 364.2   10.7  ?     ?   430.952   -8.28998     453.634    -8.28998     76.0754    -8.28998     
1 1 1 -13 13 9  f 1 214     9.3   ?     ?   381.037   -72.1028     286.547    -72.1028     59.4794    107.897      
1 1 1 -13 13 8  o 0 113     6.9   ?     ?   271.839   -136.082     200.451    -136.082     46.3929    43.9179      
1 1 1 -13 13 7  o 0 97.5    6     ?     ?   317.776   122.664      119.748    122.664      175.052    -57.336      
1 1 1 -13 13 6  o 0 13.6    5.3   ?     ?   55.8051   -124.647     13.8576    55.3526      65.8388    55.3526      
1 1 1 -13 13 5  o 0 719.5   15.6  ?     ?   535.166   -93.4849     701.144    -93.4849     200.865    -93.4849     
1 1 1 -13 13 4  o 0 212     7.6   ?     ?   371.875   -173.724     289.202    -173.724     59.505     6.27635      
1 1 1 -13 13 3  o 0 96      6     ?     ?   262.642   37.0752      147.141    37.0752      104.167    -142.925     
1 1 1 -13 13 2  o 0 73.8    6.7   ?     ?   183.777   -25.8043     141.459    -25.8043     34.759     154.196      
1 1 1 -13 13 1  o 0 246.2   8.5   ?     ?   168.113   -160.248     481.352    -160.248     319.887    -160.248     
1 1 1 13  13 0  o 0 77.3    5.7   ?     ?   179.999   104.194      154.282    104.194      19.8124    -75.8059     
1 1 1 13  13 1  o 0 85.3    6.5   ?     ?   164.692   85.5168      181.687    85.5168      22.4067    85.5168      
1 1 1 13  13 2  o 0 80.3    6.1   ?     ?   23.7758   83.5722      58.2977    83.5722      35.3146    83.5722      
1 1 1 13  13 3  o 0 143.5   7.2   ?     ?   281.981   138.583      234.842    138.583      37.4816    -41.4171     
1 1 1 13  13 4  o 0 22.9    7.1   ?     ?   192.241   5.76892      22.7426    -174.231     204.903    -174.231     
1 1 1 13  13 5  o 0 77.7    7.7   ?     ?   166.466   121.999      183.287    121.999      25.8442    121.999      
1 1 1 13  13 6  o 0 21      6.8   ?     ?   54.4347   -144.238     8.15277    -144.238     43.2109    35.7619      
1 1 1 13  13 7  o 0 53.8    8     ?     ?   141.801   30.7336      139.201    30.7336      8.0064     30.7336      
1 1 1 13  13 8  o 0 58.1    8.9   ?     ?   227.611   83.6689      99.047     83.6689      110.842    -96.3311     
1 1 1 13  13 9  f 1 23.6    9.6   ?     ?   104.55    -61.0052     26.0824    -61.0052     70.4552    118.995      
1 1 1 13  13 10 o 0 80      14.3  ?     ?   123.715   -123.909     225.772    -123.909     115.427    -123.909     
1 1 1 13  13 11 f 1 99.9    14.4  ?     ?   304.486   165.493      150.136    165.493      122.559    -14.5071     
1 1 1 13  13 12 o 0 84.3    13.6  ?     ?   181.569   9.30613      206.596    9.30613      45.6673    9.30613      
1 1 1 13  13 13 o 0 92.9    14.9  ?     ?   154.313   4.98443      245.379    4.98443      108.202    4.98443      
1 1 1 13  13 14 o 0 59.4    13.1  ?     ?   162.668   79.7395      159.543    79.7395      3.54845    79.7395      
1 1 1 13  13 15 o 0 160.7   21.1  ?     ?   222.599   27.1154      338.602    27.1154      124.973    27.1154      
1 1 1 13  13 16 o 0 24      20.2  ?     ?   152.608   30.974       33.8079    30.974       106.705    -149.026     
1 1 1 13  13 17 o 0 -5      18.4  ?     ?   21.0485   -49.4927     4.29861    -49.4927     14.5328    130.507      
1 1 1 13  13 18 o 0 18.8    23.2  ?     ?   94.9526   -58.9442     66.7351    -58.9442     16.4313    121.056      
1 1 1 13  13 19 f 1 31.6    22.7  ?     ?   165.211   -52.7047     61.4922    -52.7047     83.0392    127.295      
1 1 1 13  13 20 < 0 28.4    26.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 15 16 < 0 91.8    17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 15 15 o 0 93.3    14.3  ?     ?   249.188   114.704      183.318    114.704      22.4708    -65.2958     
1 1 1 -13 15 14 o 0 32.8    15    ?     ?   91.1943   102.37       103.786    102.37       28.0289    102.37       
1 1 1 -13 15 13 o 0 69.8    12.8  ?     ?   217.828   -83.0764     148.331    -83.0764     36.422     96.9236      
1 1 1 -13 15 12 o 0 45.5    12    ?     ?   180.249   -102.718     99.7372    -102.718     57.5235    77.2821      
1 1 1 -13 15 11 o 0 69.3    11    ?     ?   143.601   43.3931      197.716    43.3931      71.5878    43.3931      
1 1 1 -13 15 10 o 0 243.8   12.8  ?     ?   283.614   -2.67701     407.304    -2.67701     147.911    -2.67701     
1 1 1 -13 15 9  o 0 27.1    8.5   ?     ?   73.9271   -24.3386     71.2172    -24.3386     3.72177    -24.3386     
1 1 1 -13 15 8  f 1 79.1    7.8   ?     ?   195.589   91.0369      184.6      91.0369      4.16514    91.0369      
1 1 1 -13 15 7  o 0 40.9    7.2   ?     ?   168.835   143.531      93.9269    143.531      56.4424    -36.4691     
1 1 1 -13 15 6  o 0 10.8    7.6   ?     ?   91.7307   38.5327      12.1718    -141.467     90.4317    -141.467     
1 1 1 -13 15 5  o 0 59.8    7.6   ?     ?   242.682   59.9955      97.5129    59.9955      110.317    -120.005     
1 1 1 -13 15 4  o 0 25.4    6.5   ?     ?   135.388   66.0904      48.238     66.0904      68.0909    -113.91      
1 1 1 -13 15 3  o 0 27.7    6.8   ?     ?   89.9753   91.1342      60.1055    91.1342      16.7493    -88.8658     
1 1 1 -13 15 2  o 0 148.7   8.8   ?     ?   228.001   153.711      301.727    153.711      106.513    153.711      
1 1 1 -13 15 1  o 0 39.8    7.7   ?     ?   151.269   -121.012     92.5376    -121.012     37.2247    58.9875      
1 1 1 13  15 0  o 0 52      7.9   ?     ?   275.632   -6.16919     49.995     -6.16919     188.786    173.831      
1 1 1 13  15 1  o 0 4.4     8.4   ?     ?   39.6223   32.3944      14.2788    -147.606     48.591     -147.606     
1 1 1 13  15 2  o 0 26.2    9.3   ?     ?   85.8431   -109.613     49.2195    -109.613     25.0585    70.3866      
1 1 1 13  15 3  o 0 53.7    10.2  ?     ?   161.49    140.421      132.668    140.421      6.8888     -39.5785     
1 1 1 13  15 4  o 0 80.5    10.3  ?     ?   232.911   67.6713      159.886    67.6713      42.809     -112.329     
1 1 1 13  15 5  o 0 15.4    9.9   ?     ?   87.9346   174.143      10.2522    174.143      66.1079    -5.85665     
1 1 1 13  15 6  o 0 319.2   13.5  ?     ?   393.744   -178.266     417.149    -178.266     76.136     -178.266     
1 1 1 13  15 7  o 0 51      11.6  ?     ?   134.078   -129.071     149.071    -129.071     23.4083    -129.071     
1 1 1 13  15 8  f 1 108.6   12.8  ?     ?   217.678   -23.6927     236.938    -23.6927     32.609     -23.6927     
1 1 1 13  15 9  o 0 21.1    14.2  ?     ?   152.862   -40.3596     19.0204    -40.3596     124.22     139.64       
1 1 1 13  15 10 o 0 34.3    15.3  ?     ?   200.165   -97.9443     34.1882    -97.9443     152.527    82.0557      
1 1 1 13  15 11 o 0 26.9    17.7  ?     ?   127.373   -61.1451     60.093     -61.1451     54.1445    118.855      
1 1 1 13  15 12 o 0 30.9    17.3  ?     ?   155.335   -91.5385     59.7793    -91.5385     75.8824    88.4615      
1 1 1 13  15 13 o 0 27.9    21.4  ?     ?   165.21    160.751      43.5352    160.751      99.8904    -19.2486     
1 1 1 13  15 14 o 0 -1.6    20.4  ?     ?   102.13    -158.203     15.9608    -158.203     70.9834    21.797       
1 1 1 13  15 15 o 0 9.4     14.8  ?     ?   122.712   38.839       18.9932    38.839       84.984     -141.161     
1 1 1 13  15 16 < 0 79.4    22.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 17 10 < 0 31.4    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 17 9  < 0 53.2    14    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -13 17 8  o 0 81.5    13.1  ?     ?   158.275   70.0879      221.062    70.0879      92.907     70.0879      
1 1 1 -13 17 7  o 0 31.7    12.6  ?     ?   67.5831   33.2272      115.403    33.2272      60.4095    33.2272      
1 1 1 -13 17 6  o 0 103.6   12.7  ?     ?   217.637   -76.9835     227.126    -76.9835     49.634     -76.9835     
1 1 1 -13 17 5  o 0 12.2    10.7  ?     ?   10.1796   -65.4917     6.511      -65.4917     1.82417    114.508      
1 1 1 -13 17 4  o 0 18.1    10.6  ?     ?   81.9628   -170.679     48.7463    -170.679     18.6032    9.32139      
1 1 1 -13 17 3  o 0 86.5    12.5  ?     ?   142.351   -160.462     239.23     -160.462     120.351    -160.462     
1 1 1 -13 17 2  o 0 48.8    11.7  ?     ?   122.95    46.9664      150.765    46.9664      47.8209    46.9664      
1 1 1 -13 17 1  o 0 8.6     11.5  ?     ?   12.4541   12.1493      3.58117    12.1493      6.86868    -167.851     
1 1 1 13  17 0  o 0 84.7    12.6  ?     ?   218.303   109.764      186.022    109.764      0.552727   109.764      
1 1 1 13  17 1  o 0 28.8    11.4  ?     ?   103.147   81.6094      83.576     81.6094      3.99974    -98.3906     
1 1 1 13  17 2  o 0 20.1    11.8  ?     ?   138.553   -56.3102     29.657     -56.3102     87.851     123.69       
1 1 1 13  17 3  o 0 124.1   12.1  ?     ?   231.235   -35.1316     260.064    -35.1316     64.2558    -35.1316     
1 1 1 13  17 4  o 0 27.5    14.5  ?     ?   59.1772   -150.744     82.8905    -150.744     33.5317    -150.744     
1 1 1 13  17 5  o 0 140.3   17.1  ?     ?   263.291   130.571      264.63     130.571      45.5629    130.571      
1 1 1 13  17 6  o 0 73      15.2  ?     ?   198.838   120.97       171.164    120.97       6.20644    120.97       
1 1 1 13  17 7  o 0 48.7    16.6  ?     ?   146.257   -50.1746     133.351    -50.1746     12.154     -50.1746     
1 1 1 13  17 8  o 0 54.6    18.1  ?     ?   155.017   -62.9112     142.154    -62.9112     14.1924    -62.9112     
1 1 1 13  17 9  < 0 141.3   21.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 13  17 10 < 0 100.3   21.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 0  28 o 0 -30.1   21.7  ?     ?   35.456    180          9.68523    180          23.1866    2.93093e-15  
1 1 1 -14 0  27 o 0 2.4     21.2  ?     ?   102.404   0            37.3139    0            59.8017    180          
1 1 1 -14 0  26 o 0 86.5    22.8  ?     ?   142.524   0            212.261    0            72.6358    0            
1 1 1 -14 0  25 o 0 22.3    23.1  ?     ?   29.6448   0            20.8       0            9.36045    180          
1 1 1 -14 0  24 o 0 12.5    31.2  ?     ?   81.8618   180          36.7741    180          40.0958    6.43543e-15  
1 1 1 -14 0  23 o 0 -29.2   23.5  ?     ?   15.3309   180          2.24892    180          12.2406    1.28915e-15  
1 1 1 -14 0  22 o 0 32.5    13    ?     ?   86.2866   0            69.5592    0            14.9       180          
1 1 1 -14 0  21 o 0 -1.7    12    ?     ?   0.519473  0            0.0546788  0            0.467322   180          
1 1 1 -14 0  20 o 0 34.8    10.8  ?     ?   252.648   180          119.819    180          140.905    5.96667e-15  
1 1 1 -14 0  19 o 0 60.2    9.9   ?     ?   248.131   180          149.145    180          79.5884    1.31489e-14  
1 1 1 -14 0  18 o 0 82.7    10.2  ?     ?   399.967   180          195.005    180          173.472    7.88768e-15  
1 1 1 -14 0  17 o 0 282     13.1  ?     ?   636.594   180          376.805    180          226.751    1.166e-14    
1 1 1 -14 0  16 o 0 8.7     10.4  ?     ?   240.834   180          16.6706    180          216.098    5.41294e-16  
1 1 1 -14 0  15 f 1 439.9   18.1  ?     ?   660.68    0            464.811    0            164.371    180          
1 1 1 -14 0  14 o 0 249.9   9.7   ?     ?   129.881   0            279.811    0            154.354    0            
1 1 1 -14 0  13 f 1 2278.6  55.9  ?     ?   1213.17   0            1070.88    0            113.73     180          
1 1 1 -14 0  12 o 0 19.7    6.4   ?     ?   19.0054   0            4.32299    0            14.9831    180          
1 1 1 -14 0  11 o 0 1158.5  41.4  ?     ?   530.768   0            811.528    0            269.878    0            
1 1 1 -14 0  10 o 0 2.1     2.7   ?     ?   22.2384   0            0.454735   0            22.3307    180          
1 1 1 -14 0  9  o 0 1306.3  33    ?     ?   723.765   180          888.335    180          133.744    180          
1 1 1 -14 0  8  o 0 88.4    4.4   ?     ?   304.275   0            210.388    0            107.706    180          
1 1 1 -14 0  7  o 0 252.9   7.6   ?     ?   363.673   0            361.25     0            9.36419    0            
1 1 1 -14 0  6  o 0 1401.6  36    ?     ?   920.012   180          855.063    180          36.2742    1.65399e-13  
1 1 1 -14 0  5  o 0 7.4     1.2   ?     ?   142.87    180          12.402     180          126.096    6.90123e-16  
1 1 1 -14 0  4  o 0 80.5    2.9   ?     ?   149.772   0            120.743    0            18.7657    180          
1 1 1 -14 0  2  o 0 422.2   11    ?     ?   651.246   180          440.966    180          151.741    2.03909e-14  
1 1 1 -14 0  1  o 0 247.3   9.9   ?     ?   629.884   0            337.492    0            236.027    180          
1 1 1 14  0  0  o 0 885     23    ?     ?   501.003   -180         639.629    180          182.769    180          
1 1 1 14  0  1  o 0 304.3   9.1   ?     ?   548.467   180          375.999    180          125.42     2.10355e-14  
1 1 1 14  0  2  o 0 5158    143.2 ?     ?   1747.54   180          1586.78    180          52.5373    2.11925e-13  
1 1 1 14  0  3  o 0 11.7    2.1   ?     ?   164.072   0            21.4303    0            132.942    180          
1 1 1 14  0  4  o 0 12.8    2     ?     ?   298.612   180          40.152     180          241.468    1.16676e-15  
1 1 1 14  0  5  o 0 437.3   17    ?     ?   521.504   0            484.449    0            28.1479    180          
1 1 1 14  0  6  o 0 815.9   21.9  ?     ?   743.017   0            662.263    0            68.4175    180          
1 1 1 14  0  7  o 0 356.4   11.6  ?     ?   541.082   0            437.472    0            94.395     180          
1 1 1 14  0  8  o 0 273.9   9.8   ?     ?   444.668   0            414.31     0            58.2908    180          
1 1 1 14  0  9  o 0 1015.4  27.2  ?     ?   461.994   180          796.8      180          306.778    180          
1 1 1 14  0  10 o 0 11.2    6.8   ?     ?   45.4634   180          4.73104    180          42.6906    7.77602e-16  
1 1 1 14  0  11 o 0 1073.9  30    ?     ?   708.68    0            796.274    0            59.5145    0            
1 1 1 14  0  12 o 0 136.9   11.5  ?     ?   169.899   180          224.008    180          48.0619    180          
1 1 1 14  0  13 f 1 91.4    11.7  ?     ?   111.458   0            110.555    0            0.481521   180          
1 1 1 14  0  14 o 0 324.1   17.8  ?     ?   515.731   0            409.63     0            99.0181    180          
1 1 1 14  0  15 f 1 530     27.2  ?     ?   650.976   0            521.068    0            112.442    180          
1 1 1 14  0  16 o 0 96.5    16.6  ?     ?   210.328   180          173.375    180          32.0518    3.79548e-14  
1 1 1 14  0  17 o 0 30.1    14.6  ?     ?   9.05565   0            2.38061    0            6.40857    180          
1 1 1 14  0  18 o 0 67.9    15.2  ?     ?   175.296   0            122.717    0            42.7612    180          
1 1 1 14  0  19 o 0 5.3     14.3  ?     ?   105.535   180          10.328     180          89.4543    8.10115e-16  
1 1 1 14  0  20 o 0 1176.8  64.2  ?     ?   778.548   180          864.678    180          39.7788    180          
1 1 1 14  0  21 o 0 760.1   35.9  ?     ?   608.645   180          690.662    180          62.0474    180          
1 1 1 14  0  22 o 0 -8.8    26.2  ?     ?   124.389   0            28.0465    0            97.2315    180          
1 1 1 14  0  23 o 0 16.1    24.3  ?     ?   116.973   180          48.4837    180          65.3971    5.202e-15    
1 1 1 14  0  24 o 0 11      26.9  ?     ?   137.911   0            55.0088    0            79.717     180          
1 1 1 14  0  25 o 0 18.2    35.7  ?     ?   40.4523   0            30.114     0            12.382     180          
1 1 1 14  0  27 o 0 20.5    30.4  ?     ?   12.5212   180          12.1878    180          0.0555069  180          
1 1 1 -14 2  28 f 1 51.1    13.8  ?     ?   235.17    20.1047      93.8577    20.1047      123.429    -159.895     
1 1 1 -14 2  27 o 0 87.8    14.9  ?     ?   262.816   29.7613      178.074    29.7613      65.9107    -150.239     
1 1 1 -14 2  26 o 0 41.8    16.9  ?     ?   84.5859   56.8127      139.093    56.8127      56.8763    56.8127      
1 1 1 -14 2  25 f 1 8       13.5  ?     ?   113.659   -152.292     12.9696    27.7076      128.331    27.7076      
1 1 1 -14 2  24 o 0 179     13.7  ?     ?   197.115   88.4316      408.729    88.4316      223.343    88.4316      
1 1 1 -14 2  23 o 0 148.8   11.4  ?     ?   146.475   -179.993     387.417    -179.993     249.919    -179.993     
1 1 1 -14 2  22 o 0 160.8   10.6  ?     ?   274.016   175.474      310.941    175.474      44.4473    175.474      
1 1 1 -14 2  21 o 0 305.3   10.8  ?     ?   328.972   165.178      488.485    165.178      159.909    165.178      
1 1 1 -14 2  20 o 0 223.1   11    ?     ?   374.187   -113.255     312.371    -113.255     71.5905    66.7455      
1 1 1 -14 2  19 o 0 234.4   9     ?     ?   269.691   -75.9928     366.509    -75.9928     119.209    -75.9928     
1 1 1 -14 2  18 o 0 56.8    8.6   ?     ?   245.4     -23.5514     13.6837    -23.5514     211.299    156.449      
1 1 1 -14 2  17 o 0 98.4    8.6   ?     ?   216.322   50.6192      116.05     50.6192      88.1386    -129.381     
1 1 1 -14 2  16 o 0 183.5   8     ?     ?   305.039   -162.154     240.549    -162.154     49.5917    17.8463      
1 1 1 -14 2  15 o 0 120.7   6.9   ?     ?   77.8073   -6.74067     117.422    -6.74067     43.9604    -6.74067     
1 1 1 -14 2  14 f 1 3931.5  71.2  ?     ?   1329.51   -27.2775     1485.63    -27.2775     198.628    -27.2775     
1 1 1 -14 2  13 o 0 820.6   18.7  ?     ?   595.227   37.7865      669.563    37.7865      92.7135    37.7865      
1 1 1 -14 2  12 o 0 392.5   11.1  ?     ?   358.652   141.396      506.139    141.396      138.079    141.396      
1 1 1 -14 2  11 o 0 1173.9  21.5  ?     ?   448.913   -90.3829     1125.95    -90.3829     668.35     -90.3829     
1 1 1 -14 2  10 o 0 272.5   6     ?     ?   262.405   -155.161     432.06     -155.161     163.306    -155.161     
1 1 1 -14 2  9  o 0 349.1   8.3   ?     ?   273.201   127.489      544.377    127.489      256.936    127.489      
1 1 1 -14 2  8  o 0 1003.6  19.2  ?     ?   726.261   20.5042      771.398    20.5042      11.1323    20.5042      
1 1 1 -14 2  7  o 0 117.7   3.2   ?     ?   304.291   -58.7159     132.67     -58.7159     186.836    121.284      
1 1 1 -14 2  6  f 1 468.8   9     ?     ?   526.191   -3.55759     437.017    -3.55759     77.1933    176.442      
1 1 1 -14 2  5  o 0 217     4.6   ?     ?   516.183   155.724      130.678    155.724      372.079    -24.2759     
1 1 1 -14 2  4  o 0 195.7   4.1   ?     ?   214.557   -168.505     320.415    -168.505     111.182    -168.505     
1 1 1 -14 2  3  o 0 1590    32.5  ?     ?   1033.92   156.827      773.421    156.827      196.113    -23.1728     
1 1 1 -14 2  2  o 0 241.8   7.8   ?     ?   238.453   -29.8558     368.825    -29.8558     145.125    -29.8558     
1 1 1 -14 2  1  o 0 1046    21.7  ?     ?   934.459   14.4809      532.035    14.4809      344.902    -165.519     
1 1 1 14  2  0  f 1 3282.1  64.9  ?     ?   1280.67   -161.469     1298.85    -161.469     101.114    -161.469     
1 1 1 14  2  1  o 0 178.1   3.9   ?     ?   195.014   -111.201     282.752    -111.201     100.735    -111.201     
1 1 1 14  2  2  o 0 906.9   16.3  ?     ?   834.283   -128.927     523.761    -128.927     257.528    51.0734      
1 1 1 14  2  3  o 0 203.4   4.7   ?     ?   345.399   -159.045     243.383    -159.045     81.0618    20.9554      
1 1 1 14  2  4  o 0 183     4.3   ?     ?   293.331   -6.50648     257.408    -6.50648     30.0148    173.494      
1 1 1 14  2  5  o 0 1028.8  19.2  ?     ?   743.663   -36.3931     725.082    -36.3931     4.6258     143.607      
1 1 1 14  2  6  f 1 1176.9  21.3  ?     ?   844.081   13.5156      729.481    13.5156      103.363    -166.484     
1 1 1 14  2  7  o 0 84.3    3.6   ?     ?   350.014   44.4768      13.0144    44.4768      358.757    -135.523     
1 1 1 14  2  8  o 0 2009.7  36.7  ?     ?   902.269   90.5421      1258.66    90.5421      301.644    90.5421      
1 1 1 14  2  9  o 0 1794    33.9  ?     ?   1061.22   79.158       959.112    79.158       173.829    -100.842     
1 1 1 14  2  10 o 0 38.2    3.9   ?     ?   77.2446   -13.266      4.75676    166.734      85.1384    166.734      
1 1 1 14  2  11 o 0 2030.4  36.1  ?     ?   952.748   -97.6646     1173.13    -97.6646     185.173    -97.6646     
1 1 1 14  2  12 o 0 2058    36.9  ?     ?   1181.68   -135.539     888.898    -135.539     284.194    44.4609      
1 1 1 14  2  13 o 0 328.8   10.5  ?     ?   391.287   -128.074     383.67     -128.074     2.97032    51.9259      
1 1 1 14  2  14 f 1 228.9   11.5  ?     ?   303.838   121.292      311.036    121.292      14.7253    121.292      
1 1 1 14  2  15 o 0 163.7   15.5  ?     ?   159.896   -43.0857     253.054    -43.0857     98.7903    -43.0857     
1 1 1 14  2  16 o 0 277     14.5  ?     ?   412.79    -121.408     307.377    -121.408     94.269     58.5922      
1 1 1 14  2  17 o 0 1777.8  36.5  ?     ?   859.048   -140.683     1072.84    -140.683     242.441    -140.683     
1 1 1 14  2  18 o 0 97.9    13.8  ?     ?   292.169   100.765      97.674     100.765      176.942    -79.2346     
1 1 1 14  2  19 o 0 9.6     15.4  ?     ?   197.849   120.173      107.01     -59.8266     293.218    -59.8266     
1 1 1 14  2  20 o 0 -1.7    13.3  ?     ?   87.3795   -54.8822     59.0491    125.118      151.182    125.118      
1 1 1 14  2  21 o 0 281.6   18.1  ?     ?   235.089   -172.071     549.145    -172.071     307.586    -172.071     
1 1 1 14  2  22 o 0 60.2    17.9  ?     ?   262.566   -86.5071     79.2915    -86.5071     183.721    93.4929      
1 1 1 14  2  23 o 0 156.4   21.9  ?     ?   221.932   128.763      354.634    128.763      138.986    128.763      
1 1 1 14  2  24 o 0 102.8   23.3  ?     ?   211.215   -166.494     241.863    -166.494     36.7559    -166.494     
1 1 1 14  2  25 f 1 -36.7   25.7  ?     ?   111.178   166.21       29.4812    -13.7904     147.019    -13.7904     
1 1 1 14  2  26 o 0 33.7    30.8  ?     ?   158.76    26.7172      81.1761    26.7172      78.5691    -153.283     
1 1 1 14  2  27 o 0 -7.1    33.6  ?     ?   35.6526   33.818       40.3712    33.818       6.062      33.818       
1 1 1 14  2  28 < 1 37.8    30.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 4  28 < 0 28.6    23.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 4  27 o 0 115.5   18.1  ?     ?   245.931   107.413      253.977    107.413      28.8707    107.413      
1 1 1 -14 4  26 o 0 26.7    15.5  ?     ?   45.7653   84.8163      68.738     84.8163      25.8748    84.8163      
1 1 1 -14 4  25 o 0 118.2   15.2  ?     ?   140.248   -144.714     337.99     -144.714     197.529    -144.714     
1 1 1 -14 4  24 o 0 245.2   14.3  ?     ?   254.967   -176.412     479.271    -176.412     222.931    -176.412     
1 1 1 -14 4  23 o 0 29.2    11.1  ?     ?   117.124   -147.641     61.5326    -147.641     47.1839    32.3589      
1 1 1 -14 4  22 o 0 795.9   19.7  ?     ?   600.034   -90.6989     762.265    -90.6989     201.515    -90.6989     
1 1 1 -14 4  21 o 0 66.6    8.4   ?     ?   230.609   -117.053     128.034    -117.053     95.2323    62.9466      
1 1 1 -14 4  20 o 0 314.4   11.2  ?     ?   292.13    95.2485      531.347    95.2485      240.901    95.2485      
1 1 1 -14 4  19 o 0 696.8   16.5  ?     ?   558.698   71.2517      694.195    71.2517      123.55     71.2517      
1 1 1 -14 4  18 o 0 114.2   7.5   ?     ?   245.551   37.2584      175.665    37.2584      48.448     -142.742     
1 1 1 -14 4  17 o 0 19.5    6.5   ?     ?   160.395   -52.4673     75.6816    127.533      222.039    127.533      
1 1 1 -14 4  16 o 0 113.7   7.2   ?     ?   383.383   -123.179     51.5917    -123.179     308.571    56.8205      
1 1 1 -14 4  15 o 0 74.6    6.3   ?     ?   207.026   -33.1962     60.42      -33.1963     135.555    146.804      
1 1 1 -14 4  14 o 0 174     6.8   ?     ?   365.34    -91.8607     172.67     -91.8607     170.614    88.1393      
1 1 1 -14 4  13 o 0 1630.8  38.2  ?     ?   880.755   -133.483     919.531    -133.483     75.3647    -133.483     
1 1 1 -14 4  12 o 0 891.8   24.3  ?     ?   684.742   120.967      638.876    120.967      21.5487    -59.0327     
1 1 1 -14 4  11 o 0 2650.2  53.2  ?     ?   1185.11   -105.473     1138.97    -105.473     10.7028    74.5267      
1 1 1 -14 4  10 o 0 1291.7  26.5  ?     ?   787.363   -25.1159     878.168    -25.1159     79.3536    -25.1159     
1 1 1 -14 4  9  o 0 31      2.3   ?     ?   185.149   -16.7962     59.1922    163.204      247.941    163.204      
1 1 1 -14 4  8  o 0 1913.6  35.8  ?     ?   938.448   115.637      1109.33    115.637      148.513    115.637      
1 1 1 -14 4  7  o 0 322     6.5   ?     ?   322.393   -123.107     469.846    -123.107     130.915    -123.107     
1 1 1 -14 4  6  o 0 976.4   20.7  ?     ?   500.079   48.4505      970.696    48.4505      447.83     48.4505      
1 1 1 -14 4  5  o 0 191.6   4.2   ?     ?   511.016   -121.721     101.483    -121.721     434.231    58.2785      
1 1 1 -14 4  4  o 0 186.2   3.9   ?     ?   457.727   55.3055      142.097    55.3055      338.744    -124.695     
1 1 1 -14 4  3  o 0 172.2   3.9   ?     ?   212.404   96.7323      279.088    96.7323      72.6731    96.7323      
1 1 1 -14 4  2  o 0 846.9   23.3  ?     ?   699.184   -116.912     623.428    -116.912     56.7148    63.0876      
1 1 1 -14 4  1  o 0 577.8   16.1  ?     ?   626.79    -46.3757     458.224    -46.3757     151.822    133.624      
1 1 1 14  4  0  o 0 222.6   6.5   ?     ?   390.36    -77.0093     244.733    -77.0093     131.835    102.991      
1 1 1 14  4  1  o 0 113.7   3.3   ?     ?   393.463   -148.072     47.0967    -148.072     333.364    31.9285      
1 1 1 14  4  3  o 0 1150.7  21.1  ?     ?   669.648   2.37865      870.511    2.37865      220.385    2.37865      
1 1 1 14  4  4  o 0 434.3   8.5   ?     ?   377.537   105.26       573.151    105.26       175.854    105.26       
1 1 1 14  4  6  o 0 673.1   12.8  ?     ?   421.246   1.23897      787.903    1.23897      344.483    1.23897      
1 1 1 14  4  7  o 0 579.2   13.5  ?     ?   571.317   -3.73304     547.04     -3.73304     58.9738    176.267      
1 1 1 14  4  8  o 0 543.1   11.7  ?     ?   604.038   -97.018      465.32     -97.018      159.916    82.982       
1 1 1 14  4  9  o 0 280.8   9.2   ?     ?   127.656   -54.4096     470.991    -54.4095     339.181    -54.4095     
1 1 1 14  4  10 o 0 361.8   9.5   ?     ?   460.919   8.30635      391.767    8.30635      82.6639    -171.694     
1 1 1 14  4  11 o 0 108.5   5.8   ?     ?   330.821   -61.7808     76.0429    -61.7808     250.07     118.219      
1 1 1 14  4  12 o 0 1339.1  24.9  ?     ?   869.403   -13.1129     781.124    -13.1129     72.2113    166.887      
1 1 1 14  4  13 o 0 214.2   11.2  ?     ?   514.76    -32.0183     118.681    -32.0183     377.566    147.982      
1 1 1 14  4  14 o 0 286.3   12.6  ?     ?   403.028   -178.269     314.886    -178.269     71.5648    1.73122      
1 1 1 14  4  15 o 0 161.5   12.6  ?     ?   320.917   155.276      194.407    155.276      116.007    -24.7242     
1 1 1 14  4  16 o 0 208.8   13.7  ?     ?   202.922   -67.9409     335.095    -67.9409     140.054    -67.9409     
1 1 1 14  4  17 o 0 25.9    13    ?     ?   210.582   109.694      82.5407    -70.306      279.387    -70.306      
1 1 1 14  4  18 o 0 498.4   18.6  ?     ?   411.367   17.7702      577.861    17.7702      192.751    17.7702      
1 1 1 14  4  19 o 0 391.9   15.8  ?     ?   388.44    -57.7769     549.281    -57.7769     141.817    -57.7769     
1 1 1 14  4  20 o 0 772.7   25.5  ?     ?   576.39    -28.1918     772.434    -28.1918     183.142    -28.1918     
1 1 1 14  4  21 o 0 229.5   17.5  ?     ?   348.573   -49.4004     371.322    -49.4004     23.8542    -49.4004     
1 1 1 14  4  22 o 0 132.1   20.7  ?     ?   176.748   -48.94       338.59     -48.94       168.304    -48.94       
1 1 1 14  4  23 o 0 -16.2   22.5  ?     ?   89.949    -39.7516     16.2859    140.248      103.228    140.248      
1 1 1 14  4  24 o 0 30.8    24.6  ?     ?   88.2852   -56.0383     89.599     -56.0383     2.14718    123.962      
1 1 1 14  4  25 o 0 -59.4   29.7  ?     ?   32.8044   39.6095      4.85172    -140.39      38.8567    -140.39      
1 1 1 14  4  26 o 0 28.5    26.8  ?     ?   82.8254   -163.503     97.5884    -163.503     17.188     -163.503     
1 1 1 14  4  27 o 0 151.8   27.1  ?     ?   331.893   177.177      246.576    177.177      68.725     -2.82288     
1 1 1 -14 6  27 < 0 2.2     16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 6  26 o 0 93.6    17    ?     ?   235.029   -102.177     211.304    -102.177     1.19488    77.823       
1 1 1 -14 6  25 o 0 5.4     15    ?     ?   40.751    -155.629     12.4553    -155.629     25.2428    24.3711      
1 1 1 -14 6  24 o 0 62.8    13.3  ?     ?   95.8563   -153.438     215.825    -153.438     121.009    -153.438     
1 1 1 -14 6  23 o 0 124.2   14.2  ?     ?   238.852   -163.086     269.06     -163.086     31.9092    -163.086     
1 1 1 -14 6  22 o 0 26.1    10    ?     ?   5.68347   -116.186     5.27013    -116.186     0.0607223  -116.186     
1 1 1 -14 6  21 o 0 65.4    9.8   ?     ?   133.575   -174.733     191.495    -174.733     68.2408    -174.733     
1 1 1 -14 6  20 o 0 29.8    8.6   ?     ?   128.205   -9.31685     55.6385    -9.31685     66.9054    170.683      
1 1 1 -14 6  19 o 0 265.5   11.4  ?     ?   322.792   121.231      428.936    121.231      112.122    121.231      
1 1 1 -14 6  18 o 0 284.4   11.1  ?     ?   321.952   -132.28      446.851    -132.28      122.271    -132.28      
1 1 1 -14 6  17 o 0 37.2    8.5   ?     ?   37.1119   46.49        8.83029    46.49        24.5988    -133.51      
1 1 1 -14 6  16 o 0 436.6   12.1  ?     ?   330.09    83.1825      552.947    83.1824      255.722    83.1824      
1 1 1 -14 6  15 o 0 257.4   9.8   ?     ?   555.678   126.047      164.551    126.047      339.78     -53.9525     
1 1 1 -14 6  14 o 0 964.6   20.1  ?     ?   598.605   158.823      777.636    158.823      218.624    158.823      
1 1 1 -14 6  13 o 0 334.7   10.7  ?     ?   387.83    -177.716     386.212    -177.716     17.0652    -177.716     
1 1 1 -14 6  12 o 0 36.1    5.4   ?     ?   75.5694   51.4688      12.3575    -128.531     82.8574    -128.531     
1 1 1 -14 6  11 o 0 1071.7  25.2  ?     ?   642.623   125.551      800.468    125.551      197.294    125.551      
1 1 1 -14 6  10 f 1 856.8   16.2  ?     ?   817.037   99.8752      482.222    99.8752      303.16     -80.1248     
1 1 1 -14 6  9  o 0 778.4   14.8  ?     ?   747.756   -173.086     491.852    -173.086     226.912    6.91413      
1 1 1 -14 6  8  o 0 253.8   7.2   ?     ?   432.981   159.738      254.621    159.738      185.573    -20.2616     
1 1 1 -14 6  7  o 0 434.2   8.7   ?     ?   363.529   162.529      554.537    162.529      187.878    162.529      
1 1 1 -14 6  6  f 1 328.9   6.8   ?     ?   422.765   85.4808      375.426    85.4808      54.6736    -94.5192     
1 1 1 -14 6  5  o 0 95.8    2.7   ?     ?   347.27    -150.167     42.892     -150.167     309.63     29.8326      
1 1 1 -14 6  3  o 0 1137.7  24.3  ?     ?   567.518   161.7        989.908    161.7        411.388    161.7        
1 1 1 -14 6  2  f 1 586.6   14.9  ?     ?   532.156   36.9608      568.118    36.9608      22.1621    36.9608      
1 1 1 -14 6  1  o 0 117.3   3.5   ?     ?   269.463   133.904      153.637    133.904      127.93     -46.0956     
1 1 1 14  6  0  o 0 1646.1  35.1  ?     ?   1084.3    117.509      823.387    117.509      303.606    -62.4912     
1 1 1 14  6  1  o 0 473.3   15    ?     ?   616.553   -167.867     380.065    -167.867     261.789    12.1326      
1 1 1 14  6  2  f 1 262.7   5.9   ?     ?   417.956   70.9662      290.111    70.9662      137.96     -109.034     
1 1 1 14  6  3  o 0 376.6   7.8   ?     ?   415.098   -63.0625     447.697    -63.0625     24.3714    -63.0625     
1 1 1 14  6  4  o 0 656.6   13.2  ?     ?   531.489   -179.633     638.209    -179.633     96.0047    -179.633     
1 1 1 14  6  5  o 0 16.7    2.9   ?     ?   205.259   -133.11      128.521    46.8899      337.867    46.8899      
1 1 1 14  6  6  f 1 533.6   11.8  ?     ?   556.426   -50.0881     490.962    -50.0881     78.9694    129.912      
1 1 1 14  6  7  o 0 1075.8  24.9  ?     ?   680.184   21.8872      835.855    21.8872      143.763    21.8872      
1 1 1 14  6  8  o 0 880.9   30.4  ?     ?   601.467   -67.3111     752.637    -67.3111     134.574    -67.3111     
1 1 1 14  6  9  o 0 47      5.6   ?     ?   358.447   113.446      110.2      -66.5545     459.09     -66.5545     
1 1 1 14  6  10 f 1 372.7   10.2  ?     ?   297.702   -28.6352     500.336    -28.6352     210.061    -28.6352     
1 1 1 14  6  11 o 0 61.1    8.1   ?     ?   247.628   -109.211     3.59529    -109.211     232.558    70.7893      
1 1 1 14  6  12 o 0 555.8   17.1  ?     ?   334.385   -145.433     661.35     -145.433     343.894    -145.433     
1 1 1 14  6  13 o 0 714.3   18.1  ?     ?   499.645   -9.291       688.528    -9.291       209.625    -9.291       
1 1 1 14  6  14 o 0 1146.4  27.1  ?     ?   628.836   2.64588      892.889    2.64587      293.495    2.64587      
1 1 1 14  6  15 o 0 915     21.2  ?     ?   594.86    114.262      772.034    114.262      220.183    114.262      
1 1 1 14  6  16 o 0 292     14.9  ?     ?   385.402   132.922      361.699    132.922      3.37513    132.922      
1 1 1 14  6  17 o 0 114.3   12.8  ?     ?   63.6646   -131.539     148.879    -131.539     90.0989    -131.539     
1 1 1 14  6  18 o 0 80.6    14.3  ?     ?   219.068   -115.448     148.711    -115.448     77.971     64.5521      
1 1 1 14  6  19 o 0 162.2   16.3  ?     ?   179.088   16.5261      381.097    16.5261      200.446    16.5261      
1 1 1 14  6  20 o 0 58.8    19.2  ?     ?   229.97    22.4049      93.2123    22.4049      133.009    -157.595     
1 1 1 14  6  21 o 0 113.2   20.1  ?     ?   271.186   59.4854      218.751    59.4854      39.1215    -120.515     
1 1 1 14  6  22 o 0 338.8   25.5  ?     ?   448.904   46.2938      429.397    46.2938      1.07963    46.2938      
1 1 1 14  6  23 o 0 281     29.6  ?     ?   170.868   118.813      606.024    118.813      430.718    118.813      
1 1 1 14  6  24 o 0 10.5    25.7  ?     ?   87.7571   -175.574     47.2819    -175.574     39.5151    4.42649      
1 1 1 14  6  25 o 0 35.5    30.2  ?     ?   84.261    154.722      116.651    154.722      35.8811    154.722      
1 1 1 -14 8  25 o 0 25.1    17.8  ?     ?   58.8675   29.5793      93.0818    29.5793      40.9372    29.5793      
1 1 1 -14 8  24 o 0 116.6   14.6  ?     ?   179.985   -1.68344     305.889    -1.68344     144.911    -1.68344     
1 1 1 -14 8  23 o 0 231.2   22.8  ?     ?   211.901   -53.3207     477.558    -53.3207     279.172    -53.3207     
1 1 1 -14 8  22 o 0 36.3    12.4  ?     ?   129.664   -76.4949     101.569    -76.4949     25.4586    103.505      
1 1 1 -14 8  21 o 0 36.6    13.8  ?     ?   73.1333   38.8969      92.6143    38.8969      26.4008    38.8969      
1 1 1 -14 8  20 o 0 -14.3   10.8  ?     ?   50.5931   5.6095       31.0179    -174.391     76.8952    -174.391     
1 1 1 -14 8  19 f 1 32.3    9.5   ?     ?   252.737   114.033      2.73131    -65.9669     234.498    -65.9669     
1 1 1 -14 8  18 o 0 331.6   11.6  ?     ?   328.28    122.533      514.889    122.533      204.829    122.533      
1 1 1 -14 8  17 o 0 470.6   13.6  ?     ?   480.673   58.1103      535.656    58.1103      69.7746    58.1103      
1 1 1 -14 8  16 o 0 249.5   9.7   ?     ?   301.303   36.4858      407.882    36.4858      108.106    36.4858      
1 1 1 -14 8  15 o 0 422     11.5  ?     ?   381.783   -55.0696     496.269    -55.0696     157.111    -55.0696     
1 1 1 -14 8  14 o 0 21.1    5.8   ?     ?   275.695   87.8898      115.535    -92.1102     362.333    -92.1102     
1 1 1 -14 8  13 o 0 132     6.6   ?     ?   261.755   109.626      182.167    109.626      51.7947    -70.3744     
1 1 1 -14 8  12 o 0 780.3   17    ?     ?   516.947   63.2086      698.359    63.2086      223.286    63.2086      
1 1 1 -14 8  11 o 0 314.3   9.6   ?     ?   426.588   -29.721      329.236    -29.721      65.25      150.279      
1 1 1 -14 8  10 o 0 508.6   14.4  ?     ?   486.538   58.2663      489.307    58.2663      31.312     58.2663      
1 1 1 -14 8  9  o 0 1362.9  25.3  ?     ?   821.164   81.4368      809.114    81.4368      52.48      81.4368      
1 1 1 -14 8  8  f 1 194.6   5.5   ?     ?   531.231   -45.0945     68.183     -45.0945     426.147    134.906      
1 1 1 -14 8  7  o 0 41.8    3.3   ?     ?   175.152   -88.7874     24.3994    91.2126      187.233    91.2126      
1 1 1 -14 8  6  o 0 161.5   4.4   ?     ?   231.833   -25.477      234.628    -25.477      15.4552    -25.477      
1 1 1 -14 8  5  o 0 1253.9  29.2  ?     ?   781.677   -96.6287     783.168    -96.6287     41.8693    -96.6287     
1 1 1 -14 8  4  o 0 1071.7  19.8  ?     ?   782.825   128.664      666.93     128.664      77.3756    -51.3362     
1 1 1 -14 8  3  o 0 420.1   8.9   ?     ?   613.484   15.6313      283.085    15.6313      301.409    -164.369     
1 1 1 -14 8  2  o 0 2012.6  36.1  ?     ?   1086.29   -155.13      921.694    -155.13      114.85     24.8695      
1 1 1 -14 8  1  o 0 1712.3  31.4  ?     ?   1145.19   132.094      713.789    132.094      380.079    -47.9063     
1 1 1 14  8  0  f 1 245.6   5.9   ?     ?   280.611   99.4321      342.169    99.4321      73.0959    99.4321      
1 1 1 14  8  1  o 0 428.9   9.2   ?     ?   316.942   -116.836     542.249    -116.836     239.589    -116.836     
1 1 1 14  8  2  o 0 536.6   11.5  ?     ?   392.023   21.6678      593.139    21.6678      218.553    21.6678      
1 1 1 14  8  3  o 0 1304.4  28    ?     ?   889.477   -38.4591     720.778    -38.4591     129.286    141.541      
1 1 1 14  8  4  o 0 2299.3  51.2  ?     ?   953.82    -29.6314     1182.5     -29.6314     271.219    -29.6314     
1 1 1 14  8  5  o 0 402.4   12.3  ?     ?   492.059   -57.9191     371.351    -57.9191     98.3748    122.081      
1 1 1 14  8  6  o 0 1103.6  28.6  ?     ?   739.023   -149.617     729.805    -149.617     25.2847    -149.617     
1 1 1 14  8  7  o 0 338.5   15.9  ?     ?   374.397   -50.7408     395.876    -50.7408     44.2826    -50.7408     
1 1 1 14  8  8  f 1 1768.6  36.5  ?     ?   1168.25   -118.808     724.96     -118.808     375.04     61.1921      
1 1 1 14  8  9  o 0 1042.6  25.9  ?     ?   648.468   -103.319     771.596    -103.319     165.986    -103.319     
1 1 1 14  8  10 o 0 587.7   14.8  ?     ?   557.249   41.1142      517.57     41.1142      8.59897    -138.886     
1 1 1 14  8  11 o 0 1812.2  38.1  ?     ?   689.366   137.779      1214.81    137.779      566.592    137.779      
1 1 1 14  8  12 o 0 1592.7  33.8  ?     ?   862.728   129.912      955.364    129.912      164.747    129.912      
1 1 1 14  8  13 o 0 361.9   13.4  ?     ?   445.034   -146.257     388.412    -146.257     17.3056    33.7434      
1 1 1 14  8  14 o 0 526     16    ?     ?   387.857   -99.0677     610.738    -99.0677     256.083    -99.0677     
1 1 1 14  8  15 o 0 29.3    10.9  ?     ?   217.119   -160.833     52.1136    19.1667      249.418    19.1667      
1 1 1 14  8  16 o 0 79.2    13    ?     ?   199.052   -96.7691     155.769    -96.7691     47.1084    83.2309      
1 1 1 14  8  17 o 0 220.8   16.6  ?     ?   388.194   -84.6271     304.004    -84.6271     81.974     95.3729      
1 1 1 14  8  18 o 0 342.2   17.4  ?     ?   438.204   -50.1812     441.117    -50.1812     15.9372    -50.1812     
1 1 1 14  8  19 f 1 84.9    17.7  ?     ?   201.083   -127.707     203.239    -127.707     13.5439    -127.707     
1 1 1 14  8  20 o 0 142.3   21    ?     ?   297.721   173.69       252.428    173.69       25.6824    -6.30968     
1 1 1 14  8  21 o 0 182.1   23.6  ?     ?   241.443   98.8198      386.582    98.8198      150.167    98.8198      
1 1 1 14  8  22 o 0 8.8     24.8  ?     ?   171.013   23.3065      5.20364    -156.693     178.269    -156.693     
1 1 1 14  8  23 o 0 -61.6   27.7  ?     ?   15.0318   151.122      2.67204    -28.8782     17.2301    -28.8782     
1 1 1 14  8  24 o 0 27.5    30    ?     ?   96.5919   54.7351      99.1301    54.7351      9.63534    54.7351      
1 1 1 -14 10 24 < 0 23.5    11.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 10 23 o 0 15.9    12.5  ?     ?   123.189   24.664       35.475     24.664       71.7982    -155.336     
1 1 1 -14 10 22 o 0 39.4    14.3  ?     ?   56.1978   41.6622      119.919    41.6622      69.8833    41.6622      
1 1 1 -14 10 21 f 1 79.9    13.5  ?     ?   101.332   -76.0713     259.112    -76.0713     165.48     -76.0713     
1 1 1 -14 10 20 f 1 -6.6    12    ?     ?   138.664   154.529      65.2416    -25.4709     199.231    -25.4709     
1 1 1 -14 10 19 o 0 34.9    10.4  ?     ?   78.0941   76.4789      108.12     76.4789      32.8505    76.4789      
1 1 1 -14 10 18 o 0 102.9   10.2  ?     ?   194.713   66.7393      243.959    66.7393      70.9223    66.7393      
1 1 1 -14 10 17 o 0 50.4    9.3   ?     ?   171.525   74.1098      120.52     74.1098      32.7365    -105.89      
1 1 1 -14 10 16 o 0 116.4   9.5   ?     ?   284.043   88.8209      200.695    88.8209      61.8563    -91.1791     
1 1 1 -14 10 15 f 1 70.6    7.4   ?     ?   127.455   57.5867      196.038    57.5867      76.6381    57.5867      
1 1 1 -14 10 14 o 0 99.8    7.5   ?     ?   206.174   -12.0259     216.55     -12.0259     19.5991    -12.0259     
1 1 1 -14 10 13 o 0 108.9   7     ?     ?   248.577   -115.397     191.352    -115.397     52.1019    64.6029      
1 1 1 -14 10 12 f 1 92.3    6.1   ?     ?   193.257   -4.75872     189.442    -4.75872     2.11316    175.241      
1 1 1 -14 10 11 o 0 216     7     ?     ?   278.137   138.284      319.861    138.284      75.3942    138.284      
1 1 1 -14 10 10 f 1 1128.7  22.1  ?     ?   629.426   8.6306       839.825    8.6306       285.333    8.6306       
1 1 1 -14 10 9  o 0 166.7   6.1   ?     ?   188.435   -49.5265     270.044    -49.5265     104.004    -49.5265     
1 1 1 -14 10 8  f 1 7.7     4.6   ?     ?   221.327   37.2857      158.392    -142.714     355.371    -142.714     
1 1 1 -14 10 7  o 0 604.1   12.8  ?     ?   692.64    48.0824      397.132    48.0824      231.934    -131.918     
1 1 1 -14 10 6  o 0 301.5   7.4   ?     ?   315.423   -136.986     390.542    -136.986     102.972    -136.986     
1 1 1 -14 10 5  o 0 29.6    3.7   ?     ?   148.551   -166.941     47.1352    13.0594      183.017    13.0594      
1 1 1 -14 10 4  o 0 140     5.5   ?     ?   247.198   -95.622      187.639    -95.622      39.1085    84.378       
1 1 1 -14 10 3  o 0 360.2   8.4   ?     ?   474.635   -35.3794     343.37     -35.3794     92.9959    144.621      
1 1 1 -14 10 2  o 0 60.6    3.9   ?     ?   413.713   -167.925     105.264    12.0749      490.915    12.0749      
1 1 1 -14 10 1  f 1 1748.2  33    ?     ?   1105.5    151.94       769.513    151.94       267.649    -28.0598     
1 1 1 14  10 0  o 0 1194.4  25.6  ?     ?   839.844   147.954      701.407    147.954      84.4675    -32.0457     
1 1 1 14  10 1  f 1 3137.2  67    ?     ?   1023.36   -95.4563     1468.24    -95.4563     505.2      -95.4563     
1 1 1 14  10 2  o 0 1176.9  22.8  ?     ?   845.454   -97.959      685.75     -97.959      105.892    82.041       
1 1 1 14  10 3  o 0 606.1   13.1  ?     ?   769.669   -113.659     338.242    -113.659     373.587    66.3406      
1 1 1 14  10 4  o 0 700.5   16.2  ?     ?   495.436   -57.9268     656.041    -57.9268     198.198    -57.9268     
1 1 1 14  10 5  o 0 1054.5  21.6  ?     ?   866.133   -20.8335     594.974    -20.8335     204.418    159.166      
1 1 1 14  10 6  o 0 626.3   14.2  ?     ?   692.778   -63.1265     422.235    -63.1265     216.025    116.874      
1 1 1 14  10 7  o 0 327.2   11.5  ?     ?   275.45    27.1961      450.717    27.1961      197.525    27.1961      
1 1 1 14  10 8  f 1 579     14.2  ?     ?   456.758   4.11138      590.434    4.11138      178.377    4.11138      
1 1 1 14  10 9  o 0 126.9   8.7   ?     ?   297.324   -44.4671     151.345    -44.4671     114.621    135.533      
1 1 1 14  10 10 f 1 38      8.7   ?     ?   54.7926   178.056      13.4554    178.056      36.0505    -1.94431     
1 1 1 14  10 11 o 0 111.9   10.2  ?     ?   39.0833   103.869      94.6618    103.869      59.6836    103.869      
1 1 1 14  10 12 f 1 66.3    9.3   ?     ?   367.72    99.1062      17.7351    -80.8938     389.407    -80.8938     
1 1 1 14  10 13 o 0 237.1   12.2  ?     ?   198.023   -112.483     469.67     -112.483     271.614    -112.483     
1 1 1 14  10 14 o 0 105.6   11.8  ?     ?   191.082   -167.353     244.388    -167.353     57.7136    -167.353     
1 1 1 14  10 15 f 1 217.4   15.2  ?     ?   392.643   149.642      296.18     149.642      80.528     -30.3584     
1 1 1 14  10 16 o 0 79.6    15.1  ?     ?   154.533   129.09       219.372    129.09       76.5238    129.09       
1 1 1 14  10 17 o 0 107.7   20    ?     ?   267.311   130.119      200.843    130.119      45.3788    -49.8811     
1 1 1 14  10 18 o 0 182.3   19.5  ?     ?   263.286   60.9657      350.743    60.9657      107.998    60.9657      
1 1 1 14  10 19 o 0 112.7   19.4  ?     ?   246.646   170.394      232.238    170.394      12.5942    -9.60636     
1 1 1 14  10 20 f 1 7.3     22.8  ?     ?   91.0688   160.497      30.5422    160.497      60.2142    -19.5032     
1 1 1 14  10 21 f 1 -53.5   23.3  ?     ?   104.661   -10.8203     41.7981    169.18       141.677    169.18       
1 1 1 14  10 22 o 0 149.3   33    ?     ?   297.305   172.011      250.311    172.011      19.8875    -7.98898     
1 1 1 14  10 23 o 0 8       32.6  ?     ?   110.844   143.038      66.7389    143.038      33.2292    -36.9618     
1 1 1 14  10 24 < 0 -4.2    22.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 12 21 < 0 305.9   22.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 12 20 o 0 151.1   17.4  ?     ?   263.131   -7.53815     292.594    -7.53815     67.5095    -7.53815     
1 1 1 -14 12 19 o 0 44.1    13.8  ?     ?   125.409   -61.167      133.349    -61.167      23.5389    -61.167      
1 1 1 -14 12 18 o 0 36.7    14.7  ?     ?   155.509   163.35       82.4332    163.35       57.9996    -16.6497     
1 1 1 -14 12 17 o 0 105     12    ?     ?   183.129   22.376       260.5      22.376       87.7581    22.376       
1 1 1 -14 12 16 o 0 109.9   11.6  ?     ?   216.897   89.5029      245.308    89.5029      40.4264    89.5029      
1 1 1 -14 12 15 o 0 60.4    9.5   ?     ?   206.129   -128.961     127.936    -128.961     52.9465    51.0387      
1 1 1 -14 12 14 o 0 116.2   8.9   ?     ?   299.684   -117.901     190.523    -117.901     72.2493    62.0988      
1 1 1 -14 12 13 o 0 319.6   11.5  ?     ?   317.096   -166.214     495.727    -166.214     216.656    -166.214     
1 1 1 -14 12 12 o 0 15.2    7.1   ?     ?   124.509   -115.188     18.6142    64.8116      131.777    64.8116      
1 1 1 -14 12 11 o 0 208.4   8.6   ?     ?   260.348   11.7115      383.655    11.7115      145.488    11.7115      
1 1 1 -14 12 10 o 0 38.4    5.9   ?     ?   282.03    15.2559      19.0171    -164.744     282.982    -164.744     
1 1 1 -14 12 9  o 0 87.3    6     ?     ?   139.83    158.714      218.518    158.714      86.9213    158.714      
1 1 1 -14 12 8  o 0 94.4    5.7   ?     ?   188.63    75.8469      193.085    75.8469      11.4994    75.8469      
1 1 1 -14 12 7  o 0 9.1     4.4   ?     ?   152.842   -43.6598     94.7246    136.34       242.523    136.34       
1 1 1 -14 12 6  o 0 218.6   7.1   ?     ?   316.122   149.794      338.96     149.794      32.0399    149.794      
1 1 1 -14 12 5  o 0 28.5    4.6   ?     ?   79.0541   -90.7189     3.91268    89.2811      72.129     89.2811      
1 1 1 -14 12 4  o 0 581     13.6  ?     ?   488.429   44.0787      547.691    44.0787      124.949    44.0787      
1 1 1 -14 12 3  o 0 1045.4  21.8  ?     ?   639.988   -7.73794     766.902    -7.73794     211.583    -7.73794     
1 1 1 -14 12 2  o 0 325.7   8.9   ?     ?   302.56    -82.2385     440.04     -82.2385     176.971    -82.2385     
1 1 1 -14 12 1  f 1 111.4   5.7   ?     ?   216.037   97.1005      177.053    97.1005      12.0494    -82.8995     
1 1 1 14  12 0  o 0 801.5   17.4  ?     ?   601.066   49.7841      638.157    49.7841      111.596    49.7841      
1 1 1 14  12 1  f 1 189.2   7     ?     ?   290.496   -173.432     269.671    -173.432     13.8369    -173.432     
1 1 1 14  12 2  o 0 498.3   11.9  ?     ?   513.894   -175.771     458.781    -175.771     8.64577    -175.771     
1 1 1 14  12 3  o 0 40.7    5.4   ?     ?   211.851   171.97       0.87078    -8.03011     186.303    -8.03011     
1 1 1 14  12 4  o 0 21.2    5.6   ?     ?   354.666   65.6405      165.984    -114.359     476.055    -114.359     
1 1 1 14  12 5  o 0 133.9   7.3   ?     ?   312.875   19.4946      161.915    19.4946      111.167    -160.505     
1 1 1 14  12 6  o 0 62.3    6.9   ?     ?   47.3868   -85.0442     76.2206    -85.0442     29.6208    -85.0442     
1 1 1 14  12 7  o 0 6.9     6.9   ?     ?   26.0242   116.275      16.6179    -63.7248     42.1429    -63.7248     
1 1 1 14  12 8  o 0 57.9    8.8   ?     ?   77.3275   -78.756      95.319     -78.756      19.7111    -78.756      
1 1 1 14  12 9  o 0 396.7   13    ?     ?   473.788   -75.1707     452.553    -75.1707     0.967395   104.829      
1 1 1 14  12 10 o 0 61.1    10.1  ?     ?   360.417   138.781      10.7963    -41.2188     354.378    -41.2188     
1 1 1 14  12 11 o 0 132     12    ?     ?   220.985   -173.976     284.467    -173.976     78.2766    -173.976     
1 1 1 14  12 12 o 0 48.9    10.7  ?     ?   193.741   -46.9026     102.612    -46.9026     72.7596    133.097      
1 1 1 14  12 13 o 0 36.1    13.1  ?     ?   55.149    -106.177     69.4981    -106.177     19.8567    -106.177     
1 1 1 14  12 14 o 0 56.5    13.2  ?     ?   150.422   153.448      150.398    153.448      15.3126    153.448      
1 1 1 14  12 15 o 0 10      17.4  ?     ?   57.7192   -23.5534     11.9707    -23.5534     39.9758    156.447      
1 1 1 14  12 16 o 0 27.5    22.6  ?     ?   73.9786   41.6955      71.71      41.6955      0.0577462  -138.305     
1 1 1 14  12 17 o 0 39.3    18    ?     ?   178.647   155.425      69.3092    155.425      103.995    -24.5754     
1 1 1 14  12 18 o 0 221.6   27.3  ?     ?   126.96    -119.944     519.707    -119.944     401.634    -119.944     
1 1 1 14  12 19 o 0 98      22.4  ?     ?   176.233   -135.289     249.568    -135.289     90.4325    -135.289     
1 1 1 14  12 20 o 0 101.2   24.1  ?     ?   105.464   -15.176      309.916    -15.176      216.544    -15.176      
1 1 1 -14 14 18 < 0 146.8   19.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 14 17 o 0 51.2    13.6  ?     ?   170.33    -151.765     135.768    -151.765     6.40483    28.2348      
1 1 1 -14 14 16 f 1 36      13.6  ?     ?   175.059   -74.5643     72.6212    -74.5643     75.2497    105.436      
1 1 1 -14 14 15 o 0 55.8    12.8  ?     ?   190.958   -123.617     131.332    -123.617     32.6624    56.3833      
1 1 1 -14 14 14 o 0 155.6   14.3  ?     ?   228.13    -167.384     321.881    -167.384     120.166    -167.384     
1 1 1 -14 14 13 o 0 17.1    11.1  ?     ?   74.2655   170.919      30.9251    170.919      37.5488    -9.08067     
1 1 1 -14 14 12 o 0 34.8    9.3   ?     ?   166.901   88.7918      70.4168    88.7918      83.4155    -91.2082     
1 1 1 -14 14 11 o 0 32.9    8.7   ?     ?   144.35    96.9137      78.5838    96.9137      55.3521    -83.0863     
1 1 1 -14 14 10 o 0 23.7    7     ?     ?   66.4354   50.8053      47.8696    50.8053      9.26688    -129.195     
1 1 1 -14 14 9  o 0 19.5    6.7   ?     ?   253.844   -102.96      60.0779    77.0397      277.728    77.0397      
1 1 1 -14 14 8  o 0 43.6    6.1   ?     ?   185.021   170.419      88.0121    170.419      71.4529    -9.58086     
1 1 1 -14 14 7  o 0 34.3    7.3   ?     ?   204.652   175.899      40.9853    175.899      135.565    -4.10126     
1 1 1 -14 14 6  o 0 395.3   11.4  ?     ?   427.087   6.76307      486.795    6.76307      116.799    6.76307      
1 1 1 -14 14 5  o 0 49.3    6.7   ?     ?   207.878   -17.1014     92.0404    -17.1014     88.7215    162.899      
1 1 1 -14 14 4  o 0 6.1     5.6   ?     ?   201.999   -49.7133     104.675    130.287      280.894    130.287      
1 1 1 -14 14 3  o 0 76      6.6   ?     ?   207.447   -18.8654     160.571    -18.8654     25.5351    161.135      
1 1 1 -14 14 2  o 0 52      6.2   ?     ?   320.268   94.9588      6.79119    94.9588      281.188    -85.0412     
1 1 1 -14 14 1  o 0 36.7    6.5   ?     ?   142.324   131.063      76.502     131.063      51.7065    -48.937      
1 1 1 14  14 0  f 1 156.1   6.9   ?     ?   142.794   -144.729     373.021    -144.729     242.547    -144.729     
1 1 1 14  14 1  o 0 226     9.2   ?     ?   354.422   -177.737     330.794    -177.737     8.66502    -177.737     
1 1 1 14  14 2  o 0 16.9    6.8   ?     ?   82.8237   -174.981     1.52355    -174.981     73.7069    5.01898      
1 1 1 14  14 3  o 0 5.4     7.2   ?     ?   142.125   40.2436      72.6604    -139.756     201.618    -139.756     
1 1 1 14  14 4  o 0 39      7.8   ?     ?   204.553   -65.8231     60.01      -65.8231     120.696    114.177      
1 1 1 14  14 5  o 0 19.5    8.8   ?     ?   225.328   -122.34      43.8258    57.6602      242.49     57.6602      
1 1 1 14  14 6  o 0 46.3    8.6   ?     ?   198.005   -90.0087     89.0985    -90.0087     85.0486    89.9913      
1 1 1 14  14 7  o 0 91.6    12.1  ?     ?   189.552   -20.2547     218.358    -20.2547     51.5067    -20.2547     
1 1 1 14  14 8  o 0 13.5    12.3  ?     ?   60.4431   -167.555     4.39877    -167.555     48.6247    12.4448      
1 1 1 14  14 9  o 0 203.1   13.6  ?     ?   350.777   -133.686     301.112    -133.686     5.41085    46.3139      
1 1 1 14  14 10 o 0 159.4   13.8  ?     ?   232.779   -69.5401     321.289    -69.5401     116.991    -69.5401     
1 1 1 14  14 11 o 0 -7.1    12    ?     ?   36.3107   84.567       14.6699    -95.433      49.0962    -95.433      
1 1 1 14  14 12 o 0 52.6    14.9  ?     ?   136.624   -60.9397     150.14     -60.9397     21.2959    -60.9397     
1 1 1 14  14 13 o 0 90.2    18.9  ?     ?   172.757   72.869       227.816    72.869       64.6276    72.869       
1 1 1 14  14 14 o 0 38.6    14.5  ?     ?   194.616   39.2958      64.906     39.2958      111.626    -140.704     
1 1 1 14  14 15 o 0 -9.6    17.8  ?     ?   29.9701   -21.6199     1.23523    -21.6199     25.2037    158.38       
1 1 1 14  14 16 f 1 16.3    21.6  ?     ?   65.7735   -11.1195     59.6696    -11.1195     2.52298    -11.1195     
1 1 1 14  14 17 o 0 18.4    19.5  ?     ?   206.056   -88.3059     6.78165    91.6941      183.926    91.6941      
1 1 1 14  14 18 < 0 94.4    27.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 16 13 < 0 57      15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 16 12 o 0 25.9    10.7  ?     ?   99.5845   175.537      86.5685    175.537      5.33229    175.537      
1 1 1 -14 16 11 o 0 4.5     12.1  ?     ?   35.9465   -62.7241     8.26334    -62.7241     21.1948    117.276      
1 1 1 -14 16 10 o 0 2.5     11    ?     ?   151.325   66.0039      36.4413    -113.996     161.241    -113.996     
1 1 1 -14 16 9  o 0 66.9    10.2  ?     ?   149.736   105.377      189.727    105.377      63.8709    105.377      
1 1 1 -14 16 8  f 1 35.4    10    ?     ?   144.581   78.3719      94.9256    78.3719      27.8817    -101.628     
1 1 1 -14 16 7  o 0 53.6    10    ?     ?   100.656   -18.8249     175.062    -18.8249     87.7644    -18.8249     
1 1 1 -14 16 6  o 0 90.4    9.5   ?     ?   329.985   34.1662      106.797    34.1662      180.661    -145.834     
1 1 1 -14 16 5  o 0 294.3   12.7  ?     ?   325.869   35.1967      434.141    35.1967      139.217    35.1967      
1 1 1 -14 16 4  o 0 414.5   14.1  ?     ?   365.69    46.9087      541.053    46.9087      208.943    46.9087      
1 1 1 -14 16 3  o 0 41.2    9.2   ?     ?   177.771   73.3358      87.508     73.3358      74.4225    -106.664     
1 1 1 -14 16 2  o 0 73.4    11.7  ?     ?   124.55    -37.5481     217.646    -37.5481     103.907    -37.5481     
1 1 1 -14 16 1  o 0 103.4   9.6   ?     ?   214.607   -84.5022     225.85     -84.5022     29.4675    -84.5022     
1 1 1 14  16 0  o 0 63.5    10.8  ?     ?   166.561   -17.5361     166.449    -17.5361     12.1926    -17.5361     
1 1 1 14  16 1  o 0 161.5   11.4  ?     ?   213.992   -54.1406     341.78     -54.1406     143.693    -54.1406     
1 1 1 14  16 2  o 0 420.6   14.8  ?     ?   429.96    -86.1829     499.891    -86.1829     102.254    -86.1829     
1 1 1 14  16 3  o 0 68.3    10.8  ?     ?   161.177   -2.69427     183.144    -2.69427     34.2877    -2.69427     
1 1 1 14  16 4  o 0 76.1    10.8  ?     ?   211.632   66.1112      164.581    66.1112      30.5177    -113.889     
1 1 1 14  16 5  o 0 16.4    12.3  ?     ?   157.697   111.067      5.68085    -68.9326     150.727    -68.9326     
1 1 1 14  16 6  o 0 -27.5   12.4  ?     ?   29.4678   -72.9778     16.1893    107.022      42.3087    107.022      
1 1 1 14  16 7  o 0 90      17.1  ?     ?   187.381   -55.443      218.167    -55.443      52.6097    -55.443      
1 1 1 14  16 8  f 1 22.5    11.8  ?     ?   136.826   -34.7187     40.9635    -34.7187     77.5767    145.281      
1 1 1 14  16 9  o 0 52.8    16.2  ?     ?   39.6514   110.944      140.097    110.944      106.062    110.944      
1 1 1 14  16 10 o 0 122.6   19.6  ?     ?   209.7     -138.723     272.222    -138.723     95.3921    -138.723     
1 1 1 14  16 11 o 0 91.5    20.2  ?     ?   150.332   -39.5399     250.41     -39.5399     124.004    -39.5399     
1 1 1 14  16 12 o 0 43.7    22.2  ?     ?   87.9315   146.142      140.141    146.142      66.616     146.142      
1 1 1 14  16 13 < 0 14.5    26.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 18 4  < 0 81.1    13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 18 3  < 0 -1.6    14.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 18 2  < 0 65.2    15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -14 18 1  < 0 28.6    13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 14  18 0  < 0 61.2    14.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 14  18 1  < 0 28.7    13.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 14  18 2  < 0 18.1    13.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 14  18 3  < 0 11.7    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 14  18 4  < 0 13.8    16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 1  28 o 0 97.7    18.4  ?     ?   187.2     22.2259      261.684    22.2259      89.2228    22.2259      
1 1 1 -15 1  27 o 0 16.8    15.9  ?     ?   116.801   -14.0053     43.7252    -14.0053     64.9332    165.995      
1 1 1 -15 1  26 o 0 18.1    15.9  ?     ?   169.921   129.911      1.47351    129.911      164.01     -50.0888     
1 1 1 -15 1  25 o 0 29.6    12.3  ?     ?   87.0926   94.0079      82.7105    94.0079      5.39264    -85.9921     
1 1 1 -15 1  24 o 0 11      10.9  ?     ?   175.255   -21.5786     46.2275    158.421      211.326    158.421      
1 1 1 -15 1  23 o 0 109.9   10.4  ?     ?   230.851   -64.8293     247.409    -64.8293     30.38      -64.8293     
1 1 1 -15 1  22 f 1 306.4   11.6  ?     ?   458.405   24.619       375.322    24.619       73.3903    -155.381     
1 1 1 -15 1  21 o 0 162.9   9.5   ?     ?   313.29    -76.9188     273.556    -76.9188     39.7242    103.081      
1 1 1 -15 1  20 o 0 338.5   13.1  ?     ?   487.238   -80.2965     375.073    -80.2965     125.391    99.7035      
1 1 1 -15 1  19 o 0 35.4    8     ?     ?   256.12    -106.891     45.0101    73.109       280.056    73.109       
1 1 1 -15 1  18 o 0 104.5   6.4   ?     ?   220.347   -61.7796     148.364    -61.7796     53.7734    118.22       
1 1 1 -15 1  17 o 0 1208.4  24.3  ?     ?   719.009   -139.514     844.588    -139.514     165.634    -139.514     
1 1 1 -15 1  16 o 0 88.8    6.8   ?     ?   210.684   2.78195      95.7777    2.78195      104.652    -177.218     
1 1 1 -15 1  15 f 1 626.6   13.4  ?     ?   535.166   98.056       556.628    98.056       48.7877    98.056       
1 1 1 -15 1  14 o 0 3728.2  63.9  ?     ?   1307.87   68.3869      1439.49    68.3869      180.34     68.3869      
1 1 1 -15 1  13 o 0 1326.1  24.1  ?     ?   713.523   8.04542      908.382    8.04542      217.329    8.04542      
1 1 1 -15 1  12 o 0 217.7   8.3   ?     ?   358.812   -6.51997     271.526    -6.51997     91.9553    173.48       
1 1 1 -15 1  11 o 0 643.1   14.8  ?     ?   524.656   -62.9853     630.629    -62.9853     96.5315    -62.9853     
1 1 1 -15 1  10 o 0 259.3   5.9   ?     ?   312.886   19.8022      375.777    19.8022      55.8753    19.8022      
1 1 1 -15 1  9  o 0 809.9   14.8  ?     ?   713.245   69.191       616.249    69.191       132.537    -110.809     
1 1 1 -15 1  8  o 0 835.1   16.3  ?     ?   550.408   21.9695      805.506    21.9695      230.868    21.9695      
1 1 1 -15 1  7  o 0 204.5   5.5   ?     ?   517.099   -73.6263     118.197    -73.6263     423.008    106.374      
1 1 1 -15 1  6  o 0 342.1   6.9   ?     ?   634.222   113.985      196.114    113.985      418.149    -66.0146     
1 1 1 -15 1  5  o 0 205.2   4.4   ?     ?   482.166   42.4111      141.27     42.4111      326.283    -137.589     
1 1 1 -15 1  4  o 0 353.2   6.8   ?     ?   325.987   132.17       456.179    132.17       152.239    132.17       
1 1 1 -15 1  3  f 1 2652.2  45.4  ?     ?   1110.08   -140.847     1205.47    -140.847     164.842    -140.847     
1 1 1 -15 1  2  o 0 4630.6  127.7 ?     ?   1506.49   -70.8516     1568.68    -70.8516     163.359    -70.8516     
1 1 1 -15 1  1  o 0 5828.9  280.2 ?     ?   1757.22   24.0348      1680.53    24.0348      40.5347    24.0348      
1 1 1 15  1  0  o 0 2748.1  47.3  ?     ?   977.305   170.474      1367.82    170.474      459.507    170.474      
1 1 1 15  1  2  o 0 253.1   5.3   ?     ?   518.023   -148.328     176.003    -148.328     308.435    31.6719      
1 1 1 15  1  3  f 1 627.8   17.2  ?     ?   456.686   -20.4591     631.516    -20.4591     200.898    -20.4591     
1 1 1 15  1  4  o 0 364.2   7.4   ?     ?   420.753   -97.0041     415.893    -97.0041     4.08732    -97.0041     
1 1 1 15  1  5  o 0 912.9   17.2  ?     ?   653.103   -94.7095     723.018    -94.7095     82.77      -94.7095     
1 1 1 15  1  6  o 0 1092    20    ?     ?   750.441   152.194      763.375    152.194      27.2255    152.194      
1 1 1 15  1  7  o 0 226.5   5.8   ?     ?   248.201   96.0001      386.389    96.0001      122.878    96.0001      
1 1 1 15  1  8  o 0 683.7   15.8  ?     ?   634.889   110.227      596.8      110.227      76.4755    -69.7727     
1 1 1 15  1  9  o 0 2730    55.8  ?     ?   1248.93   69.2377      1254.76    69.2377      78.6299    -110.762     
1 1 1 15  1  10 o 0 3978.4  68.1  ?     ?   1474.95   -16.5205     1517.9     -16.5205     17.4049    163.48       
1 1 1 15  1  11 o 0 2490.6  46.2  ?     ?   1023.05   -49.2552     1337.22    -49.2552     275.805    -49.2552     
1 1 1 15  1  12 o 0 530.8   14.3  ?     ?   581.27    153.065      465.208    153.065      142.782    -26.9352     
1 1 1 15  1  13 o 0 996.5   21.6  ?     ?   919.14    107.259      509.625    107.259      399.497    -72.7406     
1 1 1 15  1  14 o 0 2855.1  53.3  ?     ?   1117.27   63.8165      1309.86    63.8165      210.211    63.8165      
1 1 1 15  1  15 f 1 397.8   18.3  ?     ?   392.123   -163.32      461.555    -163.32      80.7542    -163.32      
1 1 1 15  1  16 o 0 65.9    13.3  ?     ?   228.169   177.474      29.5581    177.474      192.816    -2.52604     
1 1 1 15  1  17 o 0 686.7   19.1  ?     ?   337.395   166.481      805.507    166.481      478.759    166.481      
1 1 1 15  1  18 o 0 731.6   20.9  ?     ?   408.991   123.383      796.835    123.383      411.621    123.383      
1 1 1 15  1  19 o 0 204.3   15.1  ?     ?   385.853   -99.3283     239.517    -99.3283     124.457    80.6717      
1 1 1 15  1  20 o 0 208.3   16.6  ?     ?   424.101   -101.485     246.653    -101.485     201.625    78.5153      
1 1 1 15  1  21 o 0 206.4   18.8  ?     ?   233.228   142.127      430.055    142.127      189.767    142.127      
1 1 1 15  1  22 f 1 222     20.1  ?     ?   303.079   21.7973      400.825    21.7973      94.788     21.7973      
1 1 1 15  1  23 o 0 81.6    20.7  ?     ?   171.383   2.44516      220.007    2.44516      52.962     2.44516      
1 1 1 15  1  24 o 0 15.3    23.4  ?     ?   41.985    -53.6642     28.7474    -53.6642     12.1578    126.336      
1 1 1 15  1  25 o 0 94.5    25    ?     ?   96.8806   28.4688      302.794    28.4688      201.3      28.4688      
1 1 1 15  1  26 o 0 -2.8    29.1  ?     ?   113.654   -23.7692     32.0026    -23.7692     82.7816    156.231      
1 1 1 15  1  27 o 0 6.6     28    ?     ?   50.1124   -34.98       55.5474    -34.9799     7.13387    -34.9799     
1 1 1 15  1  28 < 0 80      25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 3  28 < 0 13.9    19.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 3  27 o 0 19.5    15.5  ?     ?   86.2855   6.85053      62.9214    6.85053      16.3655    -173.149     
1 1 1 -15 3  26 o 0 -11.7   15.1  ?     ?   80.1365   25.6139      25.4872    -154.386     102.601    -154.386     
1 1 1 -15 3  25 o 0 137.2   12.9  ?     ?   266.711   -161.676     274.442    -161.676     5.75437    -161.676     
1 1 1 -15 3  24 o 0 61.9    11.3  ?     ?   130.982   86.2547      187.629    86.2547      65.6216    86.2547      
1 1 1 -15 3  23 o 0 137.7   10.8  ?     ?   274.902   -156.423     268.195    -156.423     11.597     -156.423     
1 1 1 -15 3  22 o 0 314.9   12.6  ?     ?   312.046   -157.206     527.172    -157.206     233.965    -157.206     
1 1 1 -15 3  21 o 0 372.6   12    ?     ?   363.011   87.4098      541.426    87.4098      182.107    87.4098      
1 1 1 -15 3  20 o 0 306.2   11.5  ?     ?   461.283   -29.8137     352.579    -29.8137     116.6      150.186      
1 1 1 -15 3  19 o 0 1094.1  22.6  ?     ?   764.894   -11.1076     726.028    -11.1076     30.6533    -11.1076     
1 1 1 -15 3  18 o 0 436.2   11.4  ?     ?   584.152   58.2795      353.791    58.2795      177.278    -121.721     
1 1 1 -15 3  17 o 0 72.4    6.3   ?     ?   171.944   100.932      82.1755    100.932      75.4476    -79.0679     
1 1 1 -15 3  16 o 0 33.2    5.6   ?     ?   26.5398   151.214      5.29771    -28.7862     30.341     -28.7862     
1 1 1 -15 3  15 o 0 241     7.5   ?     ?   273.432   42.0459      347.039    42.0459      83.9563    42.0459      
1 1 1 -15 3  14 o 0 147.1   6.1   ?     ?   213.598   52.8886      213.605    52.8886      12.0923    52.8886      
1 1 1 -15 3  13 f 1 239.6   10.3  ?     ?   354.003   146.803      283.21     146.803      59.1298    -33.1969     
1 1 1 -15 3  12 o 0 3662.6  89.1  ?     ?   1417.06   175.981      1317.5     175.982      54.1016    -4.0185      
1 1 1 -15 3  11 o 0 1394.8  25    ?     ?   769.801   -114.251     960.246    -114.251     180.822    -114.251     
1 1 1 -15 3  10 o 0 309.1   6.5   ?     ?   559.739   170.159      227.036    170.159      342.563    -9.84144     
1 1 1 -15 3  9  o 0 1245.9  25.1  ?     ?   829.847   113.601      812.008    113.601      36.2816    -66.3994     
1 1 1 -15 3  8  o 0 824.1   16.1  ?     ?   712.586   98.1587      629.089    98.1587      119.035    -81.8413     
1 1 1 -15 3  7  o 0 555.1   10.5  ?     ?   657.126   -39.7948     438.492    -39.7948     247.8      140.205      
1 1 1 -15 3  6  o 0 714.6   14.1  ?     ?   668.254   160.923      585.359    160.923      114.56     -19.0769     
1 1 1 -15 3  4  o 0 206     4.2   ?     ?   318.223   -155.067     276.126    -155.067     32.9983    24.9329      
1 1 1 -15 3  3  o 0 106.4   2.9   ?     ?   378.792   -175.383     42.894     -175.383     325.535    4.61663      
1 1 1 -15 3  2  o 0 986.2   28.3  ?     ?   577.229   163.426      841.476    163.426      279.558    163.426      
1 1 1 -15 3  1  o 0 427.7   11.3  ?     ?   132.911   -141.297     634.28     -141.297     504.822    -141.297     
1 1 1 15  3  0  o 0 840.2   16.7  ?     ?   561.233   -141.959     739.126    -141.959     197.4      -141.959     
1 1 1 15  3  1  o 0 1750.5  30.2  ?     ?   1023.3    -132.749     898.097    -132.749     92.2762    47.2514      
1 1 1 15  3  2  o 0 820.2   14.7  ?     ?   424.354   -33.6001     847.229    -33.6001     435.429    -33.6001     
1 1 1 15  3  3  o 0 470.8   9.5   ?     ?   570.131   38.0501      402.32     38.0501      152.253    -141.95      
1 1 1 15  3  4  o 0 604.1   11.4  ?     ?   409.405   -15.3112     676.539    -15.3112     277.598    -15.3112     
1 1 1 15  3  5  o 0 3808.3  64.6  ?     ?   1213.5    34.0387      1770.69    34.0387      489.22     34.0387      
1 1 1 15  3  6  o 0 790.8   15.1  ?     ?   598.267   21.4173      729.207    21.4173      97.3058    21.4173      
1 1 1 15  3  7  o 0 895.1   16.6  ?     ?   708.728   -40.1723     707.903    -40.1723     40.1895    139.828      
1 1 1 15  3  8  o 0 206.3   8.1   ?     ?   305.338   -2.97109     302.394    -2.97109     14.9554    177.029      
1 1 1 15  3  9  o 0 36.2    4.1   ?     ?   114.06    -159.912     16.272     20.0877      134.56     20.0877      
1 1 1 15  3  10 o 0 12.1    4.5   ?     ?   289.021   -34.7716     220.871    145.228      519.746    145.228      
1 1 1 15  3  11 o 0 1563.6  29.9  ?     ?   1089.14   -108.093     748.218    -108.093     387.658    71.9074      
1 1 1 15  3  12 o 0 45.4    7.9   ?     ?   86.9161   -42.6257     4.6769     -42.6257     81.0685    137.374      
1 1 1 15  3  13 f 1 48.5    9.2   ?     ?   181.842   -89.4062     4.56913    90.5938      184.048    90.5938      
1 1 1 15  3  14 o 0 132.1   9.6   ?     ?   239.764   -156.395     178.823    -156.395     52.35      23.6046      
1 1 1 15  3  15 o 0 93.9    10.2  ?     ?   328.945   -131.799     43.5202    -131.799     280.357    48.2006      
1 1 1 15  3  16 o 0 758.2   20.9  ?     ?   621.636   -20.2768     622.695    -20.2768     21.6569    -20.2768     
1 1 1 15  3  17 o 0 1171.8  30    ?     ?   739.75    -142.411     833.811    -142.411     138.072    -142.411     
1 1 1 15  3  18 o 0 185.8   16.6  ?     ?   258.383   42.1421      306.746    42.1421      63.3245    42.1421      
1 1 1 15  3  19 o 0 239.2   17.2  ?     ?   408.521   -38.9073     313.852    -38.9073     117.473    141.093      
1 1 1 15  3  20 o 0 291.1   18.9  ?     ?   392.622   -86.3439     420.691    -86.3439     16.5826    -86.3439     
1 1 1 15  3  21 o 0 146.7   16.6  ?     ?   246.193   -107.597     314.541    -107.597     67.4307    -107.597     
1 1 1 15  3  22 o 0 93.9    22    ?     ?   157.226   -85.9981     261.202    -85.9981     108.646    -85.9981     
1 1 1 15  3  23 o 0 26.3    21.1  ?     ?   118.402   -173.302     52.6018    -173.302     61.6783    6.69796      
1 1 1 15  3  24 o 0 60.6    24.9  ?     ?   260.812   -173.386     68.1829    -173.386     204.892    6.61365      
1 1 1 15  3  25 o 0 -4.6    34.7  ?     ?   80.7241   -60.7237     47.8417    -60.7237     36.4833    119.276      
1 1 1 15  3  26 o 0 47.6    29.2  ?     ?   169.638   -65.2108     107.557    -65.2108     58.4205    114.789      
1 1 1 15  3  27 o 0 37.5    29.6  ?     ?   165.3     -57.9247     89.8066    -57.9247     68.5084    122.075      
1 1 1 -15 5  27 < 0 -7.2    17.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 5  26 o 0 67.9    18    ?     ?   189.636   -88.9248     175.349    -88.9248     2.53164    -88.9248     
1 1 1 -15 5  25 o 0 118.3   15.7  ?     ?   196.847   -101.212     296.926    -101.212     109.075    -101.212     
1 1 1 -15 5  24 o 0 48      11.5  ?     ?   129.48    -134.03      154.571    -134.03      25.2222    -134.03      
1 1 1 -15 5  23 o 0 274.7   14.4  ?     ?   392.594   -80.912      385.526    -80.912      22.911     -80.912      
1 1 1 -15 5  22 o 0 48.7    9.7   ?     ?   140.099   -27.8848     136.448    -27.8848     6.78768    -27.8848     
1 1 1 -15 5  21 o 0 65.4    9.5   ?     ?   123.31    34.0026      197.196    34.0026      82.3216    34.0026      
1 1 1 -15 5  20 o 0 276.8   10    ?     ?   377.849   83.3549      396.143    83.3549      25.3657    83.3549      
1 1 1 -15 5  19 o 0 39.7    7.7   ?     ?   129.121   54.9214      52.1592    54.9214      78.0281    -125.079     
1 1 1 -15 5  18 f 1 38.4    7     ?     ?   107.522   -93.7445     18.6054    -93.7445     78.7834    86.2555      
1 1 1 -15 5  17 o 0 -1.7    6.8   ?     ?   99.6243   164.139      78.0232    -15.8608     168.578    -15.8608     
1 1 1 -15 5  16 o 0 197.3   8.6   ?     ?   274.458   -161.736     292.311    -161.736     42.9613    -161.736     
1 1 1 -15 5  15 o 0 726     16    ?     ?   440.278   1.24391      730.738    1.24391      319.032    1.24391      
1 1 1 -15 5  14 o 0 402.8   10.3  ?     ?   408.43    -43.7685     454.821    -43.7685     70.0797    -43.7685     
1 1 1 -15 5  13 o 0 190.8   6.6   ?     ?   394.666   -64.7428     176.964    -64.7428     191.96     115.257      
1 1 1 -15 5  12 o 0 1479.9  26.4  ?     ?   688.75    27.1104      1013.91    27.1104      365.925    27.1104      
1 1 1 -15 5  11 o 0 395.3   8.8   ?     ?   776.675   -42.7773     108.669    -42.7773     636.105    137.223      
1 1 1 -15 5  10 o 0 410.6   8.7   ?     ?   413.574   -20.6599     451.255    -20.6599     52.4897    -20.6599     
1 1 1 -15 5  9  o 0 1589.9  28.1  ?     ?   638.737   -146.387     1201.31    -146.387     557.444    -146.387     
1 1 1 -15 5  8  o 0 2166.1  37.1  ?     ?   1032.12   156.481      1137.03    156.481      91.969     156.481      
1 1 1 -15 5  7  f 1 98      4.1   ?     ?   181.486   4.44117      140.289    4.44117      45.1449    -175.559     
1 1 1 -15 5  6  o 0 1014.3  21.7  ?     ?   679.546   -59.1222     793.071    -59.1222     99.9483    -59.1222     
1 1 1 -15 5  5  o 0 110.3   4     ?     ?   323.296   50.3687      98.9268    50.3687      239.358    -129.631     
1 1 1 -15 5  4  o 0 890.9   18.9  ?     ?   621.844   171.509      779.391    171.509      132.864    171.509      
1 1 1 -15 5  2  o 0 271.1   6.7   ?     ?   344.025   123.154      380.363    123.154      21.6274    123.154      
1 1 1 -15 5  1  o 0 713.7   18.2  ?     ?   772.675   -87.309      477.986    -87.309      328.323    92.691       
1 1 1 15  5  0  o 0 1198.9  27.8  ?     ?   676.481   159.906      956.315    159.906      255.337    159.906      
1 1 1 15  5  1  o 0 1544.1  37.1  ?     ?   776.242   -75.1842     1087.25    -75.1842     281.338    -75.1842     
1 1 1 15  5  2  o 0 330.4   8.2   ?     ?   284.885   -32.7092     509.614    -32.7092     213.341    -32.7092     
1 1 1 15  5  3  o 0 89.2    3.2   ?     ?   299.642   -73.5996     63.9633    -73.5996     248.059    106.4        
1 1 1 15  5  4  o 0 384.5   8.3   ?     ?   599.525   -169.713     295.227    -169.713     334.999    10.2868      
1 1 1 15  5  5  o 0 117     3.6   ?     ?   419.317   133.047      32.7508    133.047      398.218    -46.953      
1 1 1 15  5  6  o 0 1547.6  27.9  ?     ?   746.824   -3.70952     1092.47    -3.70952     325.271    -3.70952     
1 1 1 15  5  7  f 1 475.5   10.1  ?     ?   388.306   29.2854      587.665    29.2854      187.18     29.2854      
1 1 1 15  5  8  o 0 100.4   5.1   ?     ?   134.275   78.9372      144.335    78.9372      6.81154    78.9372      
1 1 1 15  5  9  o 0 408.3   10.9  ?     ?   424.823   10.1752      478.134    10.1752      44.1206    10.1752      
1 1 1 15  5  10 o 0 1619.4  32.8  ?     ?   821.942   45.1507      989.013    45.1507      184.326    45.1507      
1 1 1 15  5  11 o 0 159.9   8     ?     ?   612.175   32.9567      63.4299    -147.043     660.517    -147.043     
1 1 1 15  5  12 o 0 1453.6  30.5  ?     ?   856.075   -20.64       863.494    -20.64       42.9365    -20.64       
1 1 1 15  5  13 o 0 88.1    9.5   ?     ?   297.215   -61.0889     48.8757    -61.0889     234.629    118.911      
1 1 1 15  5  14 o 0 356.5   12.8  ?     ?   325.914   166.334      474.33     166.334      160.571    166.334      
1 1 1 15  5  15 o 0 50.6    12.7  ?     ?   197.053   -62.8178     4.57687    117.182      193.172    117.182      
1 1 1 15  5  16 o 0 128.5   11.9  ?     ?   216.041   -98.9982     203.661    -98.9982     2.48151    -98.9982     
1 1 1 15  5  17 o 0 600.9   17.5  ?     ?   545.539   126.343      558.596    126.343      49.6111    126.343      
1 1 1 15  5  18 f 1 40      12.5  ?     ?   47.4711   -146.251     35.0531    -146.251     14.8491    33.7486      
1 1 1 15  5  19 o 0 456     19    ?     ?   359.995   15.4184      661.292    15.4184      294.201    15.4184      
1 1 1 15  5  20 o 0 72.3    16.2  ?     ?   167.396   55.0088      191.188    55.0088      24.6982    55.0088      
1 1 1 15  5  21 o 0 125.4   18    ?     ?   226.066   -10.3955     288.193    -10.3955     70.8067    -10.3955     
1 1 1 15  5  22 o 0 39.5    20.7  ?     ?   76.9989   92.6404      94.5797    92.6404      20.9172    92.6404      
1 1 1 15  5  23 o 0 248.2   28.7  ?     ?   369.953   172.436      368.942    172.436      15.2224    172.436      
1 1 1 15  5  24 o 0 10.2    25    ?     ?   214.98    -148.761     39.2286    31.2394      261.866    31.2394      
1 1 1 15  5  25 o 0 32.1    23.2  ?     ?   102.243   -174.696     88.3574    -174.696     12.939     5.30415      
1 1 1 15  5  26 o 0 285.5   33.1  ?     ?   313.637   -147.341     485.089    -147.341     187.91     -147.341     
1 1 1 -15 7  26 < 0 24.6    17.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 7  25 o 0 133.2   16.6  ?     ?   185.392   56.6097      334.671    56.6097      168.473    56.6097      
1 1 1 -15 7  24 o 0 -2      11    ?     ?   81.8986   158.243      26.8403    -21.7569     103.716    -21.7569     
1 1 1 -15 7  23 o 0 8.9     9.9   ?     ?   164.726   -152.381     48.2815    27.6189      210.129    27.6189      
1 1 1 -15 7  22 o 0 41.2    12.8  ?     ?   192.908   -147.357     77.8132    -147.357     112.395    32.6434      
1 1 1 -15 7  21 o 0 139.4   10.3  ?     ?   263.73    -172.768     274.189    -172.768     34.1879    -172.768     
1 1 1 -15 7  20 o 0 49      9.8   ?     ?   248.619   164.227      63.8216    164.227      163.887    -15.7734     
1 1 1 -15 7  19 o 0 26.9    9.2   ?     ?   196.393   127.843      2.65311    127.843      183.627    -52.157      
1 1 1 -15 7  18 o 0 496.1   14.6  ?     ?   264.36    126.501      758.749    126.501      501.346    126.501      
1 1 1 -15 7  17 o 0 674.3   16.1  ?     ?   409.969   -25.0362     799.3      -25.0362     389.386    -25.0362     
1 1 1 -15 7  16 o 0 88.5    7.8   ?     ?   346.498   -172.803     47.2334    -172.803     262.22     7.19656      
1 1 1 -15 7  15 o 0 320.6   10.6  ?     ?   468.682   -144.078     318.389    -144.078     103.566    35.9216      
1 1 1 -15 7  14 o 0 17.3    5.6   ?     ?   45.6899   -135.538     21.6312    44.462       62.7195    44.462       
1 1 1 -15 7  13 o 0 68.2    5.7   ?     ?   278.492   -106.919     11.335     -106.919     246.268    73.0809      
1 1 1 -15 7  12 o 0 187.8   6.6   ?     ?   482.9     158.744      107.505    158.744      342.162    -21.2556     
1 1 1 -15 7  11 o 0 769.5   15.6  ?     ?   490.394   153.887      701.343    153.887      248.521    153.887      
1 1 1 -15 7  10 o 0 880.1   17    ?     ?   601.001   153.532      694.908    153.532      136.784    153.532      
1 1 1 -15 7  9  o 0 55.2    3.3   ?     ?   166.287   9.79921      19.0884    9.79921      138.188    -170.201     
1 1 1 -15 7  8  o 0 407     8.6   ?     ?   450.759   -88.2076     409.899    -88.2076     18.4311    91.7924      
1 1 1 -15 7  7  o 0 253.3   7.3   ?     ?   379.687   162.663      281.676    162.663      80.6181    -17.3367     
1 1 1 -15 7  6  o 0 1622.4  29    ?     ?   1049.29   139.885      757.104    139.885      247.745    -40.1151     
1 1 1 -15 7  5  o 0 2351.1  43.5  ?     ?   1058.93   -170.87      1173.25    -170.87      102.315    -170.87      
1 1 1 -15 7  4  o 0 796.7   15.1  ?     ?   463.593   -149.169     810.586    -149.169     346.159    -149.169     
1 1 1 -15 7  3  o 0 51.1    2.1   ?     ?   130.715   -110.313     20.6515    -110.313     110.559    69.687       
1 1 1 -15 7  2  o 0 2499.5  47.1  ?     ?   1073.59   -97.9744     1250.02    -97.9744     170.779    -97.9744     
1 1 1 -15 7  1  o 0 1657.1  41.2  ?     ?   926.571   126.173      958.884    126.173      26.5289    126.173      
1 1 1 15  7  0  o 0 1228.9  23.2  ?     ?   673.241   100.473      936.612    100.473      261.264    100.473      
1 1 1 15  7  1  o 0 4583.1  79    ?     ?   1408.12   -175.735     1748.23    -175.735     333.879    -175.735     
1 1 1 15  7  2  o 0 490.1   11.5  ?     ?   469.678   42.0702      521.518    42.0702      49.317     42.0702      
1 1 1 15  7  3  o 0 756.7   14.8  ?     ?   591.872   83.9671      661.528    83.9671      66.1714    83.9671      
1 1 1 15  7  4  o 0 404.4   10.2  ?     ?   533.688   -158.719     367.691    -158.719     169.155    21.2815      
1 1 1 15  7  5  o 0 756.3   14.7  ?     ?   939.706   -147.583     312.822    -147.583     643.382    32.4174      
1 1 1 15  7  6  o 0 295.9   9.5   ?     ?   411.491   -68.2414     316.606    -68.2414     80.6765    111.759      
1 1 1 15  7  7  o 0 286.5   10.3  ?     ?   529.384   164.613      202.422    164.613      307.844    -15.3868     
1 1 1 15  7  8  o 0 745.6   19.9  ?     ?   979.698   -167.412     249.273    -167.412     692.938    12.5882      
1 1 1 15  7  9  o 0 98.7    6.4   ?     ?   506.657   76.9395      85.8915    -103.06      565.461    -103.06      
1 1 1 15  7  10 o 0 290     9.8   ?     ?   594.895   108.552      152.744    108.552      408.436    -71.4475     
1 1 1 15  7  11 o 0 200.1   9.4   ?     ?   234.116   -97.4046     304.969    -97.4046     79.0587    -97.4046     
1 1 1 15  7  12 o 0 914.7   19.8  ?     ?   440.718   168.256      889.754    168.256      471.46     168.256      
1 1 1 15  7  13 o 0 625.5   17.8  ?     ?   300.661   -92.7308     757.945    -92.7308     474.016    -92.7308     
1 1 1 15  7  14 o 0 254.2   11.3  ?     ?   326.045   121.069      346.422    121.069      46.6044    121.069      
1 1 1 15  7  15 o 0 256.4   14.9  ?     ?   561.6     144.241      161.678    144.241      356.13     -35.7594     
1 1 1 15  7  16 o 0 12      11.5  ?     ?   266.694   -114.392     153.609    65.6078      397.908    65.6078      
1 1 1 15  7  17 o 0 154.4   13    ?     ?   261.31    -63.2721     287.905    -63.2721     19.5187    -63.2721     
1 1 1 15  7  18 o 0 239.9   14.3  ?     ?   364.637   -54.6174     359.576    -54.6174     5.67008    125.383      
1 1 1 15  7  19 o 0 42.9    16.2  ?     ?   118.472   -58.7408     102.525    -58.7408     13.2461    121.259      
1 1 1 15  7  20 o 0 59.7    19.1  ?     ?   59.7827   56.1938      147.008    56.1938      90.5141    56.1938      
1 1 1 15  7  21 o 0 108.5   21.6  ?     ?   224.499   40.7832      240.605    40.7831      29.5061    40.7831      
1 1 1 15  7  22 o 0 33.4    22    ?     ?   69.9678   138.843      92.6718    138.843      21.2818    138.843      
1 1 1 15  7  23 o 0 63.6    25.6  ?     ?   29.6443   -167.392     130.085    -167.392     99.8999    -167.392     
1 1 1 15  7  24 o 0 -25.2   23.9  ?     ?   48.3647   -1.34588     3.30697    -1.34588     42.8293    178.654      
1 1 1 15  7  25 o 0 131.1   25.4  ?     ?   212.335   -84.402      309.279    -84.402      111.416    -84.402      
1 1 1 -15 9  25 < 0 28.2    21.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 9  24 o 0 69.6    15.4  ?     ?   148.511   -53.2043     211.436    -53.2043     81.2587    -53.2043     
1 1 1 -15 9  23 o 0 -9.5    15.1  ?     ?   113.966   -50.4111     23.6284    129.589      124.471    129.589      
1 1 1 -15 9  22 o 0 76.3    14    ?     ?   160.426   -145.064     217.042    -145.064     68.4885    -145.064     
1 1 1 -15 9  21 f 1 155.7   13.3  ?     ?   240.641   40.665       321.578    40.665       87.2706    40.665       
1 1 1 -15 9  20 o 0 35.4    10.9  ?     ?   126.943   121.487      97.1629    121.487      21.9498    -58.5128     
1 1 1 -15 9  19 o 0 36      9.6   ?     ?   119.166   -138.273     93.163     -138.273     13.626     41.7271      
1 1 1 -15 9  18 o 0 103.8   10.1  ?     ?   185.657   121.997      256.072    121.997      88.7321    121.997      
1 1 1 -15 9  17 o 0 249.6   10.1  ?     ?   279.253   26.6189      438.491    26.6189      177.997    26.6189      
1 1 1 -15 9  16 o 0 38.3    7.4   ?     ?   150.225   62.8209      65.932     62.8209      77.8227    -117.179     
1 1 1 -15 9  15 o 0 47.5    6.6   ?     ?   203.466   -49.4425     72.6372    -49.4425     123.673    130.557      
1 1 1 -15 9  14 f 1 109.6   8.2   ?     ?   158.882   74.3893      247.715    74.3893      89.6732    74.3893      
1 1 1 -15 9  13 o 0 167.4   7.4   ?     ?   293.742   125.707      235.612    125.707      23.7291    -54.2928     
1 1 1 -15 9  12 o 0 1584.6  30.1  ?     ?   923.944   40.2461      858.637    40.2461      37.3234    40.2461      
1 1 1 -15 9  11 o 0 1094.8  23.3  ?     ?   686.037   30.2408      783.133    30.2408      174.756    30.2408      
1 1 1 -15 9  10 o 0 92.6    6.6   ?     ?   120.82    -118.448     120.852    -118.448     13.0822    -118.448     
1 1 1 -15 9  9  o 0 1144.3  21.7  ?     ?   756.481   -148.915     745.918    -148.915     53.1086    -148.915     
1 1 1 -15 9  8  o 0 229.3   6.2   ?     ?   508.567   -70.3929     148.077    -70.3929     319.935    109.607      
1 1 1 -15 9  7  o 0 273.1   9.4   ?     ?   280.832   -68.3773     377.359    -68.3773     114.665    -68.3773     
1 1 1 -15 9  6  f 1 587.9   12.5  ?     ?   502.205   -75.3094     532.977    -75.3094     71.4572    -75.3094     
1 1 1 -15 9  5  o 0 1483.3  27.2  ?     ?   1040.44   -99.6147     678.457    -99.6147     275.904    80.3853      
1 1 1 -15 9  4  o 0 391.1   8.8   ?     ?   746.225   63.6431      135.885    63.6431      550.477    -116.357     
1 1 1 -15 9  3  o 0 249.4   6.3   ?     ?   433.122   120.518      230.388    120.518      168.874    -59.4821     
1 1 1 -15 9  2  o 0 284.2   7.2   ?     ?   296.783   -171.184     377.246    -171.184     103.194    -171.184     
1 1 1 -15 9  1  o 0 248.4   9.4   ?     ?   518.374   54.3301      159.712    54.3301      319.549    -125.67      
1 1 1 15  9  0  o 0 1639.4  31    ?     ?   685.415   55.4908      1080.86    55.4908      438.199    55.4908      
1 1 1 15  9  1  o 0 3084.4  57.2  ?     ?   1198.2    -41.5704     1278.97    -41.5704     169.269    -41.5704     
1 1 1 15  9  2  o 0 1064.3  21.2  ?     ?   607.52    -82.7326     815.886    -82.7326     253.022    -82.7326     
1 1 1 15  9  3  o 0 479.7   13.4  ?     ?   430.547   -51.3566     499.188    -51.3566     100.31     -51.3566     
1 1 1 15  9  4  o 0 2420.1  47.1  ?     ?   992.096   -20.8854     1191.08    -20.8854     272.437    -20.8854     
1 1 1 15  9  5  o 0 724.2   15.2  ?     ?   474.233   -52.3837     680.078    -52.3837     241.399    -52.3837     
1 1 1 15  9  6  f 1 204.5   8.4   ?     ?   369.395   -108.145     213.68     -108.145     129.255    71.855       
1 1 1 15  9  7  o 0 137.5   6.9   ?     ?   344.222   11.3735      123.662    11.3735      202.178    -168.627     
1 1 1 15  9  8  o 0 727.7   15.9  ?     ?   481.366   -40.1997     696.536    -40.1997     247.489    -40.1997     
1 1 1 15  9  9  o 0 279.3   11    ?     ?   506.346   -108.287     220.624    -108.287     250.252    71.713       
1 1 1 15  9  10 o 0 2.8     7.8   ?     ?   57.4676   -40.4304     43.1194    139.57       95.2567    139.57       
1 1 1 15  9  11 o 0 406.1   14.8  ?     ?   265.824   114.148      564.72     114.148      324.561    114.148      
1 1 1 15  9  12 o 0 152.3   10.3  ?     ?   282.99    -136.006     223.098    -136.006     33.5959    43.9939      
1 1 1 15  9  13 o 0 463.1   17.5  ?     ?   448.717   -75.2544     491.48     -75.2544     86.5812    -75.2544     
1 1 1 15  9  14 f 1 241.4   15    ?     ?   340.218   -106.756     366.023    -106.756     19.6032    -106.756     
1 1 1 15  9  15 o 0 267.8   14.8  ?     ?   366.855   -162.763     395.311    -162.763     32.4316    -162.763     
1 1 1 15  9  16 o 0 306.8   15.5  ?     ?   223.633   -74.6384     569.914    -74.6384     350.181    -74.6384     
1 1 1 15  9  17 o 0 508.4   18.7  ?     ?   464.288   -42.8882     604.569    -42.8882     159.2      -42.8882     
1 1 1 15  9  18 o 0 46.5    16.3  ?     ?   185.984   -36.2126     91.4354    -36.2126     81.2081    143.787      
1 1 1 15  9  19 o 0 363.3   20.5  ?     ?   325.684   -155.781     562.966    -155.781     261.941    -155.781     
1 1 1 15  9  20 o 0 109.8   20.2  ?     ?   169.187   -93.3658     293.665    -93.3658     123.874    -93.3658     
1 1 1 15  9  21 f 1 47.6    22.9  ?     ?   91.2901   39.3761      147.852    39.3761      55.8987    39.3761      
1 1 1 15  9  22 o 0 -14.7   27.8  ?     ?   104.627   146.142      6.3775     146.142      93.9988    -33.8579     
1 1 1 15  9  23 o 0 46.1    30    ?     ?   96.9831   91.0237      141.997    91.0237      52.9542    91.0237      
1 1 1 -15 11 22 o 0 35      16.1  ?     ?   152.399   21.9139      85.9224    21.9139      44.8091    -158.086     
1 1 1 -15 11 21 o 0 100.7   15.9  ?     ?   197.19    4.61551      246.486    4.61551      75.8364    4.61551      
1 1 1 -15 11 20 o 0 2.7     14.2  ?     ?   43.7613   30.1077      5.75144    30.1077      33.0296    -149.892     
1 1 1 -15 11 19 o 0 93.9    12.3  ?     ?   168.233   150.773      246.671    150.773      87.4913    150.773      
1 1 1 -15 11 18 o 0 46.4    11    ?     ?   138.626   -37.4078     132.622    -37.4078     1.15986    -37.4078     
1 1 1 -15 11 17 o 0 263.7   13.2  ?     ?   313.324   58.5854      419.545    58.5854      143.273    58.5854      
1 1 1 -15 11 16 o 0 128.3   10.3  ?     ?   184.903   23.6391      301.821    23.6391      138.766    23.6391      
1 1 1 -15 11 15 o 0 305.2   11    ?     ?   348.314   -103.462     455.206    -103.462     146.63     -103.462     
1 1 1 -15 11 14 o 0 213.2   9.3   ?     ?   309.745   -109.992     351.206    -109.992     67.5601    -109.992     
1 1 1 -15 11 13 o 0 19.8    6.1   ?     ?   127.08    -82.1568     8.50652    -82.1568     108.734    97.8432      
1 1 1 -15 11 12 o 0 126.6   6.8   ?     ?   368.861   -124.389     141.634    -124.389     206.86     55.6111      
1 1 1 -15 11 11 o 0 118.5   6.6   ?     ?   275.318   142.959      189.761    142.959      76.694     -37.0411     
1 1 1 -15 11 10 o 0 309.5   8.5   ?     ?   359.494   -7.17383     433.518    -7.17383     83.5147    -7.17383     
1 1 1 -15 11 9  o 0 393.8   10    ?     ?   424.102   10.7387      422.626    10.7387      54.9252    10.7387      
1 1 1 -15 11 8  o 0 330.9   9.5   ?     ?   345.157   -113.086     416.135    -113.086     115.389    -113.086     
1 1 1 -15 11 7  f 1 196.6   6.9   ?     ?   125.836   -16.6846     343.52     -16.6846     232.818    -16.6846     
1 1 1 -15 11 6  o 0 165.4   5.8   ?     ?   83.8497   75.2545      210.184    75.2545      137.145    75.2545      
1 1 1 -15 11 5  o 0 387.6   9.6   ?     ?   420.98    -31.1105     419.317    -31.1105     51.3444    -31.1105     
1 1 1 -15 11 4  f 1 282.8   9.5   ?     ?   610.941   -12.1477     143.935    -12.1477     394.413    167.852      
1 1 1 -15 11 3  o 0 426.2   11.2  ?     ?   494.358   -44.0291     404.779    -44.0291     29.6762    135.971      
1 1 1 -15 11 2  o 0 562.5   12.6  ?     ?   567.805   161.502      477.014    161.502      22.973     -18.4982     
1 1 1 -15 11 1  o 0 192.8   6.5   ?     ?   266.66    163.546      281.375    163.546      46.2142    163.546      
1 1 1 15  11 0  o 0 810.7   19.6  ?     ?   560.168   -100.747     689.992    -100.747     193.67     -100.747     
1 1 1 15  11 1  o 0 631.1   13.9  ?     ?   496.305   -136.432     598.831    -136.432     158.932    -136.432     
1 1 1 15  11 2  o 0 313.3   8     ?     ?   301.308   -177.856     426.567    -177.856     159.518    -177.856     
1 1 1 15  11 3  o 0 169.4   6.7   ?     ?   372.926   -8.56946     174.286    -8.56946     156.074    171.431      
1 1 1 15  11 4  f 1 469.4   11.6  ?     ?   457.599   -69.8458     478.85     -69.8458     71.7848    -69.8458     
1 1 1 15  11 5  o 0 362.8   10.1  ?     ?   457.307   42.72        368.122    42.72        36.0253    -137.28      
1 1 1 15  11 6  o 0 609.5   15.1  ?     ?   584.297   155.464      505.382    155.464      10.0066    -24.5365     
1 1 1 15  11 7  f 1 175.7   8.6   ?     ?   258.693   141.378      272.902    141.378      42.0934    141.378      
1 1 1 15  11 8  o 0 108.3   8.1   ?     ?   258.107   -82.3647     150.613    -82.3647     77.8291    97.6353      
1 1 1 15  11 9  o 0 15.6    8.2   ?     ?   45.0413   -95.4692     13.64      84.5308      53.4948    84.5308      
1 1 1 15  11 10 o 0 130.4   9.5   ?     ?   224.107   158.442      258.431    158.442      36.1134    158.442      
1 1 1 15  11 11 o 0 124.6   10.6  ?     ?   192.666   -124.76      284.569    -124.76      97.6096    -124.76      
1 1 1 15  11 12 o 0 105.9   11.7  ?     ?   162.346   -57.4684     259.103    -57.4684     102.342    -57.4684     
1 1 1 15  11 13 o 0 80.1    12.6  ?     ?   109.289   -160.645     226.222    -160.645     123.017    -160.645     
1 1 1 15  11 14 o 0 34.4    11.8  ?     ?   202.162   166.432      38.9067    166.432      146.148    -13.5684     
1 1 1 15  11 15 o 0 93.5    13.9  ?     ?   210.042   157.477      215.056    157.477      24.0151    157.477      
1 1 1 15  11 16 o 0 14.8    14.5  ?     ?   112.396   146.335      4.34872    146.335      97.5615    -33.6653     
1 1 1 15  11 17 o 0 141.9   18.7  ?     ?   322.985   167.904      221.574    167.904      71.6824    -12.0963     
1 1 1 15  11 18 o 0 119.8   17    ?     ?   211.561   -156.103     276.393    -156.103     69.495     -156.103     
1 1 1 15  11 19 o 0 26.5    27.2  ?     ?   160.733   -169.876     46.1983    -169.876     105.581    10.1242      
1 1 1 15  11 20 o 0 -17.7   26.5  ?     ?   113.992   131.256      2.31572    131.256      102.17     -48.7444     
1 1 1 15  11 21 o 0 -26.4   32.5  ?     ?   111.305   150.03       18.7591    150.03       81.0196    -29.9699     
1 1 1 -15 13 20 < 0 56.3    17.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 13 19 o 0 320.3   18.4  ?     ?   353.623   -127.769     458.896    -127.769     161.702    -127.769     
1 1 1 -15 13 18 o 0 137.3   15.5  ?     ?   204.953   164.413      310.61     164.413      137.037    164.413      
1 1 1 -15 13 17 o 0 17.5    12.9  ?     ?   70.5465   -29.2571     41.8319    -29.2571     19.277     150.743      
1 1 1 -15 13 16 o 0 34.5    11.4  ?     ?   89.6811   -123.694     107.704    -123.694     27.6493    -123.694     
1 1 1 -15 13 15 o 0 246.8   13.9  ?     ?   302.996   -150.339     401.777    -150.339     119.486    -150.339     
1 1 1 -15 13 14 o 0 122.6   11    ?     ?   260.366   -159.239     232.774    -159.239     9.93909    20.7615      
1 1 1 -15 13 13 o 0 74.5    9     ?     ?   165.767   167.33       190.986    167.33       47.5513    167.33       
1 1 1 -15 13 12 o 0 145.6   8.3   ?     ?   236.887   -41.8747     292.487    -41.8747     87.8481    -41.8747     
1 1 1 -15 13 11 o 0 86.6    7.7   ?     ?   146.68    23.5483      231.181    23.5483      103.628    23.5483      
1 1 1 -15 13 10 o 0 41.7    6.4   ?     ?   153.798   -67.3454     99.1637    -67.3454     34.8948    112.655      
1 1 1 -15 13 9  o 0 165.9   7.6   ?     ?   226.852   151.446      341.686    151.446      142.833    151.446      
1 1 1 -15 13 8  o 0 184.7   7.9   ?     ?   271.587   147.728      332.279    147.728      86.8759    147.728      
1 1 1 -15 13 7  o 0 46.1    5.4   ?     ?   230.321   -95.9571     58.7408    -95.9571     150.343    84.0429      
1 1 1 -15 13 6  o 0 172.9   7     ?     ?   292.2     -25.7658     288.731    -25.7658     17.8446    -25.7658     
1 1 1 -15 13 5  o 0 182.6   7.2   ?     ?   269.629   26.7221      324.417    26.7221      73.5369    26.7221      
1 1 1 -15 13 4  o 0 197.4   7.3   ?     ?   199.678   91.7735      401.853    91.7735      215.47     91.7735      
1 1 1 -15 13 3  o 0 335.5   10.1  ?     ?   266.818   -32.49       547.536    -32.49       297.812    -32.49       
1 1 1 -15 13 2  o 0 64.7    6.5   ?     ?   116.189   19.3551      159.701    19.3551      50.7144    19.3551      
1 1 1 -15 13 1  o 0 378.4   10.2  ?     ?   308.946   66.1204      553.315    66.1204      257.855    66.1204      
1 1 1 15  13 0  o 0 240.9   8.6   ?     ?   284.375   94.5998      396.366    94.5998      122.182    94.5998      
1 1 1 15  13 1  o 0 476.5   12.6  ?     ?   582.015   -176.591     423.225    -176.591     137.938    3.40852      
1 1 1 15  13 2  o 0 256.1   9     ?     ?   386.37    -131.304     345.758    -131.304     20.1113    48.696       
1 1 1 15  13 3  o 0 103.2   6.9   ?     ?   262.565   -145.914     180.458    -145.914     67.9605    34.0857      
1 1 1 15  13 4  o 0 184.8   8.6   ?     ?   290.388   -70.0344     316.061    -70.0344     41.6798    -70.0344     
1 1 1 15  13 5  o 0 177.7   8.9   ?     ?   307.471   -81.0958     289.146    -81.0958     0.860025   98.9042      
1 1 1 15  13 6  o 0 33      7.7   ?     ?   47.3582   -61.6801     36.0874    -61.6801     8.48014    118.32       
1 1 1 15  13 7  o 0 31      8.6   ?     ?   175.234   -143.771     38.0532    -143.771     123.658    36.2294      
1 1 1 15  13 8  o 0 -3.4    7.7   ?     ?   137.629   -127.285     92.3484    52.7147      218.949    52.7147      
1 1 1 15  13 9  o 0 56.5    8.9   ?     ?   259.423   -102.638     78.3322    -102.638     153.501    77.3624      
1 1 1 15  13 10 o 0 -4.7    10.7  ?     ?   53.5098   -64.0724     26.4422    115.928      74.0611    115.928      
1 1 1 15  13 11 o 0 13.6    11.5  ?     ?   137.14    -21.2758     16.4094    158.724      138.34     158.724      
1 1 1 15  13 12 o 0 98.4    17.4  ?     ?   349.942   -28.6985     107.228    -28.6985     205.01     151.302      
1 1 1 15  13 13 o 0 8.6     15.2  ?     ?   24.7559   120.004      3.12526    120.004      18.8388    -59.9962     
1 1 1 15  13 14 o 0 128.3   17.2  ?     ?   260.442   146.852      246.599    146.852      2.70322    -33.1483     
1 1 1 15  13 15 o 0 -22.1   19.2  ?     ?   84.5171   78.2018      23.7817    -101.798     104.754    -101.798     
1 1 1 15  13 16 o 0 97.3    20.5  ?     ?   149.095   149.862      270.475    149.862      133.416    149.862      
1 1 1 15  13 17 o 0 97.6    17.2  ?     ?   178.601   -158.417     252.361    -158.417     92.8097    -158.417     
1 1 1 15  13 18 o 0 37.8    24.7  ?     ?   106.155   -100.443     114.055    -100.443     21.2052    -100.443     
1 1 1 15  13 19 < 0 -23     24.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 15  13 20 < 0 24.5    24    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 15 16 < 0 52.6    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 15 15 o 0 203.8   16.9  ?     ?   331.629   -137.332     312.753    -137.332     40.3839    -137.332     
1 1 1 -15 15 14 o 0 4.8     13    ?     ?   141.911   -122.278     16.1605    57.722       133.411    57.722       
1 1 1 -15 15 13 o 0 57.7    11.9  ?     ?   84.1527   -165.865     200.245    -165.865     130.176    -165.865     
1 1 1 -15 15 12 o 0 124.7   11.9  ?     ?   258.102   147.232      241.948    147.232      22.6174    147.232      
1 1 1 -15 15 11 o 0 140.5   12.6  ?     ?   177.765   -179.515     330.267    -179.515     174.939    -179.515     
1 1 1 -15 15 10 o 0 10.9    8.5   ?     ?   79.3633   131.708      1.43717    131.708      70.7785    -48.2923     
1 1 1 -15 15 9  o 0 25.9    7.7   ?     ?   21.7974   103.458      34.4953    103.458      14.5454    103.458      
1 1 1 -15 15 8  o 0 23.7    8.4   ?     ?   90.5893   -15.4308     53.3961    -15.4308     29.3366    164.569      
1 1 1 -15 15 7  o 0 3.7     7     ?     ?   121.23    39.0422      54.6899    -140.958     165.943    -140.958     
1 1 1 -15 15 6  o 0 72.8    7.4   ?     ?   295.891   -32.3493     94.6361    -32.3493     168.759    147.651      
1 1 1 -15 15 5  o 0 360.2   12.1  ?     ?   335.278   -14.913      505.979    -14.913      220.196    -14.913      
1 1 1 -15 15 4  o 0 185.5   9.4   ?     ?   293.391   -10.6584     311.473    -10.6584     60.5428    -10.6584     
1 1 1 -15 15 3  o 0 139.8   9.1   ?     ?   287.787   113.738      239.437    113.738      7.42063    -66.2622     
1 1 1 -15 15 2  o 0 344.3   11.3  ?     ?   323.614   75.9276      502.152    75.9276      226.298    75.9276      
1 1 1 -15 15 1  o 0 50.2    8     ?     ?   138.067   -49.9138     132.64     -49.9138     14.7146    -49.9138     
1 1 1 15  15 0  o 0 262.9   10.1  ?     ?   152.145   -158.567     530.439    -158.567     399.011    -158.567     
1 1 1 15  15 1  o 0 92.2    8.2   ?     ?   128.681   -132.233     250.56     -132.233     139.434    -132.233     
1 1 1 15  15 2  o 0 2.5     7.9   ?     ?   163.745   -26.1771     82.3967    153.823      223.698    153.823      
1 1 1 15  15 3  o 0 192.9   10.7  ?     ?   309.94    -30.2528     314.793    -30.2528     45.3102    -30.2528     
1 1 1 15  15 4  o 0 57      11.4  ?     ?   165.613   -46.9472     142.594    -46.9472     1.16542    133.053      
1 1 1 15  15 5  o 0 382.1   14.6  ?     ?   442.663   -104.028     449.427    -104.028     65.9786    -104.028     
1 1 1 15  15 6  o 0 60.8    12.6  ?     ?   171.494   -75.5461     155.169    -75.5462     0.176305   104.454      
1 1 1 15  15 7  o 0 66.3    12.8  ?     ?   103.992   -4.2351      207.707    -4.2351      110.467    -4.2351      
1 1 1 15  15 8  o 0 -0.4    13.6  ?     ?   66.4624   -44.1153     13.5491    135.885      75.4796    135.885      
1 1 1 15  15 9  o 0 48.6    14.7  ?     ?   119.584   130.123      148.657    130.123      36.8359    130.123      
1 1 1 15  15 10 o 0 11.6    13.3  ?     ?   123.222   -77.4588     1.50753    102.541      116.218    102.541      
1 1 1 15  15 11 o 0 47.3    19.5  ?     ?   112.003   42.4609      139.13     42.4609      38.8703    42.4609      
1 1 1 15  15 12 o 0 -1.7    20.1  ?     ?   116.113   152.383      2.33429    152.383      98.8885    -27.6171     
1 1 1 15  15 13 o 0 133.4   21.2  ?     ?   195.169   47.1605      306.582    47.1605      139.645    47.1605      
1 1 1 15  15 14 o 0 179.8   22.7  ?     ?   180.849   -16.3878     400.057    -16.3878     246.003    -16.3878     
1 1 1 15  15 15 < 0 12.8    14.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 15  15 16 < 0 14.8    26.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 17 10 < 0 29.5    14.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 17 9  < 0 6.1     11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -15 17 8  o 0 51.3    12.2  ?     ?   202.136   -76.1976     110.611    -76.1976     52.2418    103.802      
1 1 1 -15 17 7  o 0 10.7    11.6  ?     ?   116.197   2.55448      17.3182    2.55448      76.7703    -177.446     
1 1 1 -15 17 6  o 0 11.1    11.5  ?     ?   131.98    37.6037      10.8428    37.6037      96.5144    -142.396     
1 1 1 -15 17 5  o 0 83.7    12.7  ?     ?   207.403   95.2158      190.461    95.2158      21.4415    95.2158      
1 1 1 -15 17 4  o 0 20.7    10.9  ?     ?   56.8339   175.724      56.4514    175.724      9.96794    175.724      
1 1 1 -15 17 3  o 0 35.7    13.8  ?     ?   85.3689   86.8248      116.705    86.8248      46.6639    86.8248      
1 1 1 -15 17 2  o 0 29.4    11.9  ?     ?   136.431   160.609      68.2812    160.609      45.4371    -19.3912     
1 1 1 -15 17 1  o 0 20.2    9.7   ?     ?   83.804    -170.747     49.5771    -170.747     20.4304    9.25289      
1 1 1 15  17 0  o 0 13.5    11.5  ?     ?   110.104   -53.7804     15.962     -53.7804     77.3391    126.22       
1 1 1 15  17 1  o 0 155.9   12.9  ?     ?   260.826   -53.0835     295.021    -53.0835     74.1301    -53.0835     
1 1 1 15  17 2  o 0 0.2     11.9  ?     ?   59.2808   141.73       0.149177   -38.2702     49.6483    -38.2702     
1 1 1 15  17 3  o 0 11.7    12.4  ?     ?   26.0247   -166.024     16.8747    -166.024     4.82381    13.9759      
1 1 1 15  17 4  o 0 106     15.6  ?     ?   187.513   153.459      255.837    153.459      99.7962    153.459      
1 1 1 15  17 5  o 0 40.9    13.5  ?     ?   193.053   -137.867     78.3936    -137.867     81.8758    42.1329      
1 1 1 15  17 6  o 0 89.2    14.5  ?     ?   177.705   -74.8007     229.679    -74.8007     82.2391    -74.8007     
1 1 1 15  17 7  o 0 48      15.9  ?     ?   126.888   -30.0381     145.09     -30.0381     40.1598    -30.0381     
1 1 1 15  17 8  < 0 73.8    18.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 15  17 9  < 0 -2.4    15.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 15  17 10 < 0 96.8    20.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 0  28 o 0 19.5    23.6  ?     ?   74.9242   0            60.4499    0            8.5851     180          
1 1 1 -16 0  27 o 0 71.6    22.5  ?     ?   239.584   0            184.969    0            37.9129    180          
1 1 1 -16 0  26 o 0 46      26.6  ?     ?   28.0817   0            44.2136    0            16.8691    0            
1 1 1 -16 0  25 o 0 35.9    21.3  ?     ?   139.419   0            103.922    0            37.0754    180          
1 1 1 -16 0  24 o 0 6.7     18.5  ?     ?   85.679    0            25.9975    0            54.682     180          
1 1 1 -16 0  23 o 0 233.9   17.6  ?     ?   245.125   0            362.901    0            132.587    0            
1 1 1 -16 0  22 o 0 213.2   26.4  ?     ?   228.915   0            347.384    0            124.619    0            
1 1 1 -16 0  21 o 0 78.2    18.6  ?     ?   187.696   180          199.703    180          12.1822    180          
1 1 1 -16 0  20 o 0 204     14.9  ?     ?   263.952   180          348.691    180          77.8661    180          
1 1 1 -16 0  19 f 1 28.5    11.1  ?     ?   55.9141   0            20.8377    0            30.6745    180          
1 1 1 -16 0  18 f 1 196.9   12.4  ?     ?   227.38    0            294.794    0            85.4366    0            
1 1 1 -16 0  17 o 0 528.8   22.3  ?     ?   547.02    180          513.057    180          2.63295    1.36728e-12  
1 1 1 -16 0  16 o 0 1745.7  45.6  ?     ?   896.73    0            939.305    0            87.8239    0            
1 1 1 -16 0  15 o 0 3687.7  91    ?     ?   1419.57   0            1338.05    0            0.692985   0            
1 1 1 -16 0  14 o 0 -0.6    9.7   ?     ?   220.547   0            7.89936    0            203.928    180          
1 1 1 -16 0  13 f 1 465.3   16.8  ?     ?   676.318   0            481.128    0            175.515    180          
1 1 1 -16 0  11 o 0 1273.5  45.2  ?     ?   779.505   180          845.981    180          55.0498    180          
1 1 1 -16 0  10 o 0 217.2   9.9   ?     ?   314.853   0            346.284    0            25.5405    0            
1 1 1 -16 0  9  f 1 2375.1  58.9  ?     ?   1058.6    0            1190.67    0            78.0904    0            
1 1 1 -16 0  8  o 0 69.8    3.5   ?     ?   28.2066   180          25.4553    180          3.86303    4.62364e-14  
1 1 1 -16 0  7  o 0 7.4     1.8   ?     ?   130.563   180          11.8441    180          124.146    6.69426e-16  
1 1 1 -16 0  6  o 0 629.9   17.2  ?     ?   540.058   0            570.122    0            49.7939    0            
1 1 1 -16 0  5  o 0 274.6   11.4  ?     ?   581.237   0            376.584    0            183.892    180          
1 1 1 -16 0  4  o 0 648.9   16.9  ?     ?   443.946   180          579.402    180          151.143    180          
1 1 1 -16 0  3  o 0 3063    73    ?     ?   1156.36   180          1209.33    180          137.268    180          
1 1 1 -16 0  2  f 1 2740.8  66.2  ?     ?   1027.53   0            1144.4     0            186.565    0            
1 1 1 -16 0  1  o 0 2638.9  64.4  ?     ?   1043.31   0            1123.88    0            155.509    0            
1 1 1 16  0  0  o 0 524.6   21.6  ?     ?   463.967   180          501.776    180          70.4592    -180         
1 1 1 16  0  1  o 0 35.7    1.9   ?     ?   189.689   180          70.5735    180          106.167    4.66428e-15  
1 1 1 16  0  2  f 1 1659.7  42    ?     ?   875.834   0            897.226    0            74.8006    0            
1 1 1 16  0  3  o 0 4132.4  100.1 ?     ?   1386.23   0            1418.75    0            120.351    0            
1 1 1 16  0  4  o 0 762.6   20.3  ?     ?   327.392   180          635.936    180          316.124    180          
1 1 1 16  0  5  o 0 2337.3  58.8  ?     ?   1101.04   180          1114.66    180          37.5984    180          
1 1 1 16  0  6  o 0 945.5   25.2  ?     ?   1003.21   180          709.551    180          272.38     1.82785e-14  
1 1 1 16  0  7  o 0 104.6   5.1   ?     ?   305.455   0            237.421    0            86.1709    180          
1 1 1 16  0  8  o 0 327.1   13.8  ?     ?   570.637   180          451.043    180          152.842    2.07066e-14  
1 1 1 16  0  9  f 1 148.6   8.7   ?     ?   39.5325   0            76.3207    0            34.9295    0            
1 1 1 16  0  10 o 0 3617.6  87.5  ?     ?   1393.95   0            1460.23    0            11.7857    0            
1 1 1 16  0  11 o 0 571.5   18.1  ?     ?   393.574   0            578.755    0            171.056    0            
1 1 1 16  0  12 o 0 445.4   15.9  ?     ?   349.03    180          483.091    180          136.806    180          
1 1 1 16  0  13 f 1 1965.8  52.1  ?     ?   1334.34   0            1011.5     0            313.555    180          
1 1 1 16  0  14 o 0 155.6   14.9  ?     ?   117.364   180          175.977    180          62.0762    180          
1 1 1 16  0  15 o 0 410.7   37.5  ?     ?   238.073   0            448.703    0            218.858    0            
1 1 1 16  0  16 o 0 229.9   19.7  ?     ?   59.5362   0            147.96     0            89.9669    0            
1 1 1 16  0  17 o 0 6.3     19.5  ?     ?   10.9011   0            1.0041     0            9.54944    180          
1 1 1 16  0  18 f 1 55.7    21.7  ?     ?   345.288   0            134.527    0            192.317    180          
1 1 1 16  0  19 f 1 519.3   35.9  ?     ?   319.326   0            513.478    0            210.687    0            
1 1 1 16  0  20 o 0 29.2    18.3  ?     ?   55.2898   180          25.481     180          32.9769    5.42176e-15  
1 1 1 16  0  21 o 0 16.9    26.7  ?     ?   169.58    0            56.9913    0            117.805    180          
1 1 1 16  0  22 o 0 369.7   34.6  ?     ?   472.409   0            473.879    0            1.0222     180          
1 1 1 16  0  23 o 0 63.2    29    ?     ?   75.364    0            112.075    0            38.5536    0            
1 1 1 16  0  24 o 0 77.4    32.4  ?     ?   38.5158   0            89.4121    0            51.8461    0            
1 1 1 16  0  25 o 0 55.1    37.1  ?     ?   140.802   180          136.37     180          12.435     7.69496e-14  
1 1 1 16  0  28 < 0 9.9     30    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 2  28 < 0 4.2     14.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 2  27 f 1 174.5   19.4  ?     ?   299.429   -176.272     323.891    -176.272     46.2251    -176.272     
1 1 1 -16 2  26 o 0 385.7   17.5  ?     ?   397.98    166.643      541.878    166.643      157.423    166.643      
1 1 1 -16 2  25 o 0 10.7    13.9  ?     ?   109.418   -142.752     5.63765    -142.752     105.002    37.2479      
1 1 1 -16 2  24 o 0 2.5     11.1  ?     ?   106.469   9.50088      36.0698    -170.499     135.599    -170.499     
1 1 1 -16 2  23 o 0 -1.2    8.9   ?     ?   40.5161   77.3327      21.1208    -102.667     59.0691    -102.667     
1 1 1 -16 2  22 o 0 73.1    8.7   ?     ?   226.256   44.316       149.875    44.316       68.8639    -135.684     
1 1 1 -16 2  21 o 0 121.7   10.5  ?     ?   164.246   21.9404      302.268    21.9404      139.186    21.9404      
1 1 1 -16 2  20 o 0 1398.9  27.9  ?     ?   860.501   -57.4138     929.397    -57.4138     51.5904    -57.4138     
1 1 1 -16 2  19 o 0 166.8   8.6   ?     ?   384.666   18.1108      172.767    18.1108      177.905    -161.889     
1 1 1 -16 2  18 o 0 1010.9  25.3  ?     ?   726.615   71.2599      712.024    71.2599      49.7355    71.2599      
1 1 1 -16 2  17 o 0 24.4    5.8   ?     ?   244.251   124.7        100.701    -55.2996     325.141    -55.2996     
1 1 1 -16 2  16 o 0 927.3   22.8  ?     ?   472.787   -55.2983     868.875    -55.2983     421.784    -55.2983     
1 1 1 -16 2  15 o 0 558.1   12    ?     ?   539.82    77.7538      489.886    77.7538      16.8305    -102.246     
1 1 1 -16 2  14 o 0 223.9   8.3   ?     ?   224.593   144.754      339.703    144.754      127.461    144.754      
1 1 1 -16 2  13 o 0 607.2   20.6  ?     ?   611.325   143.586      472.585    143.586      116.403    -36.4141     
1 1 1 -16 2  12 o 0 2195    44    ?     ?   1122.2    163.187      990.617    163.187      96.7976    -16.8132     
1 1 1 -16 2  11 o 0 726.1   14.5  ?     ?   558.492   89.7203      671.318    89.7203      105.4      89.7203      
1 1 1 -16 2  10 o 0 1407.9  28.2  ?     ?   797.185   128.664      946.768    128.664      135.192    128.664      
1 1 1 -16 2  9  o 0 567.3   12.1  ?     ?   605.872   13.274       482.335    13.274       137.028    -166.726     
1 1 1 -16 2  8  o 0 874.9   15.9  ?     ?   585.314   -4.45491     802.469    -4.45491     193.504    -4.45491     
1 1 1 -16 2  7  o 0 114.6   2.9   ?     ?   331.741   140.767      103.948    140.767      242.228    -39.2331     
1 1 1 -16 2  6  o 0 941.4   17.2  ?     ?   715.933   148.639      732.007    148.639      16.8675    -31.3612     
1 1 1 -16 2  5  o 0 2056.4  35.5  ?     ?   914.02    165.439      1161.41    165.439      276.664    165.439      
1 1 1 -16 2  4  f 1 492.2   9.3   ?     ?   848.791   -21.5283     161.85     -21.5283     665.071    158.472      
1 1 1 -16 2  2  o 0 200.6   4.3   ?     ?   100.818   34.8264      291.48     34.8264      193.605    34.8264      
1 1 1 -16 2  1  o 0 971.1   18.8  ?     ?   744.737   -0.330358    648.642    -0.330358    46.5141    179.67       
1 1 1 16  2  0  o 0 1365.2  23.9  ?     ?   742.087   172.893      899.275    172.893      211.532    172.893      
1 1 1 16  2  1  o 0 156.8   3.5   ?     ?   279.049   153.838      208.095    153.838      51.2358    -26.1623     
1 1 1 16  2  2  o 0 1200.1  21.5  ?     ?   645.11    -14.3704     925.372    -14.3704     299.595    -14.3704     
1 1 1 16  2  3  o 0 335     8.2   ?     ?   421.679   62.7874      376.586    62.7873      33.5753    -117.213     
1 1 1 16  2  4  f 1 1364    24    ?     ?   970.811   1.35732      724.358    1.35732      226.866    -178.643     
1 1 1 16  2  5  o 0 1349.9  24.5  ?     ?   942.943   50.9929      747.802    50.9929      172.692    -129.007     
1 1 1 16  2  6  o 0 137.8   3.9   ?     ?   374.761   100.153      122.047    100.153      274.232    -79.8472     
1 1 1 16  2  7  o 0 1248.8  23.3  ?     ?   778.527   -109.939     908.242    -109.939     85.2715    -109.939     
1 1 1 16  2  8  o 0 158     5.1   ?     ?   567.142   -169.222     19.8365    10.7775      623.886    10.7775      
1 1 1 16  2  9  o 0 609.2   12.1  ?     ?   588.965   56.1398      548.821    56.1398      63.2202    -123.86      
1 1 1 16  2  10 o 0 1037.2  19.7  ?     ?   601.008   -109.607     900.419    -109.607     277.496    -109.607     
1 1 1 16  2  11 o 0 528.7   12.8  ?     ?   375.814   -67.8796     661.749    -67.8796     273.502    -67.8796     
1 1 1 16  2  12 o 0 2248.5  42.3  ?     ?   772.897   82.8029      1374.06    82.8029      609.465    82.8029      
1 1 1 16  2  13 o 0 22.1    8     ?     ?   214.281   97.3747      114.187    -82.6253     325.23     -82.6253     
1 1 1 16  2  14 o 0 641.8   15.7  ?     ?   492.171   -67.2414     624.087    -67.2414     148.031    -67.2414     
1 1 1 16  2  15 o 0 132.7   13.8  ?     ?   250.759   -69.482      174.249    -69.482      66.9816    110.518      
1 1 1 16  2  16 o 0 182     14.1  ?     ?   297.256   159.336      247.49     159.336      40.9592    -20.6638     
1 1 1 16  2  17 o 0 553.4   18.3  ?     ?   418.535   142.913      630.056    142.913      234.914    142.913      
1 1 1 16  2  18 o 0 16.7    12.3  ?     ?   72.6345   58.8756      37.0785    -121.124     105.187    -121.124     
1 1 1 16  2  19 o 0 606.6   21.2  ?     ?   609.81    -56.4362     509.354    -56.4362     63.2959    123.564      
1 1 1 16  2  20 o 0 -11.9   16.4  ?     ?   169.686   3.6552       122.401    -176.345     300.945    -176.345     
1 1 1 16  2  21 o 0 99.7    17.2  ?     ?   134.644   42.3547      268.362    42.3547      130.282    42.3547      
1 1 1 16  2  22 o 0 49.5    17.9  ?     ?   115.372   -50.3174     141.15     -50.3174     28.6623    -50.3174     
1 1 1 16  2  23 o 0 23.4    21.5  ?     ?   131.909   39.0021      39.1846    39.0021      88.7754    -140.998     
1 1 1 16  2  24 o 0 20.3    23.8  ?     ?   177.421   -173.651     11.977     -173.651     160.048    6.3487       
1 1 1 16  2  25 o 0 33.2    29.9  ?     ?   148.646   -63.307      80.327     -63.307      75.7973    116.693      
1 1 1 16  2  26 o 0 -2.1    30.5  ?     ?   174.813   12.9171      6.05666    -167.083     178.067    -167.083     
1 1 1 16  2  27 f 1 -15     36.2  ?     ?   83.8768   -22.3166     52.6856    -22.3166     28.3528    157.683      
1 1 1 -16 4  28 < 0 1.6     16.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 4  27 o 0 45.4    18.6  ?     ?   133.176   78.5904      138.331    78.5904      17.2027    78.5904      
1 1 1 -16 4  26 o 0 49.9    16.4  ?     ?   98.0628   -5.79449     169.998    -5.7945      78.7277    -5.7945      
1 1 1 -16 4  25 o 0 11.7    12.6  ?     ?   44.587    -149.248     16.3146    -149.248     26.5696    30.7521      
1 1 1 -16 4  24 f 1 16.6    11.5  ?     ?   127.153   -90.264      8.14848    -90.264      119.559    89.736       
1 1 1 -16 4  23 o 0 70.9    10.8  ?     ?   149.065   -69.7067     205.349    -69.7067     66.62      -69.7067     
1 1 1 -16 4  22 o 0 38.5    9.2   ?     ?   128.274   147.319      102.718    147.319      16.4353    -32.6813     
1 1 1 -16 4  21 o 0 480.7   13.9  ?     ?   475.432   52.0691      567.784    52.0691      110.243    52.0691      
1 1 1 -16 4  20 o 0 33.4    7.6   ?     ?   171.823   22.6264      37.5753    22.6264      132.244    -157.374     
1 1 1 -16 4  19 f 1 79.6    8.6   ?     ?   58.7161   -155.709     131.41     -155.709     71.4863    -155.709     
1 1 1 -16 4  18 o 0 158.7   8     ?     ?   231.569   126.964      267.374    126.964      57.264     126.964      
1 1 1 -16 4  17 o 0 154.1   7.3   ?     ?   201.352   169.053      252.387    169.053      69.733     169.053      
1 1 1 -16 4  16 o 0 428.5   11.5  ?     ?   306.47    -120.676     554.507    -120.676     268.282    -120.676     
1 1 1 -16 4  15 o 0 558     13.3  ?     ?   521.088   75.1299      519.333    75.1299      28.9429    75.1299      
1 1 1 -16 4  14 o 0 11.2    5.9   ?     ?   323.647   35.7222      235.006    -144.278     537.336    -144.278     
1 1 1 -16 4  13 o 0 96      4.9   ?     ?   209.3     -164.318     107.922    -164.318     88.9102    15.6818      
1 1 1 -16 4  12 o 0 199.7   6.6   ?     ?   280.668   136.163      275.616    136.163      6.50927    136.163      
1 1 1 -16 4  11 o 0 5197.3  87.6  ?     ?   1792.37   -29.7096     1470.13    -29.7096     258.342    150.29       
1 1 1 -16 4  10 o 0 619.9   11.7  ?     ?   547.204   -163.615     582.075    -163.615     30.2233    -163.615     
1 1 1 -16 4  9  o 0 2200.1  44.3  ?     ?   975.633   133.567      1210.85    133.567      222.228    133.567      
1 1 1 -16 4  8  o 0 21.6    2.3   ?     ?   122.213   -147.58      59.0569    32.4204      183.424    32.4204      
1 1 1 -16 4  7  f 1 430.6   13.9  ?     ?   346.156   -85.8353     570.201    -85.8353     214.812    -85.8353     
1 1 1 -16 4  6  o 0 499.3   9.6   ?     ?   451.983   -34.5069     570.45     -34.5069     96.6783    -34.5069     
1 1 1 -16 4  5  o 0 573.2   11.6  ?     ?   487.235   -143.495     620.392    -143.495     112.743    -143.495     
1 1 1 -16 4  4  f 1 348.6   7.2   ?     ?   506.477   -135.89      341.218    -135.89      190.309    44.1099      
1 1 1 -16 4  3  o 0 130.9   3.4   ?     ?   375.942   -19.6922     104.852    -19.6922     288.294    160.308      
1 1 1 -16 4  2  o 0 406.9   16.3  ?     ?   186.472   -103.312     664.399    -103.312     469.17     -103.312     
1 1 1 -16 4  1  o 0 265.4   8.2   ?     ?   480.21    9.04648      251.822    9.04648      251.311    -170.954     
1 1 1 16  4  0  f 1 466.2   9.9   ?     ?   600.97    -133.463     361.835    -133.463     218.059    46.5368      
1 1 1 16  4  1  o 0 195.5   5.1   ?     ?   209.368   -150.058     343.74     -150.058     125.655    -150.058     
1 1 1 16  4  2  o 0 387.9   7.8   ?     ?   402.726   -155.31      489.862    -155.31      69.4841    -155.31      
1 1 1 16  4  3  o 0 71.6    3.1   ?     ?   367.798   126.413      38.0552    -53.5873     422.653    -53.5873     
1 1 1 16  4  4  f 1 783.3   15.7  ?     ?   805.568   164.786      505.235    164.786      342.529    -15.214      
1 1 1 16  4  5  o 0 103.2   3.4   ?     ?   216.387   -174.526     147.726    -174.526     78.9724    5.47392      
1 1 1 16  4  6  o 0 214.1   7.2   ?     ?   396.625   113.721      243.902    113.721      175.21     -66.2791     
1 1 1 16  4  7  f 1 374.4   8.3   ?     ?   491.564   -137.512     377.892    -137.512     132.079    42.4878      
1 1 1 16  4  8  o 0 156.5   5.2   ?     ?   335.34    120.661      186.347    120.661      159.24     -59.3387     
1 1 1 16  4  9  o 0 676.6   15.4  ?     ?   591.785   66.5608      604.286    66.5608      4.22655    -113.439     
1 1 1 16  4  10 o 0 2135.1  39.1  ?     ?   1057.02   51.6701      1096.51    51.6701      0.338839   -128.33      
1 1 1 16  4  11 o 0 394.1   10.6  ?     ?   292.733   -64.2241     536.114    -64.2241     248.604    -64.2241     
1 1 1 16  4  12 o 0 1045.9  23.2  ?     ?   856.553   -118.146     598.324    -118.146     239.505    61.8538      
1 1 1 16  4  13 o 0 4353.3  75.6  ?     ?   1152.18   132.967      1839.52    132.967      732.362    132.967      
1 1 1 16  4  14 o 0 1568.4  31.8  ?     ?   690.873   -158.161     1078.68    -158.161     418.229    -158.161     
1 1 1 16  4  15 o 0 165.6   12.9  ?     ?   203.253   2.00901      261.468    2.00901      65.4246    2.00901      
1 1 1 16  4  16 o 0 23.4    12    ?     ?   199.025   75.588       85.623     -104.412     272.436    -104.412     
1 1 1 16  4  17 o 0 123.2   14.4  ?     ?   353.251   121.619      109.895    121.619      219.494    -58.3813     
1 1 1 16  4  18 o 0 762     22.2  ?     ?   510.513   43.901       727.789    43.901       250.972    43.901       
1 1 1 16  4  19 f 1 12.7    12.9  ?     ?   103.875   -175.769     43.8549    4.23117      153.14     4.23117      
1 1 1 16  4  20 o 0 29.6    15.4  ?     ?   91.5163   -156.97      35.4471    -156.97      57.9286    23.0304      
1 1 1 16  4  21 o 0 189.6   18.3  ?     ?   175.159   67.6953      448.303    67.6953      274.027    67.6953      
1 1 1 16  4  22 o 0 16.4    23    ?     ?   144.408   102.843      17.6366    102.843      121.774    -77.1574     
1 1 1 16  4  23 o 0 36.6    19.5  ?     ?   185.85    177.604      55.8787    177.604      123.471    -2.39614     
1 1 1 16  4  24 f 1 159     26.1  ?     ?   192.417   -76.8057     384.979    -76.8057     184.284    -76.8057     
1 1 1 16  4  25 o 0 97.8    31.1  ?     ?   188.658   -168.41      232.731    -168.41      44.0029    -168.41      
1 1 1 16  4  26 o 0 -6.1    27.3  ?     ?   102.72    -173.993     33.0479    -173.993     65.2472    6.00666      
1 1 1 16  4  27 o 0 19.1    28.7  ?     ?   83.2625   18.6322      95.6032    18.6322      16.5866    18.6322      
1 1 1 -16 6  27 < 0 115.1   17.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 6  26 o 0 13.4    15.4  ?     ?   134.693   -64.5683     25.2883    -64.5683     95.7217    115.432      
1 1 1 -16 6  25 o 0 57      15.6  ?     ?   207.859   -6.9648      126.708    -6.9648      64.3746    173.035      
1 1 1 -16 6  24 o 0 153.7   13.3  ?     ?   318.705   -29.6322     261.862    -29.6322     40.8798    150.368      
1 1 1 -16 6  23 o 0 24.3    11.1  ?     ?   62.8721   -137.826     54.1639    -137.826     7.87712    42.1737      
1 1 1 -16 6  22 o 0 37.9    10.5  ?     ?   42.1378   -53.7048     80.1385    -53.7048     41.4141    -53.7048     
1 1 1 -16 6  21 o 0 -7.8    9.6   ?     ?   103.506   176.742      63.7678    -3.25779     158.7      -3.25779     
1 1 1 -16 6  20 f 1 28.9    7.9   ?     ?   239.494   146.368      15.4971    -33.632      244.215    -33.632      
1 1 1 -16 6  19 o 0 45.3    8     ?     ?   238.946   45.2093      39.6537    45.2093      193.474    -134.791     
1 1 1 -16 6  18 o 0 108.8   8.2   ?     ?   298.693   -133.492     154.955    -133.492     144.398    46.5079      
1 1 1 -16 6  17 o 0 329.1   10.8  ?     ?   394.343   -124.368     386.979    -124.368     33.8524    -124.368     
1 1 1 -16 6  16 o 0 95.1    6.7   ?     ?   158.281   -110.267     166.193    -110.267     23.2623    -110.267     
1 1 1 -16 6  15 f 1 1501.2  28.6  ?     ?   454.699   -77.4616     1236.11    -77.4616     823.714    -77.4616     
1 1 1 -16 6  14 o 0 585.7   14.7  ?     ?   206.654   31.7887      759.896    31.7887      568.029    31.7887      
1 1 1 -16 6  13 o 0 429.4   10.2  ?     ?   94.601    -164.87      548.09     -164.87      459.638    -164.87      
1 1 1 -16 6  12 o 0 1002.8  19.1  ?     ?   780.836   65.9914      622.601    65.9914      101.647    -114.009     
1 1 1 -16 6  11 o 0 243.9   6.4   ?     ?   492.586   119.708      176.686    119.708      282.994    -60.292      
1 1 1 -16 6  10 o 0 363.7   8     ?     ?   438.565   -94.0026     371.805    -94.0026     45.1947    85.9974      
1 1 1 -16 6  9  o 0 374.1   8.8   ?     ?   524.732   -135.519     311.666    -135.519     189.818    44.4811      
1 1 1 -16 6  8  o 0 248     5.3   ?     ?   355.735   -83.8956     294.822    -83.8956     46.7178    96.1044      
1 1 1 -16 6  7  o 0 1455.5  26.1  ?     ?   758.85    -46.0471     999.338    -46.0471     238.338    -46.0471     
1 1 1 -16 6  6  o 0 1154.5  20.9  ?     ?   774.901   158.475      790.975    158.475      11.128     158.475      
1 1 1 -16 6  5  o 0 609.2   11.5  ?     ?   432.345   -173.206     677.343    -173.206     240.934    -173.206     
1 1 1 -16 6  4  o 0 202.5   4.8   ?     ?   266.631   -48.3079     314.976    -48.3079     45.1775    -48.3079     
1 1 1 -16 6  3  o 0 287.6   6.4   ?     ?   136.141   -5.98058     478.273    -5.98058     340.25     -5.98058     
1 1 1 -16 6  2  o 0 664.6   16.8  ?     ?   408.251   -141.212     754.584    -141.212     340.102    -141.212     
1 1 1 -16 6  1  o 0 2846    84.3  ?     ?   922.311   -164.735     1569.94    -164.735     632.677    -164.735     
1 1 1 16  6  0  o 0 1284.3  31.1  ?     ?   662.302   68.0959      991.138    68.0959      321.391    68.0959      
1 1 1 16  6  1  o 0 134     4.3   ?     ?   457.914   -63.3079     34.4175    -63.3079     429.384    116.692      
1 1 1 16  6  2  o 0 817.2   15.9  ?     ?   751.624   72.9978      564.068    72.9978      198.199    -107.002     
1 1 1 16  6  3  o 0 1876.4  33.4  ?     ?   1052.33   46.0765      966.677    46.0765      101.501    -133.923     
1 1 1 16  6  4  o 0 94.7    3.8   ?     ?   201.645   48.7662      127.497    48.7662      77.2687    -131.234     
1 1 1 16  6  5  o 0 762.8   14.7  ?     ?   718.384   119.782      551.21     119.782      178.195    -60.2177     
1 1 1 16  6  6  o 0 3104.2  54    ?     ?   1155.41   69.5783      1451.37    69.5783      279.083    69.5783      
1 1 1 16  6  7  o 0 645.8   17.8  ?     ?   649.711   54.8607      502.593    54.8607      163.675    -125.139     
1 1 1 16  6  8  o 0 806.4   18.8  ?     ?   556.992   104.548      695.082    104.548      153.618    104.548      
1 1 1 16  6  9  o 0 3373.4  64.5  ?     ?   1206.38   14.884       1413.43    14.884       243.696    14.884       
1 1 1 16  6  10 o 0 168.6   8.2   ?     ?   297.272   34.9539      214.83     34.9539      72.4995    -145.046     
1 1 1 16  6  11 o 0 625.6   15.1  ?     ?   302.757   25.7986      748.838    25.7986      461.101    25.7986      
1 1 1 16  6  12 o 0 8.9     7.6   ?     ?   197.843   -102.006     147.337    77.9935      334.555    77.9935      
1 1 1 16  6  13 o 0 19.9    10.2  ?     ?   267.094   -95.4828     155.622    84.5172      410.846    84.5172      
1 1 1 16  6  14 o 0 600.7   16.7  ?     ?   424.653   130.657      645.685    130.657      242.078    130.657      
1 1 1 16  6  15 f 1 221.9   10.8  ?     ?   216.583   139.085      365.849    139.085      164.438    139.085      
1 1 1 16  6  16 o 0 129.3   13.3  ?     ?   336.292   -119.194     144.53     -119.194     167.342    60.8057      
1 1 1 16  6  17 o 0 66.7    14.4  ?     ?   259.189   144.7        78.0672    144.7        191.488    -35.3005     
1 1 1 16  6  18 o 0 220.2   14.9  ?     ?   273.352   -167.336     398.709    -167.336     116.485    -167.336     
1 1 1 16  6  19 o 0 -6.8    15.2  ?     ?   14.5268   136          7.8522     -43.9998     22.4755    -43.9998     
1 1 1 16  6  20 f 1 147.1   16.6  ?     ?   316.428   150.799      256.179    150.799      48.316     -29.2006     
1 1 1 16  6  21 o 0 207.7   20.4  ?     ?   389.425   -154.315     297.293    -154.315     73.75      25.6847      
1 1 1 16  6  22 o 0 39.8    18.3  ?     ?   150.033   175.959      90.8317    175.959      52.0864    -4.04064     
1 1 1 16  6  23 o 0 240.4   25.9  ?     ?   375.603   -156.437     355.976    -156.437     28.8044    23.5631      
1 1 1 16  6  24 o 0 126.9   24.9  ?     ?   325.022   -114.646     198.506    -114.646     122.522    65.3538      
1 1 1 16  6  25 o 0 94.4    28.4  ?     ?   232.999   -102.786     186.52     -102.786     36.5521    77.2136      
1 1 1 -16 8  25 o 0 5.6     12.3  ?     ?   64.5104   137.919      22.8285    137.919      33.9529    -42.0815     
1 1 1 -16 8  24 o 0 45.8    15.9  ?     ?   192.493   -146.259     96.5545    -146.259     74.5334    33.7409      
1 1 1 -16 8  23 o 0 29.5    13.2  ?     ?   165.449   -163.048     49.2418    -163.048     104.695    16.9519      
1 1 1 -16 8  22 o 0 29.5    10.6  ?     ?   67.2164   -174.286     87.4493    -174.286     22.0035    -174.286     
1 1 1 -16 8  21 o 0 139.1   12.5  ?     ?   194.108   105.765      334.542    105.765      144.926    105.765      
1 1 1 -16 8  20 o 0 15.7    10.1  ?     ?   117.601   -151.343     1.87442    28.6573      107.873    28.6573      
1 1 1 -16 8  19 o 0 11.1    9.6   ?     ?   179.206   -154.537     55.7149    25.4634      218.237    25.4634      
1 1 1 -16 8  18 o 0 471.3   14    ?     ?   412.47    80.899       600.351    80.899       213.074    80.899       
1 1 1 -16 8  17 o 0 246.3   9.9   ?     ?   223.678   6.08475      474.43     6.08475      258.904    6.08475      
1 1 1 -16 8  16 o 0 518.6   13.4  ?     ?   547.65    -144.623     511.447    -144.623     30.2638    35.3773      
1 1 1 -16 8  15 o 0 933.7   19.5  ?     ?   549.888   -132.899     884.398    -132.899     336.019    -132.899     
1 1 1 -16 8  14 o 0 100.4   5.9   ?     ?   193.614   179.887      167.387    179.887      4.94144    -0.113089    
1 1 1 -16 8  13 o 0 346.7   9.6   ?     ?   329.784   -153.292     447.985    -153.292     154.892    -153.292     
1 1 1 -16 8  12 o 0 121.8   6.2   ?     ?   132.447   85.7504      185.048    85.7504      66.5372    85.7504      
1 1 1 -16 8  11 o 0 11.5    4.3   ?     ?   201.18    -68.2268     138.736    111.773      323.735    111.773      
1 1 1 -16 8  10 o 0 257.8   6.7   ?     ?   390.937   175.656      283.696    175.656      77.8853    -4.34441     
1 1 1 -16 8  9  o 0 88.7    4.1   ?     ?   451.089   -155.458     60.7695    24.5422      474.121    24.5422      
1 1 1 -16 8  8  o 0 816.7   15.6  ?     ?   642.505   -87.6098     606.217    -87.6098     14.644     -87.6098     
1 1 1 -16 8  7  o 0 2566.9  44.3  ?     ?   936.813   -108.614     1303.06    -108.614     436.835    -108.614     
1 1 1 -16 8  6  o 0 1602.8  28.8  ?     ?   723.925   153.169      1029.75    153.169      349        153.169      
1 1 1 -16 8  5  o 0 4771.9  80.9  ?     ?   1608.08   -145.068     1479.31    -145.068     37.7087    34.9324      
1 1 1 -16 8  4  o 0 2913    50.8  ?     ?   1096.07   96.1493      1302.37    96.1493      265.587    96.1493      
1 1 1 -16 8  3  o 0 738.9   14.2  ?     ?   564.557   -4.63819     618.016    -4.63819     82.8433    -4.63819     
1 1 1 -16 8  2  o 0 1709.5  31.3  ?     ?   1001.18   -101.194     842.15     -101.194     108.492    78.8062      
1 1 1 -16 8  1  o 0 1295.4  24.8  ?     ?   1015.26   35.9458      594.953    35.9458      370.182    -144.054     
1 1 1 16  8  0  f 1 3413.4  61    ?     ?   1055.07   -87.3755     1536.12    -87.3755     528.783    -87.3755     
1 1 1 16  8  1  o 0 1646.9  30    ?     ?   769.486   -133.425     1023.75    -133.425     292.075    -133.425     
1 1 1 16  8  2  o 0 562.3   13.8  ?     ?   786.053   -121.013     267.659    -121.013     480.266    58.9867      
1 1 1 16  8  3  o 0 2849.5  51.1  ?     ?   1157.33   145.039      1227.08    145.039      125.618    145.039      
1 1 1 16  8  4  o 0 1658.3  32.1  ?     ?   883.596   -169.51      925.492    -169.51      84.737     -169.51      
1 1 1 16  8  5  o 0 193.9   8.7   ?     ?   341.942   2.76753      221.6      2.76753      103.529    -177.232     
1 1 1 16  8  6  o 0 256.9   7.9   ?     ?   330.115   32.3522      323.128    32.3522      9.63573    32.3522      
1 1 1 16  8  7  o 0 563.6   13.4  ?     ?   471.878   70.375       550.817    70.375       109.327    70.375       
1 1 1 16  8  8  o 0 87.1    7     ?     ?   236.053   -116.02      76.8599    -116.02      143.474    63.9795      
1 1 1 16  8  9  o 0 251.4   9.4   ?     ?   164.798   122.763      393.796    122.763      236.279    122.763      
1 1 1 16  8  10 o 0 376.1   13.2  ?     ?   297.963   94.0621      505.805    94.0621      225.383    94.0621      
1 1 1 16  8  11 o 0 1233.8  25.7  ?     ?   743.436   -95.4325     832.596    -95.4325     135.72     -95.4325     
1 1 1 16  8  12 o 0 171.4   10.1  ?     ?   271.464   -90.8012     252.818    -90.8012     4.78318    -90.8012     
1 1 1 16  8  13 o 0 103     9.9   ?     ?   357.904   -38.4663     62.0059    -38.4663     263.361    141.534      
1 1 1 16  8  14 o 0 -2.2    11.3  ?     ?   23.6855   107.561      16.4968    -72.4391     38.0972    -72.4391     
1 1 1 16  8  15 o 0 327     15.3  ?     ?   415.362   128.573      426.68     128.573      1.56303    128.573      
1 1 1 16  8  16 o 0 61      12.6  ?     ?   151.992   -57.1729     148.397    -57.1729     3.45293    122.827      
1 1 1 16  8  17 o 0 100.7   14.2  ?     ?   189.071   -50.3433     236.648    -50.3433     49.0712    -50.3433     
1 1 1 16  8  18 o 0 120.8   14.8  ?     ?   196.606   90.6788      288.266    90.6788      97.8982    90.6788      
1 1 1 16  8  19 o 0 131.6   18.2  ?     ?   252.35    -137.151     272.463    -137.151     36.0784    -137.151     
1 1 1 16  8  20 o 0 242.8   20.6  ?     ?   259.078   -27.0711     459.818    -27.0711     216.121    -27.0711     
1 1 1 16  8  21 o 0 148.7   24.3  ?     ?   221.71    12.5953      333.048    12.5953      108.636    12.5953      
1 1 1 16  8  22 o 0 165.5   37.2  ?     ?   136.59    10.3705      414.304    10.3705      276.284    10.3705      
1 1 1 16  8  23 o 0 35      27    ?     ?   107.847   -153.743     105.328    -153.743     3.19901    -153.743     
1 1 1 16  8  24 o 0 27.9    32.1  ?     ?   112.415   11.7338      95.6564    11.7338      8.36895    -168.266     
1 1 1 16  8  25 < 0 0.4     28.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 10 23 f 1 -0.6    11.2  ?     ?   140.467   -67.4629     32.693     112.537      154.874    112.537      
1 1 1 -16 10 22 o 0 4.3     12.3  ?     ?   88.8025   72.3256      3.76964    72.3256      73.7842    -107.674     
1 1 1 -16 10 21 o 0 67.7    12.7  ?     ?   224.158   21.6869      138.703    21.6869      66.1056    -158.313     
1 1 1 -16 10 20 o 0 281     14.5  ?     ?   317.871   102.725      446.94     102.725      143.199    102.725      
1 1 1 -16 10 19 o 0 55.6    10.6  ?     ?   130.485   59.2866      170.081    59.2866      45.0672    59.2866      
1 1 1 -16 10 18 o 0 414.2   14    ?     ?   410.157   6.48121      526.744    6.48121      161.225    6.48121      
1 1 1 -16 10 17 o 0 140.7   10.6  ?     ?   248.009   60.1602      283.15     60.1602      62.0192    60.1602      
1 1 1 -16 10 16 o 0 16.2    7.3   ?     ?   70.1169   12.6107      7.4092     12.6107      55.4234    -167.389     
1 1 1 -16 10 15 o 0 74.8    7.5   ?     ?   209.744   -134.75      160.794    -134.75      33.5704    45.2505      
1 1 1 -16 10 14 o 0 45.4    6.2   ?     ?   226.72    -58.4157     48.3697    -58.4157     166.981    121.584      
1 1 1 -16 10 13 o 0 364.9   11.1  ?     ?   409.779   111.455      459.116    111.455      60.0303    111.455      
1 1 1 -16 10 12 o 0 540.9   13.4  ?     ?   514.754   134.758      560.655    134.758      55.8573    134.758      
1 1 1 -16 10 11 o 0 260.9   7.9   ?     ?   550.575   148.435      168.905    148.435      312.368    -31.5651     
1 1 1 -16 10 10 o 0 214.7   7.5   ?     ?   231.156   -18.7655     347.233    -18.7655     143.97     -18.7655     
1 1 1 -16 10 9  f 1 116.6   6.9   ?     ?   279.152   -152.945     138.121    -152.945     107.798    27.0554      
1 1 1 -16 10 8  o 0 273.2   7.8   ?     ?   242.692   -74.2322     408.002    -74.2322     194.245    -74.2322     
1 1 1 -16 10 7  o 0 73.5    4     ?     ?   195.761   -106.978     77.7309    -106.978     95.4536    73.0217      
1 1 1 -16 10 6  o 0 733.7   14.9  ?     ?   559.299   -67.1974     617.778    -67.1974     110.474    -67.1974     
1 1 1 -16 10 5  o 0 343.2   8.1   ?     ?   495.206   -1.1403      303.583    -1.1403      147.116    178.86       
1 1 1 -16 10 4  o 0 431.9   9.5   ?     ?   383.681   83.0403      490.541    83.0403      140.333    83.0403      
1 1 1 -16 10 3  o 0 1412.8  27.5  ?     ?   636.737   128.419      1012.15    128.419      429.572    128.419      
1 1 1 -16 10 2  o 0 225.5   6.5   ?     ?   326.681   115.679      282.297    115.679      17.1662    -64.3215     
1 1 1 -16 10 1  o 0 1385.2  28.4  ?     ?   687.317   36.7613      955.59     36.7613      324.64     36.7613      
1 1 1 16  10 0  o 0 1130.6  22.5  ?     ?   347.661   8.08464      1082.94    8.08464      762.765    8.08464      
1 1 1 16  10 1  o 0 160.3   5.7   ?     ?   434.358   -51.5715     99.747     -51.5715     300.512    128.428      
1 1 1 16  10 2  o 0 18.2    4.3   ?     ?   100.213   -20.7319     53.2187    159.268      145.582    159.268      
1 1 1 16  10 3  o 0 1035.2  23.5  ?     ?   446.769   -3.56075     943.124    -3.56075     531.456    -3.56075     
1 1 1 16  10 4  o 0 2976.7  53.5  ?     ?   1144.75   -15.7013     1305.39    -15.7013     251.322    -15.7013     
1 1 1 16  10 5  o 0 2419.6  44.1  ?     ?   1068.79   69.2916      1138.78    69.2915      155.823    69.2915      
1 1 1 16  10 6  o 0 925     19.2  ?     ?   485.381   95.805       831.785    95.805       386.13     95.805       
1 1 1 16  10 7  o 0 726.9   16.4  ?     ?   350.493   -174.363     800.029    -174.363     485.613    -174.363     
1 1 1 16  10 8  o 0 1113.5  22.9  ?     ?   704.774   -116.516     786.287    -116.516     155.758    -116.516     
1 1 1 16  10 9  f 1 454.7   13.3  ?     ?   506.45    -166.598     427.856    -166.598     26.11      13.4022      
1 1 1 16  10 10 o 0 -8.1    8.5   ?     ?   86.2975   130.861      67.5172    -49.1392     144.861    -49.1392     
1 1 1 16  10 11 o 0 81.9    8.4   ?     ?   246.897   22.6004      98.9027    22.6004      121.439    -157.4       
1 1 1 16  10 12 o 0 9.8     9.3   ?     ?   54.9453   125.211      28.8958    -54.7886     83.999     -54.7886     
1 1 1 16  10 13 o 0 96.2    10.9  ?     ?   220.107   -91.0305     202.515    -91.0305     13.2323    88.9695      
1 1 1 16  10 14 o 0 22.7    10.7  ?     ?   160.934   132.965      13.3614    -47.0348     170.202    -47.0348     
1 1 1 16  10 15 o 0 133.1   13.2  ?     ?   199.109   6.62688      308.48     6.62688      118.864    6.62688      
1 1 1 16  10 16 o 0 191.6   16.3  ?     ?   313.192   39.7625      331.251    39.7625      42.3636    39.7625      
1 1 1 16  10 17 o 0 12.2    16.7  ?     ?   110.917   -113.816     1.87686    -113.816     100.083    66.1843      
1 1 1 16  10 18 o 0 92.7    18.1  ?     ?   280.211   -91.2191     155.057    -91.2191     102.803    88.7809      
1 1 1 16  10 19 o 0 29.9    21    ?     ?   57.0442   -32.3278     71.2529    -32.3278     14.7278    -32.3278     
1 1 1 16  10 20 o 0 135.1   27.8  ?     ?   291.94    28.9854      225.407    28.9854      63.5713    -151.015     
1 1 1 16  10 21 o 0 -18.9   29    ?     ?   63.1387   140.439      20.5125    140.439      38.0947    -39.5611     
1 1 1 16  10 22 o 0 38.5    27.5  ?     ?   170.611   177.989      76.7002    177.989      78.1424    -2.01139     
1 1 1 16  10 23 < 1 11.3    29    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 12 21 < 0 82.4    18.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 12 20 o 0 153.9   15.9  ?     ?   280.595   -120.289     284.69     -120.289     45.5845    -120.289     
1 1 1 -16 12 19 o 0 125     15.7  ?     ?   288.952   -153.156     219.507    -153.156     31.9898    26.8438      
1 1 1 -16 12 18 f 1 7.7     14.2  ?     ?   114.709   6.20108      0.735836   -173.799     104.241    -173.799     
1 1 1 -16 12 17 o 0 260.2   13.7  ?     ?   420.87    13.3485      317.589    13.3485      77.0879    -166.652     
1 1 1 -16 12 16 o 0 17.3    9.9   ?     ?   90.0908   -145.027     22.7491    -145.027     61.859     34.9735      
1 1 1 -16 12 15 o 0 98.5    9.4   ?     ?   173.604   -82.8326     244.663    -82.8326     93.1914    -82.8326     
1 1 1 -16 12 14 f 1 369.9   12.7  ?     ?   197.572   -88.4496     638.683    -88.4496     465.536    -88.4496     
1 1 1 -16 12 13 o 0 65.5    7.8   ?     ?   279.368   -79.0695     87.4607    -79.0695     157.038    100.93       
1 1 1 -16 12 12 o 0 102.5   7.5   ?     ?   349.649   -36.7853     123.145    -36.7853     185.029    143.215      
1 1 1 -16 12 11 o 0 140.2   7.2   ?     ?   267.647   -121.436     258.809    -121.436     15.2931    -121.436     
1 1 1 -16 12 10 o 0 29.1    5.2   ?     ?   205.861   -85.0486     11.9584    -85.0486     176.485    94.9514      
1 1 1 -16 12 9  f 1 152.5   7.1   ?     ?   143.114   -66.5944     355.877    -66.5944     221.21     -66.5944     
1 1 1 -16 12 8  o 0 150.2   6     ?     ?   236.174   -135.491     296.504    -135.491     74.2793    -135.491     
1 1 1 -16 12 7  o 0 320.5   9     ?     ?   224.784   173.71       550.497    173.71       334.239    173.71       
1 1 1 -16 12 6  o 0 90.6    5.2   ?     ?   247.782   40.1039      146.677    40.1039      92.6855    -139.896     
1 1 1 -16 12 5  o 0 97.8    5     ?     ?   295.578   42.9113      127.63     42.9113      158.934    -137.089     
1 1 1 -16 12 4  o 0 18.1    4.4   ?     ?   90.8804   -12.6761     31.1546    167.324      109.432    167.324      
1 1 1 -16 12 3  o 0 472.9   11.8  ?     ?   556.177   -120.023     394.007    -120.023     86.3035    59.9769      
1 1 1 -16 12 2  o 0 106.9   5.8   ?     ?   136.629   136.454      184.039    136.454      65.794     136.454      
1 1 1 -16 12 1  o 0 19.4    4.6   ?     ?   153.809   -1.03306     53.1663    178.967      186.502    178.967      
1 1 1 16  12 0  f 1 812.9   17.9  ?     ?   657.518   -151.216     594.19     -151.216     17.2579    -151.216     
1 1 1 16  12 1  o 0 856.9   18.6  ?     ?   592.741   -159.107     683.102    -159.107     165.557    -159.107     
1 1 1 16  12 2  o 0 165     6.7   ?     ?   344.644   127.312      192.829    127.312      108.029    -52.6877     
1 1 1 16  12 3  o 0 5.4     5.9   ?     ?   183.997   27.6902      126.871    -152.31      287.388    -152.31      
1 1 1 16  12 4  o 0 275.5   8.6   ?     ?   364.558   177.393      334.908    177.393      17.2221    177.393      
1 1 1 16  12 5  o 0 104.8   7.1   ?     ?   283.904   -130.752     155.021    -130.752     123.883    49.2481      
1 1 1 16  12 6  o 0 233.5   9.7   ?     ?   277.012   -139.248     397.632    -139.248     126.053    -139.248     
1 1 1 16  12 7  o 0 28.9    6.8   ?     ?   202.549   158.475      21.6205    -21.5247     219.696    -21.5247     
1 1 1 16  12 8  o 0 83.1    9.4   ?     ?   198.745   41.3971      180.447    41.3971      9.93963    -138.603     
1 1 1 16  12 9  f 1 18.2    9.1   ?     ?   75.6043   109.517      4.91528    -70.4826     77.4571    -70.4826     
1 1 1 16  12 10 o 0 93.7    10.1  ?     ?   158.814   100.733      243.052    100.733      94.5797    100.733      
1 1 1 16  12 11 o 0 86.4    11.1  ?     ?   274.695   -51.2638     139.898    -51.2638     115.757    128.736      
1 1 1 16  12 12 o 0 198.3   13.6  ?     ?   380.981   -57.925      279.627    -57.925      64.3969    122.075      
1 1 1 16  12 13 o 0 39.2    10.4  ?     ?   175.606   13.705       79.4258    13.705       78.8734    -166.295     
1 1 1 16  12 14 f 1 4.3     14    ?     ?   46.5869   -63.6005     6.92065    116.399      48.8809    116.399      
1 1 1 16  12 15 o 0 89.8    14.2  ?     ?   258.711   -15.001      164.365    -15.001      67.9897    164.999      
1 1 1 16  12 16 o 0 23.4    17.3  ?     ?   127.49    -80.454      41.8337    -80.454      81.6051    99.546       
1 1 1 16  12 17 o 0 84.3    24.7  ?     ?   185.557   -155.442     199.558    -155.442     19.8808    -155.442     
1 1 1 16  12 18 f 1 -34.9   26.7  ?     ?   90.141    -47.69       13.3413    132.31       97.4592    132.31       
1 1 1 16  12 19 o 0 64.2    26    ?     ?   135.812   -16.0848     174.701    -16.0848     53.8565    -16.0848     
1 1 1 16  12 20 o 0 79.1    28.4  ?     ?   196.829   45.5403      164.195    45.5403      9.81027    -134.46      
1 1 1 16  12 21 < 0 39.1    28.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 14 18 < 0 3.7     20    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 14 17 o 0 29.7    14.3  ?     ?   96.7503   28.5239      99.3417    28.5239      19.0592    28.5239      
1 1 1 -16 14 16 o 0 76.4    14.1  ?     ?   129.655   -17.7316     229.332    -17.7316     121.005    -17.7316     
1 1 1 -16 14 15 f 1 98      13    ?     ?   303.146   172.976      149.104    172.976      111.079    -7.02399     
1 1 1 -16 14 14 o 0 124.5   13.3  ?     ?   155.934   158.605      315.39     158.605      178.29     158.605      
1 1 1 -16 14 13 o 0 198.3   12.9  ?     ?   309.965   42.0903      317.392    42.0903      33.1904    42.0903      
1 1 1 -16 14 12 o 0 -0.4    9     ?     ?   92.5441   -98.3485     37.4865    81.6515      122.953    81.6515      
1 1 1 -16 14 11 o 0 35.4    7.6   ?     ?   93.7425   2.24385      108.271    2.24385      21.7629    2.24385      
1 1 1 -16 14 10 o 0 95.6    8.5   ?     ?   161.168   33.9989      241.52     33.9989      103.65     33.9989      
1 1 1 -16 14 9  o 0 23.8    6.3   ?     ?   56.0744   13.852       44.8275    13.852       3.41798    -166.148     
1 1 1 -16 14 8  o 0 17.4    6.4   ?     ?   110.012   67.9588      8.90442    67.9588      85.4219    -112.041     
1 1 1 -16 14 7  o 0 50.6    6.3   ?     ?   58.4682   -118.089     122.587    -118.089     72.2147    -118.089     
1 1 1 -16 14 6  o 0 159.7   7.2   ?     ?   396.205   -10.0718     192.981    -10.0718     148.542    169.928      
1 1 1 -16 14 5  o 0 83.6    6.6   ?     ?   204.007   -117.091     188.473    -117.091     11.9491    -117.091     
1 1 1 -16 14 4  o 0 -4.5    6     ?     ?   6.86857   24.5672      4.61637    -155.433     10.5794    -155.433     
1 1 1 -16 14 3  o 0 31.1    5.7   ?     ?   270.759   81.3877      17.8036    -98.6123     253.539    -98.6123     
1 1 1 -16 14 2  o 0 28.5    6.1   ?     ?   131.846   55.4836      56.9672    55.4836      58.0975    -124.516     
1 1 1 -16 14 1  o 0 1.6     5.7   ?     ?   89.9401   -92.5022     56.6008    87.4978      137.252    87.4978      
1 1 1 16  14 0  o 0 12.2    6.1   ?     ?   244.767   -167.45      107.477    12.5497      329.266    12.5497      
1 1 1 16  14 1  o 0 84.7    6.5   ?     ?   41.7345   152.713      160.28     152.713      122.467    152.713      
1 1 1 16  14 2  o 0 286.8   10.1  ?     ?   359.291   -65.4845     420.912    -65.4845     103.666    -65.4845     
1 1 1 16  14 3  o 0 438.5   13.6  ?     ?   479.594   -44.9927     498.274    -44.9927     75.2222    -44.9927     
1 1 1 16  14 4  o 0 317.8   11.3  ?     ?   397.53    -57.0084     427.653    -57.0084     77.4952    -57.0084     
1 1 1 16  14 5  o 0 13.3    7.9   ?     ?   78.6373   -97.5172     5.12314    82.4828      74.2579    82.4828      
1 1 1 16  14 6  o 0 83.5    9.3   ?     ?   230.342   114.028      171.054    114.028      30.975     -65.9716     
1 1 1 16  14 7  o 0 17.4    9     ?     ?   134.601   -168.7       1.23831    11.3003      119.404    11.3003      
1 1 1 16  14 8  o 0 9.4     11    ?     ?   125.35    -34.2829     27.1207    145.717      136.801    145.717      
1 1 1 16  14 9  o 0 33      12.7  ?     ?   88.3639   23.7143      82.0444    23.7143      4.34503    23.7143      
1 1 1 16  14 10 o 0 93.3    15.8  ?     ?   163.668   3.13435      247.144    3.13435      96.9067    3.13435      
1 1 1 16  14 11 o 0 7.1     18.9  ?     ?   164.96    53.3831      25.2231    -126.617     181.265    -126.617     
1 1 1 16  14 12 o 0 14.2    17.7  ?     ?   105.833   6.78123      27.3204    6.78123      73.0154    -173.219     
1 1 1 16  14 13 o 0 27.8    18.8  ?     ?   139.835   -128.032     55.24      -128.032     72.1378    51.9681      
1 1 1 16  14 14 o 0 260     28.4  ?     ?   313.41    -175.32      405.129    -175.32      121.399    -175.32      
1 1 1 16  14 15 f 1 25.1    13.2  ?     ?   188.394   -141.853     16.9582    -141.853     149.782    38.1474      
1 1 1 16  14 16 o 0 9       23.4  ?     ?   77.9681   75.5309      50.4885    75.5309      16.7888    -104.469     
1 1 1 16  14 17 < 0 -0.9    21.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 16  14 18 < 0 36.6    26.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 16 13 < 0 61.2    13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 16 12 < 0 67.5    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 16 11 o 0 -9.6    10.7  ?     ?   90.6578   -148.436     24.0985    31.5635      98.1541    31.5635      
1 1 1 -16 16 10 o 0 122.1   10.4  ?     ?   218.796   62.103       266.471    62.103       86.9945    62.103       
1 1 1 -16 16 9  o 0 49.9    10.1  ?     ?   167.221   23.5635      128.81     23.5635      11.0005    -156.436     
1 1 1 -16 16 8  o 0 87.9    9.9   ?     ?   193.064   -81.4285     212.312    -81.4286     50.0116    -81.4286     
1 1 1 -16 16 7  o 0 -12.5   8.9   ?     ?   88.9156   -65.1652     50.6966    114.835      127.417    114.835      
1 1 1 -16 16 6  o 0 71.8    10    ?     ?   98.6657   -1.71024     226.361    -1.71024     140.844    -1.71024     
1 1 1 -16 16 5  o 0 21.1    9.4   ?     ?   162.502   -129.136     15.0359    -129.136     126.378    50.8639      
1 1 1 -16 16 4  o 0 211.2   11    ?     ?   327.166   -152.243     318.75     -152.243     23.0734    -152.243     
1 1 1 -16 16 3  o 0 315.7   20    ?     ?   327.813   150.784      456.524    150.784      159.35     150.784      
1 1 1 -16 16 2  o 0 122.1   10.8  ?     ?   258.368   82.017       226.563    82.017       8.26827    -97.983      
1 1 1 -16 16 1  f 1 368.1   13.3  ?     ?   354.337   87.7236      499.747    87.7236      175.338    87.7236      
1 1 1 16  16 0  o 0 197.4   11.8  ?     ?   260.424   62.1701      361.811    62.1701      121.339    62.1701      
1 1 1 16  16 1  f 1 4.3     10.9  ?     ?   81.5268   32.7419      13.4401    -147.258     89.0767    -147.258     
1 1 1 16  16 2  o 0 41.9    10.8  ?     ?   165.198   98.8876      98.9784    98.8876      53.3704    -81.1124     
1 1 1 16  16 3  o 0 171.8   15.9  ?     ?   175.185   123.626      385.687    123.626      224.336    123.626      
1 1 1 16  16 4  o 0 125.6   12.9  ?     ?   234.68    -173.224     254.349    -173.224     38.5791    -173.224     
1 1 1 16  16 5  o 0 228.9   14.1  ?     ?   369.855   -116.875     321.251    -116.875     6.62982    63.1253      
1 1 1 16  16 6  o 0 219.2   15.3  ?     ?   287.219   -87.1232     377.397    -87.1232     123.451    -87.1232     
1 1 1 16  16 7  o 0 27.6    14.4  ?     ?   59.2659   -18.7657     65.9991    -18.7657     13.7624    -18.7657     
1 1 1 16  16 8  o 0 39.5    16.8  ?     ?   63.6367   61.0773      117.702    61.0773      62.9794    61.0773      
1 1 1 16  16 9  o 0 47.1    18.3  ?     ?   110.113   158.955      144.562    158.955      51.4867    158.955      
1 1 1 16  16 10 o 0 14.1    18.6  ?     ?   83.0213   18.6292      47.8088    18.6292      22.0486    -161.371     
1 1 1 16  16 11 o 0 -56.4   20.9  ?     ?   129.558   -30.9088     43.9769    149.091      152.691    149.091      
1 1 1 16  16 12 < 0 -20.5   20.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 16  16 13 < 0 61.2    27.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 18 3  < 0 61.4    13.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 18 2  < 0 49.4    13.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -16 18 1  < 1 73.7    12.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 16  18 0  < 0 100.7   13    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 16  18 1  < 1 34      12.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 16  18 2  < 0 4.8     14    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 16  18 3  < 0 -21.4   15.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 1  28 < 0 46.6    19    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 1  27 o 0 94.3    17.1  ?     ?   225.021   137.951      222.72     137.951      14.7249    137.951      
1 1 1 -17 1  26 o 0 256.1   18.5  ?     ?   321.126   136.175      438.163    136.175      127.403    136.175      
1 1 1 -17 1  25 o 0 61.5    11.4  ?     ?   114.73    50.6979      205.051    50.6979      89.7179    50.6979      
1 1 1 -17 1  24 o 0 47.2    11.4  ?     ?   107.712   -61.0468     148.138    -61.0468     47.2977    -61.0468     
1 1 1 -17 1  23 o 0 196.6   15.2  ?     ?   247.609   100.903      399.064    100.903      166.843    100.903      
1 1 1 -17 1  22 o 0 66.6    8.3   ?     ?   202.381   89.8889      149.406    89.8889      46.4777    -90.1111     
1 1 1 -17 1  21 o 0 293.5   10.7  ?     ?   415.341   -165.097     390.359    -165.097     22.4449    14.9025      
1 1 1 -17 1  20 o 0 314.3   9.7   ?     ?   161.794   101.158      614.917    101.158      449.735    101.158      
1 1 1 -17 1  19 o 0 222.4   7.9   ?     ?   340.981   53.4461      295.113    53.4461      15.9284    -126.554     
1 1 1 -17 1  18 o 0 268.5   12.7  ?     ?   296.788   -14.7152     383.054    -14.7152     112.424    -14.7152     
1 1 1 -17 1  17 o 0 1171.1  23.1  ?     ?   635.432   114.881      889.835    114.881      293.388    114.881      
1 1 1 -17 1  16 o 0 2488.9  51.8  ?     ?   957.264   24.2557      1304.8     24.2557      399.568    24.2557      
1 1 1 -17 1  15 o 0 348.4   9.5   ?     ?   351.124   8.98369      425.166    8.98369      95.6546    8.98369      
1 1 1 -17 1  14 o 0 789.2   17    ?     ?   682.654   -101.722     564.551    -101.722     80.233     78.2779      
1 1 1 -17 1  13 o 0 1166.5  28.1  ?     ?   576.151   -11.8148     927.148    -11.8148     372.489    -11.8148     
1 1 1 -17 1  12 o 0 556.4   11.5  ?     ?   521.581   -144.769     508.571    -144.769     3.71693    -144.769     
1 1 1 -17 1  11 o 0 1737.2  35.6  ?     ?   811.681   130.215      1123.43    130.215      302.149    130.215      
1 1 1 -17 1  10 o 0 182.1   5.3   ?     ?   359.595   133.944      211.468    133.944      153.953    -46.056      
1 1 1 -17 1  9  o 0 736     13.6  ?     ?   522.871   -17.0611     718.005    -17.0611     184.678    -17.0611     
1 1 1 -17 1  8  o 0 276.5   5.8   ?     ?   333.215   -159.022     395.35     -159.022     49.5919    -159.022     
1 1 1 -17 1  6  o 0 101.5   3     ?     ?   212.618   92.3983      144.055    92.3983      77.545     -87.6017     
1 1 1 -17 1  5  o 0 143.3   3.3   ?     ?   173.662   112.871      229.553    112.871      62.1367    112.871      
1 1 1 -17 1  4  o 0 226.5   4.5   ?     ?   398.7     -56.4554     244.035    -56.4554     140.68     123.545      
1 1 1 -17 1  3  o 0 409.8   7.7   ?     ?   598.884   -66.1168     307.221    -66.1168     271.029    113.883      
1 1 1 -17 1  2  o 0 158.4   3.4   ?     ?   157.012   81.5868      247.452    81.5868      101.693    81.5868      
1 1 1 -17 1  1  f 1 1792.4  31.5  ?     ?   814.094   45.1019      1069.31    45.1019      309.068    45.1019      
1 1 1 17  1  0  o 0 262.2   5.5   ?     ?   378.729   -133.949     299.848    -133.949     50.897     46.0513      
1 1 1 17  1  1  f 1 209.5   4.7   ?     ?   214.226   107.963      326.622    107.963      126.694    107.963      
1 1 1 17  1  2  o 0 426.6   8.6   ?     ?   367.145   -25.2173     506.982    -25.2173     165.128    -25.2173     
1 1 1 17  1  4  o 0 2617    45.4  ?     ?   1240.04   40.9129      1123.75    40.9129      83.8625    -139.087     
1 1 1 17  1  5  o 0 439.3   8.9   ?     ?   280.32    -1.25489     609.825    -1.25489     336.415    -1.25489     
1 1 1 17  1  6  o 0 94.4    3.3   ?     ?   303.959   88.5575      75.7596    88.5575      245.426    -91.4425     
1 1 1 17  1  7  o 0 242.9   7.8   ?     ?   292.715   109.35       381.702    109.35       72.4366    109.35       
1 1 1 17  1  8  o 0 135     4.5   ?     ?   270.916   -160.646     195.89     -160.646     92.5666    19.3544      
1 1 1 17  1  9  o 0 1202.8  23.6  ?     ?   784.973   -46.1025     840.538    -46.1025     24.8936    -46.1025     
1 1 1 17  1  10 o 0 1163.9  22    ?     ?   693.325   -117.586     902.45     -117.586     183.764    -117.586     
1 1 1 17  1  11 o 0 772.9   16.6  ?     ?   655.645   126.491      631.606    126.491      45.9513    -53.5091     
1 1 1 17  1  12 o 0 2019    36.7  ?     ?   962.789   116.961      1078.96    116.961      125.998    116.961      
1 1 1 17  1  13 o 0 110.1   8.2   ?     ?   237.174   -33.973      137.748    -33.973      96.0187    146.027      
1 1 1 17  1  14 o 0 620.4   17.6  ?     ?   742.444   -85.7944     379.063    -85.7944     339.767    94.2056      
1 1 1 17  1  15 o 0 258.8   14.5  ?     ?   432.647   -144.024     254.092    -144.024     162.605    35.9759      
1 1 1 17  1  16 o 0 1349.1  30.2  ?     ?   869.956   67.2135      818.401    67.2135      26.9477    -112.787     
1 1 1 17  1  17 o 0 485.6   17.8  ?     ?   462.678   85.4419      525.93     85.4419      88.417     85.4419      
1 1 1 17  1  18 o 0 114.4   13.4  ?     ?   239.084   -49.714      165.048    -49.714      59.5406    130.286      
1 1 1 17  1  19 o 0 240.4   18.6  ?     ?   385.437   -9.3219      293.297    -9.3219      69.3761    170.678      
1 1 1 17  1  20 o 0 170     17.2  ?     ?   251.62    48.9001      333.456    48.9001      68.1185    48.9001      
1 1 1 17  1  21 o 0 227.5   21.8  ?     ?   241.303   66.2502      457.037    66.2502      208.981    66.2502      
1 1 1 17  1  22 o 0 507     23.2  ?     ?   540.232   -77.9718     570.215    -77.9718     42.1151    -77.9718     
1 1 1 17  1  23 o 0 463.7   23.8  ?     ?   409.089   -82.1752     636.477    -82.1752     238.521    -82.1752     
1 1 1 17  1  24 o 0 254.3   27.3  ?     ?   362.034   167.909      393.404    167.909      41.3229    167.909      
1 1 1 17  1  25 o 0 14.9    25.6  ?     ?   152.042   165.964      25.3623    165.964      134.843    -14.0357     
1 1 1 17  1  26 o 0 -12.8   27.8  ?     ?   85.3875   135.104      13.6943    135.104      72.4076    -44.8958     
1 1 1 17  1  27 o 0 12.5    32.4  ?     ?   43.0376   -162.517     68.0293    -162.517     26.5104    -162.517     
1 1 1 -17 3  28 < 0 -20.8   15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 3  27 o 0 101.4   16.8  ?     ?   255.759   96.1349      215.286    96.1349      18.723     -83.8651     
1 1 1 -17 3  26 o 0 21.8    11.3  ?     ?   81.8077   144.316      63.463     144.316      13.1217    -35.6841     
1 1 1 -17 3  25 o 0 74.6    16.6  ?     ?   210.96    -100.848     169.566    -100.848     41.6009    79.1516      
1 1 1 -17 3  24 o 0 14.1    9.9   ?     ?   133.997   -7.12124     8.85453    172.879      143.489    172.879      
1 1 1 -17 3  23 o 0 -2.6    9.7   ?     ?   128.188   113.428      70.104     -66.5722     189.006    -66.5722     
1 1 1 -17 3  22 f 1 12.1    9.6   ?     ?   128.468   42.3421      25.4275    -137.658     146.005    -137.658     
1 1 1 -17 3  21 o 0 137.5   9     ?     ?   330.848   -5.53027     214.47     -5.53027     105.552    174.47       
1 1 1 -17 3  20 o 0 538.2   14    ?     ?   483.986   -57.5973     618.655    -57.5973     137.953    -57.5973     
1 1 1 -17 3  19 o 0 1004    20.4  ?     ?   605.312   93.6028      905.426    93.6028      287.888    93.6028      
1 1 1 -17 3  18 o 0 607.3   15.3  ?     ?   473.127   120.901      613.271    120.901      182.015    120.901      
1 1 1 -17 3  17 o 0 1044.8  21.6  ?     ?   909.049   -161.782     574.885    -161.782     253.385    18.2181      
1 1 1 -17 3  16 o 0 370.4   10.2  ?     ?   361.581   -172.075     452.389    -172.075     113.269    -172.075     
1 1 1 -17 3  15 o 0 179     8.6   ?     ?   334.252   112.917      211.406    112.917      104.417    -67.0831     
1 1 1 -17 3  14 o 0 12.8    4.9   ?     ?   136.999   137.026      92.4097    -42.9744     220.871    -42.9744     
1 1 1 -17 3  13 o 0 2375.7  58.3  ?     ?   990.03    -103.522     1184.06    -103.522     237.364    -103.522     
1 1 1 -17 3  12 o 0 41.4    3     ?     ?   526.1     -87.7158     264.565    92.2842      770.665    92.2842      
1 1 1 -17 3  11 o 0 3087.1  66.3  ?     ?   1164.56   28.5383      1337.15    28.5383      210.686    28.5383      
1 1 1 -17 3  10 o 0 204.1   5.2   ?     ?   512.923   80.5219      113.069    80.5219      405.639    -99.4781     
1 1 1 -17 3  9  o 0 57.8    3.5   ?     ?   126.326   -55.7471     38.6494    -55.7471     89.6735    124.253      
1 1 1 -17 3  8  o 0 341.7   7.9   ?     ?   290.87    -21.0972     505.606    -21.0972     208.974    -21.0972     
1 1 1 -17 3  7  o 0 278.9   6     ?     ?   396.623   -130.31      343.333    -130.31      71.839     49.6902      
1 1 1 -17 3  6  o 0 1309.4  23.2  ?     ?   848.013   -169.842     865.951    -169.842     16.5649    10.1584      
1 1 1 -17 3  5  o 0 272.9   5.6   ?     ?   409.18    -69.9979     327.101    -69.9979     99.7146    110.002      
1 1 1 -17 3  4  o 0 132.1   3.1   ?     ?   368.432   -66.2702     113.749    -66.2702     271.264    113.73       
1 1 1 -17 3  3  o 0 159.9   5.1   ?     ?   425.077   46.2176      112.403    46.2176      298.482    -133.782     
1 1 1 -17 3  2  f 1 217.6   7     ?     ?   174.913   -145.594     361.808    -145.594     191.689    -145.594     
1 1 1 -17 3  1  o 0 264.3   6.3   ?     ?   238.213   -7.57997     413.741    -7.57997     183.059    -7.57997     
1 1 1 17  3  0  o 0 349.7   6.9   ?     ?   417.172   -9.65359     393.813    -9.65359     7.00582    170.346      
1 1 1 17  3  1  o 0 2334.9  40.5  ?     ?   1198.73   112.033      1021.96    112.033      132.63     -67.9666     
1 1 1 17  3  3  o 0 246.5   5.5   ?     ?   424.53    114.095      253.134    114.095      157.671    -65.9046     
1 1 1 17  3  4  o 0 1468.1  25.8  ?     ?   928.426   162.902      896.618    162.902      77.6719    -17.0985     
1 1 1 17  3  5  o 0 851     15.7  ?     ?   738.258   125.817      637.874    125.817      137.673    -54.1828     
1 1 1 17  3  6  o 0 1271.2  26.1  ?     ?   753.84    148.361      943.331    148.361      151.164    148.361      
1 1 1 17  3  7  o 0 279.7   7.3   ?     ?   416.896   -17.4204     330.219    -17.4204     111.488    162.58       
1 1 1 17  3  8  o 0 5792.4  97.2  ?     ?   1664.44   147.771      1942.94    147.771      221.13     147.771      
1 1 1 17  3  9  o 0 1576.1  29.5  ?     ?   956.314   130.392      905.75     130.392      81.6044    -49.6079     
1 1 1 17  3  10 o 0 738     15.3  ?     ?   535.713   -46.9442     714.511    -46.9442     162.862    -46.9442     
1 1 1 17  3  11 o 0 273.4   9.4   ?     ?   421.451   111.322      284.566    111.322      131.258    -68.678      
1 1 1 17  3  12 o 0 1381    27.8  ?     ?   910.791   45.6916      768.357    45.6916      126.804    -134.308     
1 1 1 17  3  13 o 0 480.9   13.5  ?     ?   419.48    96.5075      530.819    96.5075      125.707    96.5075      
1 1 1 17  3  14 o 0 239.8   18.6  ?     ?   223.978   16.1254      369.2      16.1254      153.965    16.1254      
1 1 1 17  3  15 o 0 611.4   17.4  ?     ?   613.116   20.3934      503.377    20.3934      91.2036    -159.607     
1 1 1 17  3  16 o 0 274.8   14    ?     ?   373.354   36.4852      333.066    36.4852      26.8515    -143.515     
1 1 1 17  3  17 o 0 33.2    15.7  ?     ?   77.8787   136.004      11.7349    -43.9958     84.7766    -43.9958     
1 1 1 17  3  18 o 0 523.6   18.9  ?     ?   618.855   61.2238      423.321    61.2238      158.174    -118.776     
1 1 1 17  3  19 o 0 173.2   17.2  ?     ?   263.404   160.757      329.74     160.757      52.3172    160.757      
1 1 1 17  3  20 o 0 104.6   16.7  ?     ?   213.612   166.944      235.926    166.944      16.5732    166.944      
1 1 1 17  3  21 o 0 27.2    17.8  ?     ?   135.92    38.1505      36.1778    38.1505      99.9533    -141.85      
1 1 1 17  3  22 f 1 21.1    21.2  ?     ?   189.347   18.7071      0.389349   -161.293     184.683    -161.293     
1 1 1 17  3  23 o 0 145.8   22.9  ?     ?   227.406   -89.237      325.502    -89.237      106.426    -89.237      
1 1 1 17  3  24 o 0 171.2   26.3  ?     ?   215.125   -46.5338     392.838    -46.5338     167.993    -46.5338     
1 1 1 17  3  25 o 0 85.1    24.2  ?     ?   164.544   6.46497      233.388    6.46497      61.7818    6.46497      
1 1 1 17  3  26 o 0 140.9   34.7  ?     ?   261.476   75.1549      274.306    75.1549      18.851     75.1549      
1 1 1 17  3  27 o 0 -44     31    ?     ?   211.282   101.769      69.663     -78.2309     271.744    -78.2309     
1 1 1 -17 5  27 < 0 33.9    18.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 5  26 o 0 -3.3    15.2  ?     ?   26.0563   -52.2038     4.592      -52.2038     18.9982    127.796      
1 1 1 -17 5  25 o 0 13.1    11.5  ?     ?   99.1751   -139.406     11.8065    -139.406     82.2242    40.5941      
1 1 1 -17 5  24 f 1 41.4    11.6  ?     ?   162.859   -100.986     104.961    -100.986     57.5224    79.0144      
1 1 1 -17 5  23 o 0 65      11    ?     ?   65.9893   7.59251      200.927    7.59251      137.433    7.59251      
1 1 1 -17 5  22 o 0 156.3   10.7  ?     ?   334.899   36.5155      249.862    36.5155      58.1316    -143.485     
1 1 1 -17 5  21 o 0 69.1    10.1  ?     ?   216.641   106.075      151.567    106.075      48.9906    -73.9248     
1 1 1 -17 5  20 o 0 75.7    7.5   ?     ?   296.824   179.445      98.3556    179.445      186.269    -0.5553      
1 1 1 -17 5  19 o 0 231.6   8.8   ?     ?   425.838   159.893      285.468    159.893      133.785    -20.1072     
1 1 1 -17 5  18 o 0 76.3    7.5   ?     ?   89.7446   160.296      157.862    160.296      67.112     160.296      
1 1 1 -17 5  17 f 1 13.7    6.3   ?     ?   427.124   -48.7095     272.998    131.29       660.845    131.29       
1 1 1 -17 5  16 o 0 358.2   10.8  ?     ?   257.51    93.4819      515.707    93.4819      283.181    93.4819      
1 1 1 -17 5  15 o 0 503.5   12.4  ?     ?   628.77    77.5456      368.137    77.5456      216.249    -102.454     
1 1 1 -17 5  14 o 0 1092.6  21.3  ?     ?   860.962   154.079      634.093    154.079      172.002    -25.9214     
1 1 1 -17 5  13 f 1 660.1   14.4  ?     ?   808.476   146.545      335.347    146.545      419.664    -33.4551     
1 1 1 -17 5  12 o 0 852.1   23.8  ?     ?   779.465   79.9605      520.312    79.9605      208.553    -100.039     
1 1 1 -17 5  11 o 0 474.6   9.7   ?     ?   423.431   5.26384      505.047    5.26384      101.485    5.26384      
1 1 1 -17 5  10 o 0 659     12.7  ?     ?   374.403   105.138      720.225    105.138      361.437    105.138      
1 1 1 -17 5  9  f 1 458.9   9.1   ?     ?   227.847   23.7834      634.706    23.7834      414.147    23.7834      
1 1 1 -17 5  8  f 1 336.2   7.1   ?     ?   448.676   -102.301     359.642    -102.301     94.1867    77.699       
1 1 1 -17 5  7  o 0 666.9   12.7  ?     ?   687.105   33.2828      493.872    33.2828      200.29     -146.717     
1 1 1 -17 5  6  o 0 3433.3  58.2  ?     ?   1321.87   -176.633     1419.83    -176.633     79.8375    -176.633     
1 1 1 -17 5  5  f 1 943.2   17.2  ?     ?   596.01    74.5582      813.966    74.5582      204.933    74.5582      
1 1 1 -17 5  4  o 0 594.3   12.6  ?     ?   530.869   -79.7793     578.619    -79.7793     37.6588    -79.7793     
1 1 1 -17 5  3  o 0 298     7     ?     ?   390.438   -42.0377     375.548    -42.0377     32.1961    137.962      
1 1 1 -17 5  2  o 0 1790.1  68.1  ?     ?   685.463   100.378      1320.31    100.378      609.685    100.378      
1 1 1 -17 5  1  o 0 4021.1  99.4  ?     ?   1099.36   25.6317      1935.94    25.6317      795.169    25.6317      
1 1 1 17  5  0  o 0 718.8   15.2  ?     ?   717.428   34.9512      531.732    34.9512      207.986    -145.049     
1 1 1 17  5  1  o 0 158.1   5.1   ?     ?   274.016   1.46836      237.132    1.46836      45.9309    -178.532     
1 1 1 17  5  2  o 0 607.1   11.9  ?     ?   388.921   52.2247      737.44     52.2247      331.507    52.2247      
1 1 1 17  5  3  o 0 677.6   15.5  ?     ?   344.64    71.3176      844.803    71.3176      484.623    71.3176      
1 1 1 17  5  4  o 0 897.2   16.9  ?     ?   529.939   -38.837      848.111    -38.837      306.263    -38.837      
1 1 1 17  5  5  f 1 450.4   9     ?     ?   580.859   68.1561      379.525    68.1561      217.6      -111.844     
1 1 1 17  5  6  o 0 7.4     2.6   ?     ?   178.823   99.2641      150.596    -80.7359     333.422    -80.7359     
1 1 1 17  5  7  o 0 92.5    4.9   ?     ?   224.73    -8.13606     114.09     -8.13606     115.441    171.864      
1 1 1 17  5  8  f 1 728.8   15.1  ?     ?   863.9     -30.6484     376.344    -30.6484     509.076    149.352      
1 1 1 17  5  9  f 1 1512.8  30.7  ?     ?   826.295   53.8768      918.978    53.8768      106.758    53.8768      
1 1 1 17  5  10 o 0 1480.6  27.5  ?     ?   775.643   163.538      949.292    163.538      192.98     163.538      
1 1 1 17  5  11 o 0 1545.8  30.3  ?     ?   807.436   -144.678     953.634    -144.678     169.096    -144.678     
1 1 1 17  5  12 o 0 1967.6  38.4  ?     ?   1189.47   -148.164     827.786    -148.164     308.224    31.8362      
1 1 1 17  5  13 f 1 1059.1  23.3  ?     ?   524.778   -166.946     928.145    -166.946     413.184    -166.946     
1 1 1 17  5  14 o 0 62.3    10.1  ?     ?   237.371   89.5246      15.1019    89.5246      212.681    -90.4754     
1 1 1 17  5  15 o 0 16.8    10.9  ?     ?   192.486   -31.859      105.079    148.141      284.917    148.141      
1 1 1 17  5  16 o 0 219.9   13.4  ?     ?   339.021   91.8759      289.599    91.8759      25.1974    -88.1241     
1 1 1 17  5  17 f 1 237.8   13.6  ?     ?   410.787   73.3208      264.696    73.3208      119.499    -106.679     
1 1 1 17  5  18 o 0 179.5   14.4  ?     ?   203.457   -53.998      385.112    -53.998      172.868    -53.998      
1 1 1 17  5  19 o 0 45.3    15.5  ?     ?   200.368   162.483      60.4751    162.483      143.356    -17.5168     
1 1 1 17  5  20 o 0 463.7   20    ?     ?   545.854   133.361      497.015    133.361      44.6738    -46.6392     
1 1 1 17  5  21 o 0 56      20.9  ?     ?   117.364   133.965      156.712    133.965      44.0885    133.965      
1 1 1 17  5  22 o 0 52.9    20.2  ?     ?   206.13    150.45       96.7005    150.45       100.116    -29.5498     
1 1 1 17  5  23 o 0 105.6   25.6  ?     ?   222.08    160.587      240.707    160.587      10.6243    160.587      
1 1 1 17  5  24 f 1 41.6    28    ?     ?   135.126   -16.0088     108.662    -16.0088     31.7631    163.991      
1 1 1 17  5  25 o 0 57.5    28.3  ?     ?   118.67    -104.485     171.448    -104.485     56.503     -104.485     
1 1 1 17  5  26 o 0 14      32.4  ?     ?   166.456   -112.555     38.3692    -112.555     119.133    67.4454      
1 1 1 -17 7  26 < 0 16.3    16.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 7  25 o 0 68.4    12.7  ?     ?   164.222   58.6502      200.721    58.6502      54.4638    58.6502      
1 1 1 -17 7  24 o 0 26      12.8  ?     ?   128.128   -111.641     64.5675    -111.641     52.4323    68.3591      
1 1 1 -17 7  23 o 0 15.5    9.8   ?     ?   73.7253   -63.5752     24.4987    -63.5752     47.4741    116.425      
1 1 1 -17 7  22 o 0 34      9.4   ?     ?   143.729   -79.4479     87.2639    -79.4479     53.5535    100.552      
1 1 1 -17 7  21 o 0 162.4   10.6  ?     ?   130.071   -9.09395     412.051    -9.09395     293.398    -9.09395     
1 1 1 -17 7  20 o 0 176.2   10.5  ?     ?   276.475   9.67         333.07     9.67         81.4292    9.67         
1 1 1 -17 7  19 o 0 25.6    9.1   ?     ?   209.634   22.4774      12.6167    -157.523     210.223    -157.523     
1 1 1 -17 7  18 o 0 124.2   9     ?     ?   140.585   -148.78      310.886    -148.78      174.843    -148.78      
1 1 1 -17 7  17 o 0 182.5   8.6   ?     ?   257.82    -122.698     333.958    -122.698     77.7494    -122.698     
1 1 1 -17 7  16 f 1 553.4   13.5  ?     ?   388.585   -138.485     702.189    -138.485     310.724    -138.485     
1 1 1 -17 7  15 o 0 218.9   7.9   ?     ?   475.791   -149.861     177.08     -149.861     248.685    30.1392      
1 1 1 -17 7  14 o 0 249.5   7.5   ?     ?   253.184   -11.9296     376.406    -11.9296     150.091    -11.9296     
1 1 1 -17 7  13 o 0 1578    32.2  ?     ?   830.955   170.366      939.346    170.366      175.321    170.366      
1 1 1 -17 7  12 o 0 14      4     ?     ?   172.632   -124.758     109.155    55.2419      268.948    55.2419      
1 1 1 -17 7  11 o 0 235.4   6.3   ?     ?   382.889   -57.893      255.578    -57.893      105.359    122.107      
1 1 1 -17 7  10 o 0 1221.7  24.4  ?     ?   668.206   -83.7154     860.807    -83.7154     243.942    -83.7154     
1 1 1 -17 7  9  o 0 480.5   11.5  ?     ?   412.408   -44.7836     515.348    -44.7836     132.635    -44.7836     
1 1 1 -17 7  8  o 0 748.7   14.3  ?     ?   540.657   -74.8287     644.609    -74.8287     133.86     -74.8287     
1 1 1 -17 7  7  o 0 410.7   12.4  ?     ?   602.461   -92.1191     281.47     -92.1191     290.056    87.8809      
1 1 1 -17 7  6  o 0 398.4   9.4   ?     ?   521.271   141.061      340.756    141.061      155.566    -38.9394     
1 1 1 -17 7  5  o 0 153.1   4     ?     ?   472.599   -83.7445     48.1892    -83.7445     403.206    96.2555      
1 1 1 -17 7  4  o 0 382.2   7.7   ?     ?   272.128   12.8781      550.601    12.8781      276.234    12.8781      
1 1 1 -17 7  3  f 1 928.7   17.6  ?     ?   718.655   27.9646      671.497    27.9646      49.6203    -152.035     
1 1 1 -17 7  1  o 0 55.1    2.6   ?     ?   56.9702   -131.767     20.9276    -131.767     36.1003    48.2334      
1 1 1 17  7  0  o 0 1512    32.6  ?     ?   991.794   -60.9207     803.107    -60.9207     187.112    119.079      
1 1 1 17  7  1  o 0 563.5   11.9  ?     ?   593.504   -159.552     479.631    -159.552     113.709    20.4479      
1 1 1 17  7  2  o 0 1671.2  30.1  ?     ?   856.917   30.028       1030.01    30.028       172.5      30.028       
1 1 1 17  7  3  f 1 2269.4  40.1  ?     ?   1049.16   74.8604      1153.69    74.8604      97.803     74.8604      
1 1 1 17  7  4  o 0 480.9   11.2  ?     ?   589.646   160.405      390.888    160.405      206.693    -19.5951     
1 1 1 17  7  5  o 0 908.6   23.3  ?     ?   973.358   111.868      381.505    111.868      555.078    -68.1323     
1 1 1 17  7  6  o 0 2226.3  54.6  ?     ?   1187.44   55.5518      935.352    55.5518      206.15     -124.448     
1 1 1 17  7  7  o 0 5014    127   ?     ?   1350.36   85.9462      1823.75    85.9462      527.583    85.9462      
1 1 1 17  7  8  o 0 581.7   20.1  ?     ?   474.77    43.824       567.158    43.824       112.391    43.824       
1 1 1 17  7  9  o 0 1221.8  24.5  ?     ?   767.644   10.9519      789.906    10.9519      66.1078    10.9519      
1 1 1 17  7  10 o 0 101.2   8.2   ?     ?   202.284   -42.8957     121.342    -42.8957     68.7719    137.104      
1 1 1 17  7  11 o 0 880.9   20.6  ?     ?   560.494   -14.3177     762.672    -14.3177     230.178    -14.3177     
1 1 1 17  7  12 o 0 335.1   13.3  ?     ?   246.153   -47.0024     490.007    -47.0024     257.163    -47.0024     
1 1 1 17  7  13 o 0 277.2   13.8  ?     ?   372.974   32.1736      343.831    32.1736      0.0506997  32.1736      
1 1 1 17  7  14 o 0 29.8    10.8  ?     ?   400.749   31.4039      187.821    -148.596     555.219    -148.596     
1 1 1 17  7  15 o 0 80.1    10.1  ?     ?   100.635   46.3749      121.216    46.3749      28.6944    46.3749      
1 1 1 17  7  16 f 1 37.2    12    ?     ?   169.233   -70.2224     29.4227    -70.2224     146.037    109.778      
1 1 1 17  7  17 o 0 5.3     12.9  ?     ?   81.3144   62.4758      34.6324    -117.524     116.481    -117.524     
1 1 1 17  7  18 o 0 180.3   16.6  ?     ?   419.901   -178.888     205.675    -178.888     213.917    1.1117       
1 1 1 17  7  19 o 0 138.4   19    ?     ?   261.718   -159.017     283.484    -159.017     34.6602    -159.017     
1 1 1 17  7  20 o 0 35.2    19.7  ?     ?   158.061   -96.1068     63.8349    -96.1068     85.7783    83.8932      
1 1 1 17  7  21 o 0 6.7     23    ?     ?   239.581   -122.366     66.7907    57.6336      293.6      57.6336      
1 1 1 17  7  22 o 0 50      24.2  ?     ?   107.232   -138.01      146.552    -138.01      37.3401    -138.01      
1 1 1 17  7  23 o 0 43.7    27.2  ?     ?   223.039   -66.3064     42.7103    -66.3064     176.378    113.694      
1 1 1 17  7  24 o 0 48.6    31.5  ?     ?   149.526   -110.402     118.671    -110.402     23.7447    69.5976      
1 1 1 -17 9  24 o 0 14.5    14.9  ?     ?   140.199   -55.4701     23.7184    -55.4701     98.371     124.53       
1 1 1 -17 9  23 f 1 17.1    16.4  ?     ?   74.6179   37.5672      54.6232    37.5672      11.3132    -142.433     
1 1 1 -17 9  22 o 0 -26.5   14.1  ?     ?   60.0283   -101.259     30.0143    78.7411      85.2446    78.7411      
1 1 1 -17 9  21 o 0 189.6   14.7  ?     ?   271.859   50.1675      352.425    50.1675      90.7424    50.1675      
1 1 1 -17 9  20 o 0 43      11.7  ?     ?   85.0298   45.9366      140.079    45.9366      57.9865    45.9366      
1 1 1 -17 9  19 o 0 26.3    10.3  ?     ?   144.019   9.33562      43.1775    9.33562      86.2053    -170.664     
1 1 1 -17 9  18 o 0 378     12.7  ?     ?   470.148   17.38        445.842    17.38        24.6859    17.38        
1 1 1 -17 9  17 o 0 125.7   8.6   ?     ?   185.314   104.883      305.035    104.883      137.502    104.883      
1 1 1 -17 9  16 o 0 53.3    6.8   ?     ?   130.634   76.9683      143.337    76.9683      21.1604    76.9683      
1 1 1 -17 9  15 o 0 253.6   9.1   ?     ?   416.112   -90.9086     319.812    -90.9086     79.2573    89.0914      
1 1 1 -17 9  14 o 0 50.1    6.3   ?     ?   206.699   -113.984     59.1282    -113.984     144.21     66.0161      
1 1 1 -17 9  13 o 0 213.4   7.8   ?     ?   218.273   127.509      351.529    127.509      159.955    127.509      
1 1 1 -17 9  12 o 0 333.3   10.4  ?     ?   457.277   129.142      336.738    129.142      67.3685    -50.8579     
1 1 1 -17 9  11 o 0 693     14.5  ?     ?   533.955   176.179      616.447    176.179      145.68     176.179      
1 1 1 -17 9  10 o 0 516.1   11.5  ?     ?   482.83    -170.275     506.846    -170.275     78.6404    -170.275     
1 1 1 -17 9  9  o 0 494.7   11    ?     ?   334.88    158.281      588.133    158.281      283.181    158.281      
1 1 1 -17 9  8  o 0 335.3   8     ?     ?   314.446   -13.7007     433.995    -13.7007     146.25     -13.7007     
1 1 1 -17 9  7  o 0 264.9   8.1   ?     ?   318.723   -161.176     343.724    -161.176     50.7857    -161.176     
1 1 1 -17 9  6  o 0 475.4   10.3  ?     ?   369.312   -37.4968     547.08     -37.4968     202.21     -37.4968     
1 1 1 -17 9  5  o 0 1006.9  19.7  ?     ?   616.036   -156.634     758.009    -156.634     195.981    -156.634     
1 1 1 -17 9  4  o 0 782.7   15.5  ?     ?   740.807   145.448      491.225    145.448      186.553    -34.5519     
1 1 1 -17 9  3  o 0 663     13.8  ?     ?   411.445   84.6046      674.638    84.6046      297.322    84.6046      
1 1 1 -17 9  2  o 0 917.4   18.4  ?     ?   723.261   -28.2552     608.106    -28.2552     56.3815    151.745      
1 1 1 -17 9  1  o 0 2766.3  49    ?     ?   1095.23   18.4206      1237.1     18.4206      229.506    18.4206      
1 1 1 17  9  0  o 0 610.2   12.7  ?     ?   345.178   177.25       683.029    177.25       364.972    177.25       
1 1 1 17  9  1  o 0 1812.3  33.2  ?     ?   678.037   -146.95      1180.16    -146.95      554.874    -146.95      
1 1 1 17  9  2  o 0 1532.7  28.1  ?     ?   1035.95   -176.408     713.94     -176.408     241.832    3.59201      
1 1 1 17  9  3  o 0 135.7   5.3   ?     ?   314.827   128.199      137.063    128.199      153.401    -51.8013     
1 1 1 17  9  4  o 0 564.2   16.2  ?     ?   564.762   5.99406      465.566    5.99406      55.2645    -174.006     
1 1 1 17  9  5  o 0 1535.6  31.8  ?     ?   830.536   96.9348      898.359    96.9349      133.132    96.9349      
1 1 1 17  9  6  o 0 713.4   15.2  ?     ?   632.607   -170.719     548.16     -170.719     49.5805    9.28104      
1 1 1 17  9  7  o 0 587.5   13.9  ?     ?   269.573   -143.986     733.695    -143.986     482.513    -143.986     
1 1 1 17  9  8  o 0 2.3     6.3   ?     ?   105.731   -87.7017     86.4042    92.2983      184.68     92.2983      
1 1 1 17  9  9  o 0 415.9   10.7  ?     ?   531.944   157.078      360.344    157.078      132.61     -22.9221     
1 1 1 17  9  10 o 0 105     8.6   ?     ?   257.209   25.8663      130.64     25.8663      101.93     -154.134     
1 1 1 17  9  11 o 0 163.3   9.1   ?     ?   134.1     -139.409     263.517    -139.409     142.754    -139.409     
1 1 1 17  9  12 o 0 38      9.1   ?     ?   90.7575   -169.025     17.4617    -169.025     64.6092    10.9753      
1 1 1 17  9  13 o 0 170     11    ?     ?   291.909   26.3599      257.531    26.3599      5.93416    -153.64      
1 1 1 17  9  14 o 0 316.7   14.2  ?     ?   355.284   68.4403      462.627    68.4403      103.722    68.4403      
1 1 1 17  9  15 o 0 108.8   14    ?     ?   243.251   21.4686      214.937    21.4686      25.0411    -158.531     
1 1 1 17  9  16 o 0 982.1   60.8  ?     ?   346.06    39.0434      1117.5     39.0434      783.991    39.0434      
1 1 1 17  9  17 o 0 35.9    19.3  ?     ?   135.228   98.05        77.3257    98.05        48.8626    -81.95       
1 1 1 17  9  18 o 0 5.8     17.1  ?     ?   154.683   130.993      33.2553    -49.007      177.063    -49.007      
1 1 1 17  9  19 o 0 98.4    19.6  ?     ?   285.219   42.1576      165.339    42.1576      100.038    -137.842     
1 1 1 17  9  20 o 0 246.1   24.6  ?     ?   286.732   25.3481      441.748    25.3481      154.556    25.3481      
1 1 1 17  9  21 o 0 149     27.2  ?     ?   218.344   39.9903      325.218    39.9903      106.812    39.9903      
1 1 1 17  9  22 o 0 133.6   27    ?     ?   220.65    28.827       299.242    28.827       92.3212    28.827       
1 1 1 17  9  23 f 1 14.4    30    ?     ?   106.463   10.8657      69.1352    10.8657      28.9615    -169.134     
1 1 1 -17 11 22 < 0 183.4   16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 11 21 o 0 6.6     14.9  ?     ?   20.4518   77.0173      11.1658    77.0173      6.42076    -102.983     
1 1 1 -17 11 20 o 0 75.9    12.5  ?     ?   244.444   -173.837     149.953    -173.837     65.3087    6.16277      
1 1 1 -17 11 19 o 0 37.9    10.1  ?     ?   142.401   136.114      105.609    136.114      23.7812    -43.8857     
1 1 1 -17 11 18 o 0 50.9    10.5  ?     ?   151.178   49.6106      139.597    49.6106      2.88474    -130.389     
1 1 1 -17 11 17 o 0 8.6     10.1  ?     ?   57.9664   76.0641      6.50845    -103.936     59.7674    -103.936     
1 1 1 -17 11 16 o 0 168.4   10.6  ?     ?   226.581   -95.0688     344.235    -95.0688     145.631    -95.0688     
1 1 1 -17 11 15 o 0 6.5     7.8   ?     ?   41.3258   -87.0497     13.1186    92.9503      49.6485    92.9503      
1 1 1 -17 11 14 o 0 8.1     6.6   ?     ?   84.6299   83.6842      28.2728    -96.3158     103.397    -96.3158     
1 1 1 -17 11 13 o 0 53.8    5.9   ?     ?   148.136   133.944      135.859    133.944      0.00977036 -46.0561     
1 1 1 -17 11 12 o 0 388.2   10    ?     ?   369.73    156.162      526.653    156.162      179.354    156.162      
1 1 1 -17 11 11 f 1 122.9   6     ?     ?   155.547   129.406      295.197    129.406      147.373    129.406      
1 1 1 -17 11 10 o 0 176.9   6.6   ?     ?   77.3127   -30.7054     347.845    -30.7054     272.997    -30.7054     
1 1 1 -17 11 9  o 0 64.3    5.7   ?     ?   267.272   -149.66      62.2548    -149.66      197.934    30.3396      
1 1 1 -17 11 8  o 0 241.2   7.8   ?     ?   376.677   -127.055     279.48     -127.055     46.9301    52.9451      
1 1 1 -17 11 7  o 0 579.7   14.8  ?     ?   483.516   37.7972      553.656    37.7972      132.756    37.7972      
1 1 1 -17 11 6  o 0 1547.9  29    ?     ?   900.678   9.27124      844.858    9.27125      57.6408    9.27125      
1 1 1 -17 11 5  o 0 128.7   4.9   ?     ?   214.344   89.3265      191.673    89.3265      5.29718    89.3265      
1 1 1 -17 11 4  o 0 381.2   9.7   ?     ?   481.052   155.001      364.892    155.001      54.6671    -24.9989     
1 1 1 -17 11 3  o 0 804.6   18.6  ?     ?   794.821   170.446      481.184    170.446      213.811    -9.55423     
1 1 1 -17 11 2  o 0 97.9    4.8   ?     ?   302.426   -178.573     85.9893    -178.573     179.003    1.42666      
1 1 1 -17 11 1  f 1 427.2   12    ?     ?   292.493   -111.404     553.597    -111.404     295.577    -111.404     
1 1 1 17  11 0  o 0 295.5   8.2   ?     ?   435.486   160.418      305.345    160.418      78.9889    -19.5819     
1 1 1 17  11 1  f 1 2656.3  56.1  ?     ?   1074.55   31.9143      1228.22    31.9143      274.595    31.9143      
1 1 1 17  11 2  o 0 1449.4  28.5  ?     ?   809.408   -12.951      887.766    -12.951      173.119    -12.951      
1 1 1 17  11 3  o 0 1112.2  22    ?     ?   638.316   26.3366      830.698    26.3366      267.349    26.3366      
1 1 1 17  11 4  o 0 57.2    5.8   ?     ?   228.869   47.9205      21.9419    47.9205      179.872    -132.08      
1 1 1 17  11 5  o 0 741     16.3  ?     ?   596.172   104.748      602.722    104.748      77.7298    104.748      
1 1 1 17  11 6  o 0 616.2   14.8  ?     ?   452.003   173.449      621.514    173.449      220.721    173.449      
1 1 1 17  11 7  o 0 113     7.7   ?     ?   278.925   -90.2859     147.04     -90.2859     99.7129    89.7141      
1 1 1 17  11 8  o 0 181.3   9.7   ?     ?   362.608   -61.5015     207.319    -61.5014     112.566    118.499      
1 1 1 17  11 9  o 0 161     9.1   ?     ?   129.963   7.59156      362.716    7.59156      233.693    7.59156      
1 1 1 17  11 10 o 0 99.8    10.2  ?     ?   161.537   76.7814      223.055    76.7814      63.2955    76.7814      
1 1 1 17  11 11 f 1 234.9   13    ?     ?   217.959   3.84843      461.838    3.84843      249.868    3.84843      
1 1 1 17  11 12 o 0 55.7    9.8   ?     ?   117.897   -9.74693     134.571    -9.74693     21.0483    -9.74693     
1 1 1 17  11 13 o 0 12.8    11.6  ?     ?   171.767   -61.0016     48.5416    118.998      210.312    118.998      
1 1 1 17  11 14 o 0 35.6    13.2  ?     ?   238.199   -68.1947     14.9253    -68.1947     202.562    111.805      
1 1 1 17  11 15 o 0 83.3    14.9  ?     ?   196.476   5.62485      198.212    5.62485      19.2714    5.62485      
1 1 1 17  11 16 o 0 8.7     15    ?     ?   68.0505   -46.5459     4.19132    -46.5459     57.908     133.454      
1 1 1 17  11 17 o 0 100.9   19.6  ?     ?   246.988   -71.9928     202.228    -71.9928     40.6787    108.007      
1 1 1 17  11 18 o 0 210.4   21    ?     ?   370.354   -19.5874     298.838    -19.5874     65.3236    160.413      
1 1 1 17  11 19 o 0 519.1   28.1  ?     ?   392.772   7.07703      675.885    7.07703      305.704    7.07703      
1 1 1 17  11 20 o 0 149.6   26.4  ?     ?   284.661   38.6812      270.449    38.6812      9.9944     38.6812      
1 1 1 17  11 21 o 0 60.7    29.5  ?     ?   96.369    53.6028      188.212    53.6028      101.773    53.6028      
1 1 1 -17 13 19 < 0 46.3    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 13 18 o 0 396.3   17.8  ?     ?   401.548   45.8567      509.497    45.8567      171.529    45.8567      
1 1 1 -17 13 17 o 0 121.7   12.6  ?     ?   256.952   29.2852      239.151    29.2852      17.9319    29.2852      
1 1 1 -17 13 16 o 0 42.5    13.1  ?     ?   75.6821   136.043      140.243    136.043      73.0927    136.043      
1 1 1 -17 13 15 o 0 41      10.4  ?     ?   68.5807   -19.5414     132.514    -19.5414     69.0007    -19.5414     
1 1 1 -17 13 14 o 0 258.7   12.5  ?     ?   407.578   20.825       328.093    20.825       49.6136    -159.175     
1 1 1 -17 13 13 o 0 284.1   10.9  ?     ?   406.03    2.53548      378.889    2.53548      12.6984    2.53548      
1 1 1 -17 13 12 o 0 183     9.9   ?     ?   357.65    -15.436      259.467    -15.436      50.4133    164.564      
1 1 1 -17 13 11 o 0 108.9   8     ?     ?   172.883   87.6196      265.054    87.6196      115.567    87.6196      
1 1 1 -17 13 10 o 0 35.8    5.9   ?     ?   158.111   20.5522      75.0283    20.5522      62.0195    -159.448     
1 1 1 -17 13 9  o 0 37.4    5.6   ?     ?   139.823   -29.5939     89.8533    -29.5939     32.037     150.406      
1 1 1 -17 13 8  o 0 11.6    5     ?     ?   197.226   163.159      77.6167    -16.8407     254.86     -16.8407     
1 1 1 -17 13 7  f 1 21.5    4.7   ?     ?   139.929   -31.455      12.2205    -31.455      114.776    148.545      
1 1 1 -17 13 6  o 0 4.8     4.5   ?     ?   129.343   20.4882      77.0193    -159.512     194.304    -159.512     
1 1 1 -17 13 5  o 0 263.3   8.8   ?     ?   426.294   152.359      313.429    152.359      81.1685    -27.6409     
1 1 1 -17 13 4  o 0 148.9   6.6   ?     ?   146.196   175.304      345.47     175.304      209.701    175.304      
1 1 1 -17 13 3  o 0 13.5    5     ?     ?   67.9999   -60.7801     17.6462    119.22       80.972     119.22       
1 1 1 -17 13 2  o 0 217.3   8.5   ?     ?   237.275   118.333      406.292    118.333      184.815    118.333      
1 1 1 -17 13 1  o 0 349.8   9.8   ?     ?   399.448   -170.36      452.971    -170.36      79.4305    -170.36      
1 1 1 17  13 0  o 0 291.1   9.1   ?     ?   459.177   -138.298     328.655    -138.298     104.768    41.7017      
1 1 1 17  13 1  o 0 229.2   8.3   ?     ?   416.694   -121.671     278.251    -121.671     115.103    58.3292      
1 1 1 17  13 2  o 0 130.2   7.4   ?     ?   272.25    -8.42751     229.957    -8.42751     26.9533    171.572      
1 1 1 17  13 3  o 0 205.4   8.4   ?     ?   226.464   -55.3603     399.699    -55.3603     186.163    -55.3603     
1 1 1 17  13 4  o 0 378     11.8  ?     ?   442.597   -108.057     451.553    -108.057     34.7394    -108.057     
1 1 1 17  13 5  o 0 26.2    6.3   ?     ?   62.1665   148.794      24.211     148.794      34.2349    -31.2058     
1 1 1 17  13 6  o 0 118.7   8.6   ?     ?   235.252   119.033      244.246    119.033      27.2381    119.033      
1 1 1 17  13 7  f 1 60.3    8.9   ?     ?   159.145   112.623      149.713    112.623      2.54492    112.623      
1 1 1 17  13 8  o 0 8.9     8.5   ?     ?   189.385   39.9668      74.2719    -140.033     243.641    -140.033     
1 1 1 17  13 9  o 0 26.8    10.5  ?     ?   249.375   43.1459      27.9801    -136.854     250.197    -136.854     
1 1 1 17  13 10 o 0 17.2    11.1  ?     ?   125.811   -125.171     2.60024    -125.171     109.473    54.8294      
1 1 1 17  13 11 o 0 -2.4    11.7  ?     ?   89.1106   -1.26762     37.3518    178.732      116.369    178.732      
1 1 1 17  13 12 o 0 -2.2    15.1  ?     ?   71.2991   -38.8633     15.2804    141.137      78.7359    141.137      
1 1 1 17  13 13 o 0 131.5   16.9  ?     ?   215.796   142.731      293.417    142.731      86.0859    142.731      
1 1 1 17  13 14 o 0 34.4    10.8  ?     ?   171.427   117.488      66.6427    117.488      97.0709    -62.5123     
1 1 1 17  13 15 o 0 115.9   22    ?     ?   318.662   -19.4813     160.333    -19.4813     144.29     160.519      
1 1 1 17  13 16 o 0 186.4   25.4  ?     ?   307.956   -57.5437     302.738    -57.5437     20.2353    -57.5437     
1 1 1 17  13 17 o 0 7.6     22.2  ?     ?   119.169   -56.5284     23.6479    -56.5284     82.5999    123.472      
1 1 1 17  13 18 o 0 49.3    21.4  ?     ?   118.925   17.6657      150.867    17.6657      46.8074    17.6657      
1 1 1 17  13 19 < 0 50.5    29.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 15 16 < 0 12.4    16.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 15 15 < 0 66.1    13.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 15 14 o 0 21.8    13.3  ?     ?   117.324   64.6631      58.7718    64.6631      37.8086    -115.337     
1 1 1 -17 15 13 o 0 43.8    10.5  ?     ?   159.171   6.42773      119.73     6.42773      12.0294    -173.572     
1 1 1 -17 15 12 o 0 25.8    10.2  ?     ?   118.04    172.383      66.2834    172.383      33.4486    -7.61664     
1 1 1 -17 15 11 o 0 17.5    9.6   ?     ?   131.511   33.7729      15.188     33.7729      99.0722    -146.227     
1 1 1 -17 15 10 o 0 341.4   12.6  ?     ?   387.227   48.7029      449.606    48.7029      111.023    48.7029      
1 1 1 -17 15 9  o 0 30.8    8.2   ?     ?   138.378   66.3728      75.8577    66.3728      50.0926    -113.627     
1 1 1 -17 15 8  o 0 76.1    8.4   ?     ?   180.33    -151.594     189.287    -151.594     24.2625    -151.594     
1 1 1 -17 15 7  o 0 73.1    8.3   ?     ?   138.077   -133.326     208.383    -133.326     82.3475    -133.326     
1 1 1 -17 15 6  o 0 230.7   10    ?     ?   310.796   -82.5236     370.335    -82.5236     85.3816    -82.5236     
1 1 1 -17 15 5  f 1 57.2    7.5   ?     ?   42.1147   -56.7262     131.275    -56.7262     93.6426    -56.7262     
1 1 1 -17 15 4  o 0 268.5   10.2  ?     ?   321.833   -175.537     405.444    -175.537     131.591    -175.537     
1 1 1 -17 15 3  o 0 82.6    8.1   ?     ?   153.432   110.295      216.025    110.295      85.0741    110.295      
1 1 1 -17 15 2  f 1 30.8    8     ?     ?   200.068   34.5494      31.9652    34.5494      140.103    -145.451     
1 1 1 -17 15 1  o 0 121.7   8.2   ?     ?   242.08    -21.8945     240.575    -21.8945     33.0077    -21.8945     
1 1 1 17  15 0  o 0 48.2    7.4   ?     ?   137.23    22.9089      133.487    22.9089      14.3015    22.9089      
1 1 1 17  15 1  o 0 228     10.8  ?     ?   348.815   -25.0985     335.628    -25.0984     32.7487    -25.0984     
1 1 1 17  15 2  f 1 34      8.5   ?     ?   68.0522   -142.458     87.238     -142.458     27.8834    -142.458     
1 1 1 17  15 3  o 0 24.7    9.2   ?     ?   39.084    -173.733     33.9085    -173.733     0.0317742  -173.733     
1 1 1 17  15 4  o 0 112     9.7   ?     ?   204.701   116.352      250.013    116.352      72.8612    116.352      
1 1 1 17  15 5  f 1 160.4   11.6  ?     ?   285.873   163.876      290.184    163.876      30.0019    163.876      
1 1 1 17  15 6  o 0 12.5    10.6  ?     ?   171.841   108.043      37.4055    -71.9569     198.117    -71.9569     
1 1 1 17  15 7  o 0 32.3    14.8  ?     ?   78.7807   -44.8862     83.9609    -44.8862     10.4991    -44.8862     
1 1 1 17  15 8  o 0 -5.8    16.3  ?     ?   78.5174   -150.832     12.001     29.1678      85.5153    29.1678      
1 1 1 17  15 9  o 0 -1.1    15.7  ?     ?   36.1439   133.004      0.360016   133.004      33.3496    -46.9963     
1 1 1 17  15 10 o 0 4.4     15.9  ?     ?   85.493    115.332      5.65825    115.332      71.0569    -64.6684     
1 1 1 17  15 11 o 0 3.4     18.2  ?     ?   66.2925   -41.5976     16.7933    -41.5976     41.1715    138.402      
1 1 1 17  15 12 o 0 49.2    22.9  ?     ?   155.094   -39.135      113.527    -39.135      21.3659    140.865      
1 1 1 17  15 13 o 0 39.6    21.9  ?     ?   123.862   -65.5338     107.877    -65.5338     2.16567    -65.5338     
1 1 1 17  15 14 o 0 32      22.5  ?     ?   83.1244   169.691      109.367    169.691      38.7074    169.691      
1 1 1 17  15 15 < 0 48.3    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 17 9  < 0 22.3    11.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 17 8  < 0 33.4    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -17 17 7  o 0 10.1    11.1  ?     ?   140.855   36.8799      0.0761478  -143.12      113.516    -143.12      
1 1 1 -17 17 6  o 0 18.3    9.3   ?     ?   24.9056   -80.7897     36.9359    -80.7897     16.7845    -80.7897     
1 1 1 -17 17 5  o 0 95      11    ?     ?   241.056   -120.028     194.376    -120.028     1.4793     59.9725      
1 1 1 -17 17 4  o 0 42.1    10.8  ?     ?   155.076   -147.957     114.646    -147.957     11.5339    32.0432      
1 1 1 -17 17 3  o 0 23.6    11.1  ?     ?   124.228   96.1813      57.0905    96.1813      44.3163    -83.8187     
1 1 1 -17 17 2  o 0 12.9    12.3  ?     ?   154.083   144.912      1.36529    -35.0879     127.49     -35.0879     
1 1 1 -17 17 1  o 0 56.1    11.4  ?     ?   159.165   95.0539      155.438    95.0539      24.8536    95.0539      
1 1 1 17  17 0  o 0 107.4   14.5  ?     ?   107.525   152.732      311.517    152.732      221.865    152.732      
1 1 1 17  17 1  o 0 50.3    12.3  ?     ?   191.057   108.731      116.861    108.731      42.3553    -71.269      
1 1 1 17  17 2  o 0 20.4    11.6  ?     ?   141.525   85.1272      34.5508    85.1272      83.2757    -94.8728     
1 1 1 17  17 3  o 0 44.3    13.3  ?     ?   148.23    178.222      125.18     178.222      1.94317    178.222      
1 1 1 17  17 4  o 0 91.3    15.2  ?     ?   140.971   -164.067     255.467    -164.067     138.482    -164.067     
1 1 1 17  17 5  o 0 129.3   17.6  ?     ?   143.547   -150.733     334.274    -150.733     215.158    -150.733     
1 1 1 17  17 6  o 0 30.4    14.8  ?     ?   108.187   15.7761      95.3745    15.7761      5.84794    15.7761      
1 1 1 17  17 7  o 0 27.5    17.9  ?     ?   127.349   98.0139      72.4985    98.0138      32.546     -81.9862     
1 1 1 17  17 8  < 0 72.4    19.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 17  17 9  < 0 19.5    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 0  28 < 0 -2.2    20.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 0  27 o 0 -5.9    21    ?     ?   21.4976   0            7.84996    0            12.0178    180          
1 1 1 -18 0  26 o 0 44.8    23.4  ?     ?   248.184   180          130.834    180          109.265    8.40177e-15  
1 1 1 -18 0  25 o 0 41.7    21.2  ?     ?   197.448   180          127.84     180          72.0472    1.24504e-14  
1 1 1 -18 0  24 o 0 25.3    17.7  ?     ?   86.2513   180          52.6475    180          28.0526    1.31685e-14  
1 1 1 -18 0  23 o 0 10.6    15.6  ?     ?   113.204   0            32.1193    0            73.9697    180          
1 1 1 -18 0  22 o 0 16.3    15.9  ?     ?   27.1904   180          9.95619    180          16.3374    4.27606e-15  
1 1 1 -18 0  21 f 1 51.7    12.7  ?     ?   135.13    0            136.813    0            1.9614     0            
1 1 1 -18 0  20 o 0 74.7    21    ?     ?   245.749   0            192.634    0            57.9492    180          
1 1 1 -18 0  19 o 0 710.1   32.7  ?     ?   459.086   0            580.927    0            162.745    0            
1 1 1 -18 0  18 o 0 -1.6    7.4   ?     ?   137.092   0            3.68712    0            121.121    180          
1 1 1 -18 0  17 o 0 58.4    8.7   ?     ?   90.4137   0            62.5643    0            20.3837    180          
1 1 1 -18 0  16 o 0 662     21.8  ?     ?   643.092   0            574.902    0            32.0043    180          
1 1 1 -18 0  15 o 0 232.1   10.2  ?     ?   390.059   0            331.919    0            33.3061    180          
1 1 1 -18 0  14 o 0 1405    36.2  ?     ?   899.674   180          826.334    180          21.3105    2.72079e-13  
1 1 1 -18 0  13 o 0 390.3   11.8  ?     ?   896.731   180          438.049    180          422.853    7.26887e-15  
1 1 1 -18 0  12 o 0 38      7.1   ?     ?   240.232   180          87.566     180          144.257    4.25925e-15  
1 1 1 -18 0  11 o 0 653.5   25.6  ?     ?   464.329   0            602.359    0            134.099    0            
1 1 1 -18 0  10 o 0 648.5   17.3  ?     ?   429.102   0            602.708    0            168.24     0            
1 1 1 -18 0  9  o 0 135.9   5     ?     ?   298.811   0            264.58     0            38.9986    180          
1 1 1 -18 0  8  o 0 3832.4  92    ?     ?   1111.79   180          1507.03    180          348.335    180          
1 1 1 -18 0  7  o 0 26.2    2.3   ?     ?   99.6695   0            32.8778    0            70.3253    180          
1 1 1 -18 0  6  o 0 309.9   8.8   ?     ?   418.43    0            430.149    0            3.81868    180          
1 1 1 -18 0  5  o 0 114.7   3.7   ?     ?   520.423   180          240.886    180          258.243    6.54509e-15  
1 1 1 -18 0  4  o 0 643.2   23.1  ?     ?   501.105   180          573.739    180          92.7646    180          
1 1 1 -18 0  3  o 0 1025.5  25.5  ?     ?   404.099   180          725.157    180          337.045    180          
1 1 1 -18 0  2  o 0 270.6   7.9   ?     ?   150.918   0            322.968    0            177.913    0            
1 1 1 -18 0  1  o 0 3707.4  88.9  ?     ?   1266.52   0            1326.63    0            155.645    0            
1 1 1 18  0  0  o 0 93      3.3   ?     ?   187.256   -6.58741e-14 156.588    0            16.8242    180          
1 1 1 18  0  1  o 0 4850.8  117.7 ?     ?   1511.96   180          1584.68    180          124.46     180          
1 1 1 18  0  2  o 0 110.8   4     ?     ?   261.239   0            215.633    0            37.2541    180          
1 1 1 18  0  3  o 0 361.5   10.7  ?     ?   246.505   0            428.983    0            189.819    0            
1 1 1 18  0  4  o 0 1692.8  43.5  ?     ?   929.902   0            942.757    0            38.8305    0            
1 1 1 18  0  5  o 0 1281.6  33.6  ?     ?   592.685   0            821.433    0            244.546    0            
1 1 1 18  0  6  o 0 321.1   10.6  ?     ?   456.61    0            445.277    0            36.1681    180          
1 1 1 18  0  7  o 0 105.6   5     ?     ?   428.722   0            250.591    0            201.385    180          
1 1 1 18  0  8  o 0 767     31.5  ?     ?   660.549   0            687.307    0            14.5177    180          
1 1 1 18  0  9  o 0 674.5   26    ?     ?   786.326   0            629.224    0            186.181    180          
1 1 1 18  0  10 o 0 3023.5  72.5  ?     ?   863.48    180          1329.46    180          436.07     180          
1 1 1 18  0  11 o 0 116.1   8.7   ?     ?   300.389   180          244.386    180          65.5108    2.61756e-14  
1 1 1 18  0  12 o 0 537.2   19    ?     ?   503.698   0            528.916    0            31.1259    0            
1 1 1 18  0  13 o 0 46.1    11.5  ?     ?   746.118   180          148.508    180          585.894    1.77855e-15  
1 1 1 18  0  14 o 0 1035.5  34.5  ?     ?   801.976   180          727.978    180          47.587     1.0734e-13   
1 1 1 18  0  15 o 0 -4.1    14.8  ?     ?   7.08243   180          0.339783   180          6.65879    3.58047e-16  
1 1 1 18  0  16 o 0 26.8    18.4  ?     ?   75.5858   0            15.6981    0            57.6927    180          
1 1 1 18  0  17 o 0 38.9    16.6  ?     ?   249.335   180          84.0368    180          151.6      3.88958e-15  
1 1 1 18  0  18 o 0 126     19.3  ?     ?   298.122   0            247.855    0            34.5354    180          
1 1 1 18  0  19 o 0 156.3   22.6  ?     ?   296.159   180          276.001    180          2.61458    7.40702e-13  
1 1 1 18  0  20 o 0 -17.4   26.8  ?     ?   97.3598   180          13.3975    180          89.2708    1.05305e-15  
1 1 1 18  0  21 f 1 -65.6   30.5  ?     ?   110.052   0            13.7259    0            98.1113    180          
1 1 1 18  0  22 o 0 198.4   35.8  ?     ?   305.826   180          340.356    180          41.2774    180          
1 1 1 18  0  23 o 0 17.2    32.6  ?     ?   15.6617   180          8.81529    180          6.42935    9.62062e-15  
1 1 1 18  0  24 o 0 240     36.3  ?     ?   354.392   180          386.405    180          24.7847    180          
1 1 1 18  0  25 o 0 16.4    38.3  ?     ?   209.465   180          92.4337    180          128.5      5.04731e-15  
1 1 1 18  0  26 o 0 38.4    35.6  ?     ?   131.272   180          104.434    180          25.3334    2.89255e-14  
1 1 1 -18 2  28 < 0 75.8    14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 2  27 f 1 28.2    14.2  ?     ?   97.7017   88.1721      94.5392    88.1721      4.54435    88.1721      
1 1 1 -18 2  26 o 0 7.9     16.7  ?     ?   50.5336   -32.3276     21.7299    -32.3276     25.7519    147.672      
1 1 1 -18 2  25 o 0 155     14.4  ?     ?   223.189   -39.304      348.321    -39.3041     124.121    -39.3041     
1 1 1 -18 2  24 o 0 135.8   10.9  ?     ?   185.502   139.443      348.348    139.443      167.727    139.443      
1 1 1 -18 2  23 o 0 23.5    8.2   ?     ?   201.651   116.262      6.68525    -63.7376     194.336    -63.7376     
1 1 1 -18 2  22 o 0 52.6    9.4   ?     ?   161.9     126.697      139.811    126.697      11.835     -53.3034     
1 1 1 -18 2  21 o 0 93.6    9.1   ?     ?   209.368   -98.8568     218.04     -98.8568     14.9311    -98.8568     
1 1 1 -18 2  20 o 0 59.4    6.9   ?     ?   199.678   22.4121      96.4701    22.4121      105.933    -157.588     
1 1 1 -18 2  19 o 0 53.9    7.3   ?     ?   296.36    69.389       7.45126    -110.611     275.917    -110.611     
1 1 1 -18 2  18 o 0 314.1   9.5   ?     ?   290.394   -164.258     456.929    -164.258     191.605    -164.258     
1 1 1 -18 2  17 o 0 276.1   9     ?     ?   499.319   -164.725     238.243    -164.725     217.697    15.2746      
1 1 1 -18 2  16 o 0 331.8   9.1   ?     ?   389.225   36.3267      386.041    36.3267      20.2767    36.3267      
1 1 1 -18 2  15 o 0 318.1   8.5   ?     ?   473.867   -10.905      297.048    -10.905      156.9      169.095      
1 1 1 -18 2  14 o 0 24.7    4     ?     ?   224.2     -148.508     104.39     31.4922      314.93     31.4922      
1 1 1 -18 2  13 o 0 2327.6  58.2  ?     ?   1090.63   30.6179      1069.26    30.6179      25.0933    30.6179      
1 1 1 -18 2  12 o 0 102.6   5.3   ?     ?   205.732   -150.504     129.718    -150.504     68.3774    29.4962      
1 1 1 -18 2  11 o 0 3568.5  64.6  ?     ?   1272.93   -25.3298     1512.73    -25.3298     231.059    -25.3298     
1 1 1 -18 2  10 o 0 300.1   7.2   ?     ?   416.731   -20.0788     343.893    -20.0788     77.6547    159.921      
1 1 1 -18 2  9  o 0 291     6     ?     ?   364.135   -36.9902     377.885    -36.9902     8.02756    -36.9902     
1 1 1 -18 2  7  o 0 261.9   5.5   ?     ?   410.883   -176.298     307.111    -176.298     118.896    3.70183      
1 1 1 -18 2  6  o 0 183     5.2   ?     ?   312.243   -174.753     259.06     -174.753     65.4642    5.24669      
1 1 1 -18 2  5  f 1 439.4   11.5  ?     ?   442.918   25.1726      512.52     25.1726      48.9251    25.1726      
1 1 1 -18 2  4  o 0 466.1   8.8   ?     ?   582.867   -19.9298     382.087    -19.9298     179.386    160.07       
1 1 1 -18 2  3  o 0 175.4   4.3   ?     ?   223.248   77.3161      278.682    77.3161      63.3825    77.3161      
1 1 1 -18 2  2  o 0 513.9   10.2  ?     ?   411.1     59.7121      581.753    59.7121      184.917    59.7121      
1 1 1 -18 2  1  o 0 457.9   8.8   ?     ?   332.416   7.39606      587.027    7.39606      265.86     7.39606      
1 1 1 18  2  0  o 0 1318.5  23.7  ?     ?   797.707   72.658       851.681    72.658       85.4965    72.658       
1 1 1 18  2  1  o 0 704.1   13.5  ?     ?   511.374   119.885      670.156    119.885      177.758    119.885      
1 1 1 18  2  2  o 0 766.6   14.4  ?     ?   487.403   -55.0217     745.425    -55.0217     274.877    -55.0217     
1 1 1 18  2  3  o 0 937.9   17.5  ?     ?   632.702   -102.54      751.176    -102.54      138.855    -102.54      
1 1 1 18  2  4  o 0 909.8   16.7  ?     ?   770.425   77.6533      604.217    77.6533      142.886    -102.347     
1 1 1 18  2  5  f 1 359.7   7.8   ?     ?   484.444   134.872      379.269    134.872      132.628    -45.1276     
1 1 1 18  2  6  o 0 1728.9  30.3  ?     ?   932.6     -157.839     1056.22    -157.839     75.2139    -157.839     
1 1 1 18  2  7  o 0 199.3   5.3   ?     ?   284.786   129.758      312.039    129.758      12.5231    129.758      
1 1 1 18  2  8  o 0 2149.5  38.7  ?     ?   1073.87   119.299      1112       119.299      0.616098   -60.7008     
1 1 1 18  2  9  o 0 1337.9  24.6  ?     ?   820.262   115.344      893.244    115.344      44.8198    115.344      
1 1 1 18  2  10 o 0 1838.8  34.7  ?     ?   947.928   29.8788      1067.1     29.8788      88.9642    29.8788      
1 1 1 18  2  11 o 0 237.2   8.1   ?     ?   433.313   -77.2432     234.85     -77.2432     216.294    102.757      
1 1 1 18  2  12 o 0 839.1   18.5  ?     ?   626.74    -68.4618     666.204    -68.4618     48.6734    -68.4618     
1 1 1 18  2  13 o 0 1482.4  30.7  ?     ?   912.04    -31.3939     826.467    -31.3939     68.3886    148.606      
1 1 1 18  2  14 o 0 382.3   16.3  ?     ?   396.422   -163.413     440.926    -163.413     58.8598    -163.413     
1 1 1 18  2  15 o 0 523     16.9  ?     ?   356.16    174.245      640.796    174.245      294.317    174.245      
1 1 1 18  2  16 o 0 655.1   19.7  ?     ?   562.55    96.8543      587.13     96.8543      43.0082    96.8543      
1 1 1 18  2  17 o 0 16.5    14    ?     ?   55.4838   54.9615      27.3948    -125.039     79.6175    -125.039     
1 1 1 18  2  18 o 0 141.1   15.6  ?     ?   149.378   -118.921     272.493    -118.921     131.605    -118.921     
1 1 1 18  2  19 o 0 361.4   17.1  ?     ?   324.289   87.7232      574.287    87.7232      231.387    87.7232      
1 1 1 18  2  20 o 0 200.6   17.3  ?     ?   419.287   113.181      250.049    113.181      182.298    -66.8193     
1 1 1 18  2  21 o 0 172     17.1  ?     ?   166.612   -46.2889     426.932    -46.2889     259.333    -46.2889     
1 1 1 18  2  22 o 0 69.6    17.5  ?     ?   264.744   -53.8051     115.787    -53.8051     141.743    126.195      
1 1 1 18  2  23 o 0 298.1   29.5  ?     ?   377.465   -63.2499     448.284    -63.2499     82.9149    -63.2499     
1 1 1 18  2  24 o 0 6.5     26.1  ?     ?   65.4096   -68.2045     35.5414    -68.2045     33.1633    111.795      
1 1 1 18  2  25 o 0 79.7    33.5  ?     ?   167.197   -19.3887     191.104    -19.3887     15.829     -19.3887     
1 1 1 18  2  26 o 0 30.1    37.7  ?     ?   122.61    88.8367      102.223    88.8367      18.2079    -91.1633     
1 1 1 -18 4  27 o 0 48.7    17.8  ?     ?   106.02    47.1898      169.216    47.1898      73.4419    47.1898      
1 1 1 -18 4  26 f 1 70.2    14.4  ?     ?   183.184   -158.246     192.966    -158.246     24.9664    -158.246     
1 1 1 -18 4  25 o 0 383.6   17.4  ?     ?   333.091   -157.76      592.386    -157.76      274.151    -157.76      
1 1 1 -18 4  24 o 0 76.1    11.6  ?     ?   136.387   150.847      234.146    150.847      98.766     150.847      
1 1 1 -18 4  23 o 0 64.7    9.9   ?     ?   65.5802   96.3282      192.892    96.3282      132.259    96.3282      
1 1 1 -18 4  22 o 0 0.8     8.4   ?     ?   27.8684   13.5329      13.618     -166.467     39.4335    -166.467     
1 1 1 -18 4  21 o 0 69.1    8.5   ?     ?   176.706   -2.66605     172.305    -2.66605     3.34743    -2.66605     
1 1 1 -18 4  20 o 0 165     8.7   ?     ?   312.595   103.897      273.344    103.897      33.6196    -76.1035     
1 1 1 -18 4  19 o 0 622     14.8  ?     ?   324.492   81.4462      834.754    81.4462      507.386    81.4462      
1 1 1 -18 4  18 o 0 154.8   7.6   ?     ?   289.758   -24.6378     221.679    -24.6378     39.5534    155.362      
1 1 1 -18 4  17 o 0 371     10.6  ?     ?   549.781   -97.5784     308.749    -97.5784     186.81     82.4216      
1 1 1 -18 4  16 o 0 744.7   16.1  ?     ?   576.447   -153.635     641.951    -153.635     118.14     -153.635     
1 1 1 -18 4  15 f 1 78.3    5.7   ?     ?   132.162   165.973      74.737     165.973      49.4868    -14.0269     
1 1 1 -18 4  14 o 0 619.6   15.4  ?     ?   664.527   -155.909     443.137    -155.91      190.332    24.0905      
1 1 1 -18 4  13 o 0 290.8   7.5   ?     ?   571.554   -48.5331     172.625    -48.5331     361.469    131.467      
1 1 1 -18 4  12 o 0 2521.8  44    ?     ?   1133.77   45.7434      1111.26    45.7434      31.1091    45.7434      
1 1 1 -18 4  11 o 0 622.5   12.1  ?     ?   671.15    78.1917      429.777    78.1917      213.313    -101.808     
1 1 1 -18 4  10 o 0 2493.2  43.3  ?     ?   1080.94   -126.757     1160.98    -126.757     119.783    -126.757     
1 1 1 -18 4  9  o 0 323.9   7.1   ?     ?   377.263   -58.0344     407.951    -58.0344     28.1302    -58.0344     
1 1 1 -18 4  8  o 0 746.7   14    ?     ?   526.055   -95.5914     718.098    -95.5914     186.234    -95.5914     
1 1 1 -18 4  7  o 0 825     15.3  ?     ?   673.577   131.589      646.679    131.589      36.8606    -48.4106     
1 1 1 -18 4  6  f 1 111.5   5.2   ?     ?   232.927   176.127      155.902    176.127      82.4414    -3.87348     
1 1 1 -18 4  5  o 0 247.1   5.1   ?     ?   314.54    100.934      363.618    100.934      35.1817    100.934      
1 1 1 -18 4  3  o 0 582.7   12.3  ?     ?   464.999   25.2263      649.17     25.2263      165.952    25.2263      
1 1 1 -18 4  2  o 0 101.2   3     ?     ?   320.896   -162.557     79.5539    -162.557     254.348    17.4426      
1 1 1 -18 4  1  o 0 680.6   17.3  ?     ?   439.325   73.5392      769.966    73.5392      312.404    73.5392      
1 1 1 18  4  0  o 0 226.7   5.3   ?     ?   498.939   45.32        170.822    45.32        345.143    -134.68      
1 1 1 18  4  1  o 0 148.4   3.6   ?     ?   167.354   104.891      257.25     104.891      83.8154    104.891      
1 1 1 18  4  2  o 0 214.2   4.7   ?     ?   399.389   -57.0582     241.601    -57.0582     173.13     122.942      
1 1 1 18  4  3  o 0 214.9   5.3   ?     ?   351.254   -48.4344     284.327    -48.4344     81.0393    131.566      
1 1 1 18  4  4  o 0 384     8     ?     ?   308.299   -74.6499     563.03     -74.6499     241.943    -74.6499     
1 1 1 18  4  5  o 0 4.9     2.8   ?     ?   75.925    135.49       70.1791    -44.5102     149.996    -44.5102     
1 1 1 18  4  6  f 1 2113.2  37.4  ?     ?   1112.7    74.1699      1039.23    74.1699      110.163    -105.83      
1 1 1 18  4  7  o 0 245     5.9   ?     ?   297.117   90.9865      367.571    90.9865      62.4265    90.9865      
1 1 1 18  4  8  o 0 274.8   8.5   ?     ?   344.567   77.4384      374.589    77.4384      21.1877    77.4384      
1 1 1 18  4  9  o 0 1022.7  22.6  ?     ?   627.724   -103.41      852.591    -103.41      210.075    -103.41      
1 1 1 18  4  10 o 0 256.9   8.1   ?     ?   341.698   -147.786     325.047    -147.786     10.2659    32.2136      
1 1 1 18  4  11 o 0 1128.8  23.4  ?     ?   692.469   -172.013     809.601    -172.013     132.307    -172.013     
1 1 1 18  4  12 o 0 1137.1  24.2  ?     ?   807.152   151.975      713.523    151.975      62.6378    -28.025      
1 1 1 18  4  13 o 0 376.9   13.5  ?     ?   557.591   93.9538      294.989    93.9538      238.814    -86.0462     
1 1 1 18  4  14 o 0 1012.3  26.3  ?     ?   419.057   42.1771      996.107    42.1771      591.052    42.1771      
1 1 1 18  4  15 f 1 952.2   22.1  ?     ?   614.614   29.7883      773.986    29.7883      180.122    29.7883      
1 1 1 18  4  16 o 0 454.8   15.9  ?     ?   555.803   35.1149      408.65     35.1149      111.393    -144.885     
1 1 1 18  4  17 o 0 703.3   20.8  ?     ?   491.516   -15.054      698.909    -15.054      237.971    -15.054      
1 1 1 18  4  18 o 0 47.1    12.9  ?     ?   159.681   -171.363     65.368     -171.363     83.8222    8.6367       
1 1 1 18  4  19 o 0 207.1   15.9  ?     ?   170.231   -170.401     454.741    -170.401     277.038    -170.401     
1 1 1 18  4  20 o 0 13.7    18.1  ?     ?   92.1208   -56.0037     8.91893    123.996      102.674    123.996      
1 1 1 18  4  21 o 0 78.7    16.1  ?     ?   174.248   -90.0221     214.193    -90.0221     45.5423    -90.0221     
1 1 1 18  4  22 o 0 -3.3    24.8  ?     ?   101.42    58.1719      1.83026    -121.828     99.5219    -121.828     
1 1 1 18  4  23 o 0 22.4    19.8  ?     ?   114.122   69.5898      44.7569    69.5898      65.1437    -110.41      
1 1 1 18  4  24 o 0 73      26.2  ?     ?   214.871   33.477       145.911    33.477       78.291     -146.523     
1 1 1 18  4  25 o 0 72.7    26.4  ?     ?   206.001   79.4807      156.331    79.4807      49.3714    -100.519     
1 1 1 18  4  26 f 1 25.1    26.8  ?     ?   196.959   87.2079      24.3449    87.2079      164.781    -92.7921     
1 1 1 -18 6  26 o 0 143.3   14.8  ?     ?   227.103   91.973       323.755    91.973       121.112    91.973       
1 1 1 -18 6  25 o 0 7.2     13.3  ?     ?   27.7661   -88.5158     8.41316    -88.5158     16.9397    91.4842      
1 1 1 -18 6  24 o 0 46.4    12.3  ?     ?   133.983   -133.066     146.644    -133.066     20.222     -133.066     
1 1 1 -18 6  23 o 0 100.2   12.5  ?     ?   149.15    101.413      284.256    101.413      138.052    101.413      
1 1 1 -18 6  22 o 0 19.1    8.7   ?     ?   84.3758   12.6222      27.2511    12.6222      49.7803    -167.378     
1 1 1 -18 6  21 f 1 3.3     10    ?     ?   43.3573   104.204      15.163     -75.7958     55.0225    -75.7958     
1 1 1 -18 6  20 o 0 8.5     9.4   ?     ?   58.6325   106.136      12.9322    -73.8639     66.9014    -73.8639     
1 1 1 -18 6  19 f 1 11.6    7.7   ?     ?   70.8183   123.58       16.4659    -56.4204     84.3153    -56.4204     
1 1 1 -18 6  18 o 0 46.8    7.2   ?     ?   137.844   144.807      103.94     144.807      30.9278    -35.193      
1 1 1 -18 6  17 o 0 145     7.6   ?     ?   117.766   130.584      333.748    130.584      215.435    130.584      
1 1 1 -18 6  16 o 0 1068.6  20.9  ?     ?   843.618   102.952      631.554    102.952      125.416    -77.0481     
1 1 1 -18 6  15 o 0 434.6   12.1  ?     ?   550.784   151.245      375.159    151.245      118.681    -28.7547     
1 1 1 -18 6  14 o 0 1622.4  30.2  ?     ?   860.612   149.636      940.534    149.636      146.54     149.636      
1 1 1 -18 6  13 f 1 561.5   12.2  ?     ?   780.404   158.119      285.977    158.119      442.839    -21.8811     
1 1 1 -18 6  12 o 0 317.9   9.9   ?     ?   309.462   -172.413     421.506    -172.413     128.576    -172.413     
1 1 1 -18 6  11 o 0 334.4   7.9   ?     ?   399.307   -16.2022     367.155    -16.2022     3.14057    163.798      
1 1 1 -18 6  10 o 0 34.4    3.3   ?     ?   197.805   -148.894     56.2126    31.1057      240.679    31.1057      
1 1 1 -18 6  9  f 1 314.1   6.8   ?     ?   353.479   50.8583      379.054    50.8583      41.6228    50.8583      
1 1 1 -18 6  8  o 0 121.9   3.6   ?     ?   387.9     -24.6404     58.6069    -24.6404     311.49     155.36       
1 1 1 -18 6  7  o 0 484.4   9.5   ?     ?   433.213   -18.8237     509.424    -18.8237     94.3983    -18.8237     
1 1 1 -18 6  6  o 0 511.4   12.7  ?     ?   420.793   155.696      584.385    155.696      163.522    155.696      
1 1 1 -18 6  5  o 0 258.6   5.4   ?     ?   243.123   8.90584      414.55     8.90584      170.644    8.90584      
1 1 1 -18 6  4  o 0 143.8   3.4   ?     ?   55.3262   -142.292     135.864    -142.292     80.2182    -142.292     
1 1 1 -18 6  3  o 0 1303.7  23.4  ?     ?   758.049   125.946      908.719    125.946      144.746    125.946      
1 1 1 -18 6  2  o 0 804.2   20.5  ?     ?   627.753   66.6378      669.69     66.6378      36.0509    66.6378      
1 1 1 -18 6  1  o 0 4398.3  105.4 ?     ?   1623.13   4.0756       1475.86    4.0756       164.279    -175.924     
1 1 1 18  6  0  o 0 2045.4  46    ?     ?   1174.83   43.5123      926.346    43.5123      255.733    -136.488     
1 1 1 18  6  1  o 0 132.3   4     ?     ?   84.6552   147.209      168.016    147.209      82.7032    147.209      
1 1 1 18  6  2  o 0 864.7   18.9  ?     ?   750.256   -44.6927     601.173    -44.6927     155.888    135.307      
1 1 1 18  6  3  o 0 738.3   16.5  ?     ?   653.599   -7.11324     589.473    -7.11324     70.657     172.887      
1 1 1 18  6  4  o 0 287.1   7.2   ?     ?   402.712   -92.2844     337.736    -92.2844     69.1903    87.7156      
1 1 1 18  6  5  o 0 247.4   6.2   ?     ?   571.579   137.679      126.655    137.679      450.876    -42.3209     
1 1 1 18  6  6  o 0 1306.9  30.9  ?     ?   1061.33   62.9586      614.435    62.9586      457.3      -117.041     
1 1 1 18  6  7  o 0 264.7   8.1   ?     ?   523.916   -13.1788     179.04     -13.1788     328.919    166.821      
1 1 1 18  6  8  o 0 150.4   6.6   ?     ?   359.475   158.494      137.128    158.494      210.772    -21.5056     
1 1 1 18  6  9  f 1 54.7    5.7   ?     ?   374.964   -100.087     98.2774    79.9132      462.159    79.9132      
1 1 1 18  6  10 o 0 2576.3  46.2  ?     ?   888.548   -140.257     1387.45    -140.257     543.282    -140.257     
1 1 1 18  6  11 o 0 1890.2  34.4  ?     ?   971.324   -108.644     983.846    -108.644     64.3232    -108.644     
1 1 1 18  6  12 o 0 946.7   21.1  ?     ?   575.02    3.22264      804.486    3.22264      254.409    3.22264      
1 1 1 18  6  13 f 1 133.9   9.9   ?     ?   323.368   -26.5636     136.462    -26.5636     173.02     153.436      
1 1 1 18  6  14 o 0 153.6   10.7  ?     ?   568.072   -5.82037     6.84955    174.18       533.734    174.18       
1 1 1 18  6  15 o 0 174.2   11.4  ?     ?   177.391   29.3727      296.836    29.3727      133.242    29.3727      
1 1 1 18  6  16 o 0 29.3    12.6  ?     ?   148.345   -49.529      23.0485    130.471      160.202    130.471      
1 1 1 18  6  17 o 0 62.3    14.4  ?     ?   146.334   -36.5367     128.765    -36.5367     22.9826    143.463      
1 1 1 18  6  18 o 0 28.7    15    ?     ?   255.809   -156.921     50.4062    23.0789      309.2      23.0789      
1 1 1 18  6  19 f 1 196.8   17.9  ?     ?   258.678   128.558      391.383    128.558      134.682    128.558      
1 1 1 18  6  20 o 0 9.1     17.5  ?     ?   164.953   135.252      30.3507    -44.7476     187.888    -44.7476     
1 1 1 18  6  21 f 1 114.3   21    ?     ?   265.861   -58.5463     221.931    -58.5463     32.1031    121.454      
1 1 1 18  6  22 o 0 2.3     21.2  ?     ?   46.5441   -92.1587     7.90172    -92.1587     36.3405    87.8413      
1 1 1 18  6  23 o 0 90.5    25.5  ?     ?   184.492   -169.667     230.421    -169.667     40.3817    -169.667     
1 1 1 18  6  24 o 0 -14.5   28.5  ?     ?   60.9639   10.904       20.0159    10.904       40.0871    -169.096     
1 1 1 18  6  25 o 0 32.9    32.9  ?     ?   102.999   -9.60664     112.44     -9.60664     15.2822    -9.60664     
1 1 1 18  6  26 < 0 13.3    31.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 8  25 < 0 62.6    12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 8  24 o 0 56      13.2  ?     ?   195.62    -57.9387     137.553    -57.9387     35.1413    122.061      
1 1 1 -18 8  23 o 0 100.3   11.4  ?     ?   262.653   -58.0331     200.448    -58.0331     37.2368    121.967      
1 1 1 -18 8  22 f 1 31.4    11.2  ?     ?   149.082   -83.3328     67.7999    -83.3328     77.1355    96.6672      
1 1 1 -18 8  21 f 1 109.9   12.8  ?     ?   186.986   -23.6906     274.825    -23.6906     92.432     -23.6906     
1 1 1 -18 8  20 o 0 36      10.3  ?     ?   258.724   -2.34344     9.04066    -2.34344     224.67     177.657      
1 1 1 -18 8  19 o 0 110.3   9.6   ?     ?   175.633   -24.6674     277.007    -24.6674     118.753    -24.6674     
1 1 1 -18 8  18 o 0 17.2    7.7   ?     ?   83.6406   -60.4756     2.26026    -60.4756     75.7688    119.524      
1 1 1 -18 8  17 o 0 257.6   9.3   ?     ?   370.322   -62.2229     365.851    -62.2229     11.2949    -62.2229     
1 1 1 -18 8  16 o 0 365.1   10.5  ?     ?   388.787   -122.547     496.362    -122.547     120.893    -122.547     
1 1 1 -18 8  15 f 1 114.1   6.7   ?     ?   204.869   -92.2868     235.278    -92.2868     31.2081    -92.2868     
1 1 1 -18 8  14 o 0 23.1    5.4   ?     ?   206.761   -31.9122     65.0064    148.088      247.889    148.088      
1 1 1 -18 8  13 o 0 487.9   15.8  ?     ?   525.657   23.1285      442.757    23.1285      21.5226    -156.871     
1 1 1 -18 8  12 o 0 12.6    5     ?     ?   202.222   -57.6743     124.192    122.326      304.02     122.326      
1 1 1 -18 8  11 o 0 706.4   14.1  ?     ?   564.967   10.5177      595.683    10.5177      79.3351    10.5177      
1 1 1 -18 8  10 o 0 1270.2  23.4  ?     ?   781.383   57.7276      805.695    57.7276      87.379     57.7276      
1 1 1 -18 8  9  o 0 529.1   12    ?     ?   414.758   55.673       569.904    55.673       186.583    55.673       
1 1 1 -18 8  8  o 0 305     7.2   ?     ?   431.129   -35.1114     302.179    -35.1114     92.3995    144.889      
1 1 1 -18 8  7  f 1 229     5.7   ?     ?   327.875   -117.827     278.8      -117.827     24.1255    62.1733      
1 1 1 -18 8  6  o 0 567.5   12.1  ?     ?   687.603   54.7035      362.693    54.7035      271.744    -125.297     
1 1 1 -18 8  5  o 0 395.7   8.4   ?     ?   455.777   -127.182     388.166    -127.182     39.3215    52.8178      
1 1 1 -18 8  4  o 0 672.1   13.5  ?     ?   618.184   -1.96693     511.312    -1.96693     70.1116    178.033      
1 1 1 -18 8  3  o 0 2563.3  45.7  ?     ?   964.947   -27.3722     1273.41    -27.3722     363.782    -27.3722     
1 1 1 -18 8  2  o 0 466.5   12.3  ?     ?   599.19    -48.9294     341.316    -48.9294     224.529    131.071      
1 1 1 -18 8  1  o 0 227.4   6.9   ?     ?   325.912   -4.47395     283.069    -4.47395     25.1084    175.526      
1 1 1 18  8  0  o 0 902.2   19.2  ?     ?   826.645   -105.066     505.149    -105.066     276.364    74.9338      
1 1 1 18  8  1  o 0 727.6   14.7  ?     ?   736.444   95.0489      454.034    95.0489      242.954    -84.9511     
1 1 1 18  8  2  o 0 642.7   12.9  ?     ?   476.292   76.0195      613.78     76.0195      162.685    76.0195      
1 1 1 18  8  3  o 0 419.5   9     ?     ?   329.636   37.5169      518.66     37.5169      206.369    37.5169      
1 1 1 18  8  4  o 0 937.9   19.8  ?     ?   610.804   -71.7306     727.22     -71.7306     148.64     -71.7306     
1 1 1 18  8  5  o 0 158.7   6.3   ?     ?   542.987   173.472      1.73177    173.472      505.59     -6.52778     
1 1 1 18  8  6  o 0 1414    26.8  ?     ?   1097.47   145.56       598.424    145.56       425.787    -34.4402     
1 1 1 18  8  7  f 1 376.1   9.8   ?     ?   458.934   87.7002      367.383    87.7002      62.3999    -92.2998     
1 1 1 18  8  8  o 0 112.2   6.8   ?     ?   216.6     -154.599     140.232    -154.599     61.1251    25.4009      
1 1 1 18  8  9  o 0 15.5    6.5   ?     ?   186.16    -160.691     116.865    19.3094      291.984    19.3094      
1 1 1 18  8  10 o 0 1.7     6.8   ?     ?   45.4611   104.847      37.3594    -75.1526     79.983     -75.1526     
1 1 1 18  8  11 o 0 180.5   11.3  ?     ?   184.943   -13.1674     304.539    -13.1674     135.404    -13.1674     
1 1 1 18  8  12 o 0 59.6    10.4  ?     ?   196.184   100.457      41.0714    100.457      137.56     -79.543      
1 1 1 18  8  13 o 0 310.3   14.7  ?     ?   219.717   -22.6136     497.81     -22.6136     296.986    -22.6136     
1 1 1 18  8  14 o 0 83.2    13.5  ?     ?   209.887   146.984      122.152    146.984      68.6528    -33.0162     
1 1 1 18  8  15 f 1 86.5    11.7  ?     ?   229.721   42.5348      155.371    42.5348      80.2431    -137.465     
1 1 1 18  8  16 o 0 26.4    12.7  ?     ?   84.2052   72.7005      23.2324    72.7005      60.6536    -107.299     
1 1 1 18  8  17 o 0 188.8   16.8  ?     ?   289.009   57.4542      347.436    57.4542      66.2656    57.4542      
1 1 1 18  8  18 o 0 34      15.9  ?     ?   86.3527   36.7271      78.2507    36.7271      3.0714     -143.273     
1 1 1 18  8  19 o 0 316     21    ?     ?   279.149   -5.60345     549.233    -5.60345     287.395    -5.60345     
1 1 1 18  8  20 o 0 109.5   22.3  ?     ?   157.005   12.3217      290.472    12.3217      143.125    12.3217      
1 1 1 18  8  21 f 1 82.1    21.1  ?     ?   89.6732   -1.5093      264.253    -1.5093      173.216    -1.5093      
1 1 1 18  8  22 f 1 8.5     27.9  ?     ?   105.084   -16.7664     43.1178    -16.7664     59.8125    163.234      
1 1 1 18  8  23 o 0 24.5    32.2  ?     ?   133.013   -13.738      74.7835    -13.738      50.9421    166.262      
1 1 1 18  8  24 o 0 3.9     31    ?     ?   141.003   75.0146      41.7286    75.0146      88.8179    -104.985     
1 1 1 -18 10 23 < 0 32.8    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 10 22 o 0 0.8     13.2  ?     ?   102.335   108.996      6.40057    -71.0044     95.178     -71.0044     
1 1 1 -18 10 21 o 0 55.2    12.6  ?     ?   144.512   85.3567      167.315    85.3567      38.8809    85.3567      
1 1 1 -18 10 20 o 0 25.8    12.2  ?     ?   153.862   174.252      36.9546    174.252      109.109    -5.74802     
1 1 1 -18 10 19 o 0 -4.8    10.4  ?     ?   83.7694   -35.6628     40.1554    144.337      119.894    144.337      
1 1 1 -18 10 18 o 0 37.2    9.8   ?     ?   58.7421   169.683      92.8632    169.683      40.8493    169.683      
1 1 1 -18 10 17 o 0 86.4    9.2   ?     ?   149.01    135.497      233.253    135.497      101.235    135.497      
1 1 1 -18 10 16 o 0 50.4    6.9   ?     ?   141.401   -113.996     136.774    -113.996     10.8598    -113.996     
1 1 1 -18 10 15 o 0 158.7   7.9   ?     ?   261.4     -79.5629     301.42     -79.5629     60.697     -79.5629     
1 1 1 -18 10 14 o 0 127.3   6.9   ?     ?   169.106   -68.4413     297.222    -68.4413     137.587    -68.4413     
1 1 1 -18 10 13 o 0 85.8    6.4   ?     ?   169.352   162.843      204.354    162.843      43.2925    162.843      
1 1 1 -18 10 12 o 0 287.6   8.6   ?     ?   384.567   155.143      382.315    155.143      7.47176    155.143      
1 1 1 -18 10 11 o 0 298.6   10.2  ?     ?   437.308   -23.1743     312.797    -23.1743     68.3809    156.826      
1 1 1 -18 10 10 o 0 965.5   22.6  ?     ?   637.643   -85.8966     721.528    -85.8966     164.16     -85.8966     
1 1 1 -18 10 9  o 0 527.8   11.8  ?     ?   515.408   -144.605     486.593    -144.605     33.5871    -144.605     
1 1 1 -18 10 8  o 0 559.8   12    ?     ?   283.567   -154.633     686.134    -154.633     437.825    -154.633     
1 1 1 -18 10 7  o 0 183.9   5.9   ?     ?   329.147   -65.5607     227.412    -65.5608     62.1086    114.439      
1 1 1 -18 10 6  o 0 437.2   9.9   ?     ?   477.795   -59.8123     431.416    -59.8123     9.46271    -59.8123     
1 1 1 -18 10 5  o 0 1114.4  20.9  ?     ?   477.815   -136.719     953.425    -136.719     520.97     -136.719     
1 1 1 -18 10 4  o 0 737.1   15.6  ?     ?   766.741   159.365      443.3      159.365      252.729    -20.6353     
1 1 1 -18 10 3  o 0 654     13.7  ?     ?   297.204   -151.226     757.298    -151.226     486.829    -151.226     
1 1 1 -18 10 2  f 1 284.3   7.9   ?     ?   137.195   150.068      418.096    150.068      292.348    150.068      
1 1 1 -18 10 1  o 0 947.5   18.6  ?     ?   515.142   151.37       818.852    151.37       348.383    151.37       
1 1 1 18  10 0  o 0 633.3   13.4  ?     ?   564.418   152.503      536.736    152.503      19.189     152.503      
1 1 1 18  10 1  o 0 289.9   10.5  ?     ?   132.579   107.326      424.395    107.326      302.747    107.326      
1 1 1 18  10 2  f 1 532.3   11.7  ?     ?   461.187   -90.4986     529.96     -90.4986     104.517    -90.4986     
1 1 1 18  10 3  o 0 145.2   7     ?     ?   110.858   159.634      189.192    159.634      87.4667    159.634      
1 1 1 18  10 4  o 0 255.9   8.1   ?     ?   362.53    66.4754      299.841    66.4754      32.6124    -113.525     
1 1 1 18  10 5  o 0 475.2   11.6  ?     ?   520.302   149.056      426.967    149.056      49.6466    -30.944      
1 1 1 18  10 6  o 0 649     16.2  ?     ?   620.474   -169.29      516.966    -169.29      38.6885    10.7102      
1 1 1 18  10 7  o 0 505.5   13.3  ?     ?   326.033   -104.145     620.603    -104.145     329.236    -104.145     
1 1 1 18  10 8  o 0 403.7   12.2  ?     ?   390.905   -0.412401    468.028    -0.412401    119.588    -0.412401    
1 1 1 18  10 9  o 0 349.7   11.4  ?     ?   437.54    62.3857      376.741    62.3857      15.4667    -117.614     
1 1 1 18  10 10 o 0 25.4    7.9   ?     ?   207.213   31.2372      56.7587    -148.763     241.834    -148.763     
1 1 1 18  10 11 o 0 29      8.3   ?     ?   83.96     -161.451     15.8678    -161.451     68.4551    18.5489      
1 1 1 18  10 12 o 0 141.5   11.3  ?     ?   323.245   -143.482     203.461    -143.482     119.682    36.5176      
1 1 1 18  10 13 o 0 26.3    9.5   ?     ?   123.373   151.52       19.4465    151.52       101.114    -28.4799     
1 1 1 18  10 14 o 0 56.9    15    ?     ?   114.029   70.7475      157.884    70.7475      48.9304    70.7475      
1 1 1 18  10 15 o 0 52.5    13.9  ?     ?   114.997   44.3744      142.276    44.3744      33.0667    44.3744      
1 1 1 18  10 16 o 0 320.6   17.4  ?     ?   323.374   105.73       512.379    105.73       214.891    105.73       
1 1 1 18  10 17 o 0 80.3    17.3  ?     ?   212.041   -17.4121     178.867    -17.4121     15.5591    162.588      
1 1 1 18  10 18 o 0 129.5   19.9  ?     ?   185.189   -37.1262     309.181    -37.1262     139.17     -37.1262     
1 1 1 18  10 19 o 0 361.1   25.2  ?     ?   391.793   23.1088      498.217    23.1088      110.866    23.1088      
1 1 1 18  10 20 o 0 29.3    22.5  ?     ?   121.755   14.8679      70.6049    14.8679      45.6096    -165.132     
1 1 1 18  10 21 o 0 -10.6   23.7  ?     ?   67.3113   33.6092      14.8231    33.6092      47.5328    -146.391     
1 1 1 18  10 22 o 0 135.6   33.4  ?     ?   216.236   24.8362      290.412    24.8362      94.5265    24.8362      
1 1 1 -18 12 21 < 1 9.8     17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 12 20 o 0 35.6    15.4  ?     ?   153.04    -168.939     87.6297    -168.939     41.9271    11.0614      
1 1 1 -18 12 19 o 0 11.5    14.1  ?     ?   33.7903   28.9761      23.2884    28.9761      5.55041    -151.024     
1 1 1 -18 12 18 o 0 286.9   15.1  ?     ?   405.321   21.2681      381.328    21.2681      27.3372    21.2681      
1 1 1 -18 12 17 o 0 9.8     9.4   ?     ?   80.4928   162.195      1.2221     -17.8055     76.2267    -17.8055     
1 1 1 -18 12 16 o 0 167.3   10.5  ?     ?   307.981   -157.949     276.854    -157.949     10.5689    22.0509      
1 1 1 -18 12 15 o 0 37.5    8.1   ?     ?   125.423   19.1926      105.381    19.1926      8.63634    -160.807     
1 1 1 -18 12 14 o 0 67.3    7.5   ?     ?   177.035   73.601       167.669    73.601       12.9178    73.601       
1 1 1 -18 12 13 o 0 65      7     ?     ?   125.007   -15.6801     185.246    -15.6801     76.0971    -15.6801     
1 1 1 -18 12 12 o 0 78.1    7.1   ?     ?   212.418   115.781      171.112    115.781      14.9853    -64.2193     
1 1 1 -18 12 11 o 0 251.7   8.9   ?     ?   350.39    100.883      369.92     100.883      53.013     100.883      
1 1 1 -18 12 10 o 0 54.8    5.6   ?     ?   160.793   48.0498      131.969    48.0498      14.357     -131.95      
1 1 1 -18 12 9  o 0 43      5.1   ?     ?   93.9237   131.723      87.3809    131.723      0.0378241  -48.2768     
1 1 1 -18 12 8  f 1 302.8   8.9   ?     ?   323.12    134.359      458.109    134.359      154.255    134.359      
1 1 1 -18 12 7  o 0 636.9   15.3  ?     ?   561.439   86.9751      594.529    86.9751      57.4252    86.9751      
1 1 1 -18 12 6  o 0 917.3   22    ?     ?   504.787   47.5598      880.445    47.5598      395.513    47.5598      
1 1 1 -18 12 5  o 0 432.4   11.7  ?     ?   427.671   96.4349      516.738    96.4349      104.37     96.4349      
1 1 1 -18 12 4  o 0 203.8   7     ?     ?   219.138   76.9316      389.052    76.9316      177.077    76.9316      
1 1 1 -18 12 3  o 0 26.5    4.7   ?     ?   139.187   166.175      22.4842    -13.8248     142.052    -13.8248     
1 1 1 -18 12 2  o 0 251.1   9.6   ?     ?   367.435   107.145      297.493    107.145      18.8589    -72.8552     
1 1 1 -18 12 1  o 0 400.6   10.4  ?     ?   530.722   -172.258     342.579    -172.258     115.172    7.7425       
1 1 1 18  12 0  o 0 257.9   8     ?     ?   508.575   134.717      198.349    134.717      243.84     -45.2826     
1 1 1 18  12 1  o 0 466.6   11.3  ?     ?   478.801   42.5221      453.71     42.5221      37.2929    42.5221      
1 1 1 18  12 2  o 0 254.2   7.8   ?     ?   384.123   20.1206      292.038    20.1206      41.9891    -159.879     
1 1 1 18  12 3  o 0 -8.1    5.5   ?     ?   131.304   7.69346      117.632    -172.307     246.478    -172.307     
1 1 1 18  12 4  o 0 19.4    6.2   ?     ?   77.7739   54.9737      13.43      -125.026     89.6702    -125.026     
1 1 1 18  12 5  o 0 15.9    6.4   ?     ?   68.9658   -178.401     22.9814    1.59853      90.487     1.59853      
1 1 1 18  12 6  o 0 23.4    7.3   ?     ?   31.3471   -97.8235     0.970476   -97.8235     29.653     82.1765      
1 1 1 18  12 7  o 0 21.4    7.3   ?     ?   90.8183   35.7268      5.90153    35.7268      81.0596    -144.273     
1 1 1 18  12 8  f 1 344     11.9  ?     ?   386.741   -34.1671     464.407    -34.1671     93.272     -34.1671     
1 1 1 18  12 9  o 0 -2.7    9.6   ?     ?   146.111   -58.334      97.7418    121.666      236.765    121.666      
1 1 1 18  12 10 o 0 116.5   10.4  ?     ?   138.028   -94.8058     304.533    -94.8058     175.897    -94.8058     
1 1 1 18  12 11 o 0 8.2     9.2   ?     ?   77.5248   -154.069     19.6413    25.9307      89.7837    25.9307      
1 1 1 18  12 12 o 0 119.1   12.2  ?     ?   285.116   73.4883      213.55     73.4883      43.1595    -106.512     
1 1 1 18  12 13 o 0 22.3    11.5  ?     ?   216.487   61.1653      25.5986    -118.835     220.204    -118.835     
1 1 1 18  12 14 o 0 13.5    11.7  ?     ?   57.4567   117.384      9.06516    117.384      42.7327    -62.6157     
1 1 1 18  12 15 o 0 96.1    16.9  ?     ?   250.771   -62.0953     187.361    -62.0953     56.5014    117.905      
1 1 1 18  12 16 o 0 93      19.1  ?     ?   187.348   -80.786      230.436    -80.786      48.1257    -80.786      
1 1 1 18  12 17 o 0 8.6     23.8  ?     ?   77.4678   -58.2955     35.2225    -58.2955     37.0972    121.704      
1 1 1 18  12 18 o 0 55.7    23.2  ?     ?   178.704   5.17746      123.921    5.17746      38.173     -174.823     
1 1 1 18  12 19 o 0 28      30    ?     ?   115.925   -29.4569     87.6784    -29.4569     15.2574    150.543      
1 1 1 18  12 20 o 0 38.3    29.9  ?     ?   64.9727   106.887      131.82     106.887      74.4938    106.887      
1 1 1 -18 14 18 < 0 54.6    15.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 14 17 < 0 122.7   13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 14 16 o 0 119.2   14.1  ?     ?   250.25    91.8286      239.561    91.8286      31.3235    91.8286      
1 1 1 -18 14 15 o 0 166.2   13.6  ?     ?   269.051   103.068      311.155    103.068      85.8209    103.068      
1 1 1 -18 14 14 o 0 214.8   12.2  ?     ?   313.442   31.7831      351.426    31.7831      83.2448    31.7831      
1 1 1 -18 14 13 o 0 166.5   12    ?     ?   335.191   49.4584      251.828    49.4584      43.3522    -130.542     
1 1 1 -18 14 12 o 0 9.2     9.2   ?     ?   75.2372   74.6943      2.03523    -105.306     71.1017    -105.306     
1 1 1 -18 14 11 o 0 365.6   12.4  ?     ?   359.542   52.2435      502.374    52.2435      172.542    52.2435      
1 1 1 -18 14 10 o 0 57.4    7.7   ?     ?   233.24    107.828      97.4169    107.828      117.908    -72.1719     
1 1 1 -18 14 9  o 0 264.8   10.3  ?     ?   296.727   152.86       422.631    152.86       168.803    152.86       
1 1 1 -18 14 8  o 0 133.8   7.2   ?     ?   207.006   118.364      290.582    118.364      112.554    118.364      
1 1 1 -18 14 7  o 0 46.7    5.9   ?     ?   174.729   -101.788     104.044    -101.788     45.6472    78.2123      
1 1 1 -18 14 6  o 0 142.2   7.7   ?     ?   265.49    -80.4962     263.815    -80.4962     35.3703    -80.4962     
1 1 1 -18 14 5  o 0 10.7    4.8   ?     ?   105.521   62.0343      25.843     -117.966     116.652    -117.966     
1 1 1 -18 14 4  o 0 10.8    6.2   ?     ?   25.0244   35.3494      3.91938    -144.651     25.5287    -144.651     
1 1 1 -18 14 3  o 0 33.5    6.2   ?     ?   123.661   88.9105      79.2257    88.9105      27.874     -91.0895     
1 1 1 -18 14 2  o 0 4.3     5.5   ?     ?   93.7208   -86.5251     47.5937    93.4749      128.964    93.4749      
1 1 1 -18 14 1  o 0 149.3   8     ?     ?   250.782   -97.9461     291.948    -97.9461     73.7763    -97.9461     
1 1 1 18  14 0  o 0 129.8   7.1   ?     ?   230.652   -60.9346     273.693    -60.9346     70.6493    -60.9346     
1 1 1 18  14 1  o 0 38      6.7   ?     ?   194.764   -121.599     62.908     -121.599     108.536    58.4005      
1 1 1 18  14 2  o 0 174.2   8.1   ?     ?   118.59    -108.687     420.855    -108.687     316.515    -108.687     
1 1 1 18  14 3  o 0 26.8    7.3   ?     ?   23.7217   114.157      22.5472    114.157      1.69498    114.157      
1 1 1 18  14 4  o 0 226.4   10.8  ?     ?   323.304   118.259      363.193    118.259      79.385     118.259      
1 1 1 18  14 5  o 0 129.1   10    ?     ?   273.616   118.308      237.502    118.308      2.25174    -61.6922     
1 1 1 18  14 6  o 0 -9.1    9.4   ?     ?   131.056   137.461      80.3536    -42.5395     195.36     -42.5395     
1 1 1 18  14 7  o 0 77.8    10.5  ?     ?   199.132   -71.7789     177.829    -71.7789     3.56258    -71.7789     
1 1 1 18  14 8  o 0 10.4    11.3  ?     ?   106.782   149.572      10.2037    -30.4278     104.167    -30.4278     
1 1 1 18  14 9  o 0 29.2    12    ?     ?   142.893   111.412      52.647     111.412      72.6278    -68.5878     
1 1 1 18  14 10 o 0 31.1    13.4  ?     ?   177.032   -175.696     41.0869    -175.696     126.691    4.30355      
1 1 1 18  14 11 o 0 65.4    14.3  ?     ?   131.664   -145.832     193.193    -145.832     68.9904    -145.832     
1 1 1 18  14 12 o 0 35.1    18.5  ?     ?   61.4341   -136.587     95.4826    -136.587     37.3944    -136.587     
1 1 1 18  14 13 o 0 65.6    23.4  ?     ?   136.073   -117.973     180.787    -117.973     57.1534    -117.973     
1 1 1 18  14 14 o 0 49.7    17.4  ?     ?   156.732   20.2781      128.177    20.2781      10.4133    -159.722     
1 1 1 18  14 15 o 0 16.2    10.1  ?     ?   224.353   -27.7157     42.4381    152.284      236.957    152.284      
1 1 1 18  14 16 o 0 23      21.3  ?     ?   42.7985   -118.635     77.1902    -118.635     40.2598    -118.635     
1 1 1 18  14 17 < 0 -37.4   26.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 16 13 < 0 68      12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 16 12 < 0 10.3    12.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 16 11 o 0 30      10.3  ?     ?   155.745   80.9911      70.9838    80.9911      55.4837    -99.0089     
1 1 1 -18 16 10 f 1 59.5    10.8  ?     ?   222.763   65.4803      119.528    65.4803      63.0652    -114.52      
1 1 1 -18 16 9  o 0 84.4    11.5  ?     ?   148.193   -127.934     235.59     -127.934     114.011    -127.934     
1 1 1 -18 16 8  o 0 109.7   10.7  ?     ?   302.953   -101.696     173.756    -101.696     79.4719    78.3038      
1 1 1 -18 16 7  o 0 25.2    9.4   ?     ?   97.3312   -3.44638     71.9979    -3.44638     9.77053    176.554      
1 1 1 -18 16 6  o 0 26.2    9     ?     ?   120.182   -24.4405     62.7903    -24.4405     40.7985    155.559      
1 1 1 -18 16 5  o 0 103.2   10    ?     ?   228.784   -87.2618     216.655    -87.2618     18.6474    -87.2618     
1 1 1 -18 16 4  o 0 -9.3    8.7   ?     ?   76.9658   -90.8057     41.3771    89.1943      108.232    89.1943      
1 1 1 -18 16 3  o 0 290.6   13.4  ?     ?   364.272   28.2453      394.06     28.2453      65.5814    28.2453      
1 1 1 -18 16 2  o 0 222.1   12.1  ?     ?   273.77    27.5781      379.993    27.5781      132.458    27.5781      
1 1 1 -18 16 1  o 0 38.6    9.7   ?     ?   130.259   -135.19      108.711    -135.19      9.32867    44.8104      
1 1 1 18  16 0  o 0 239.4   11.3  ?     ?   248.674   -75.3302     433.757    -75.3302     204.922    -75.3302     
1 1 1 18  16 1  o 0 101.2   10.7  ?     ?   181.21    -161.15      247.737    -161.15      81.0404    -161.15      
1 1 1 18  16 2  o 0 5.4     9.6   ?     ?   109.852   81.4962      27.2903    -98.5038     128.265    -98.5038     
1 1 1 18  16 3  o 0 9.8     11.8  ?     ?   91.1246   -130.477     4.83864    -130.477     76.0034    49.5228      
1 1 1 18  16 4  o 0 30.2    13.3  ?     ?   141.541   -70.776      64.1547    -70.776      61.2053    109.224      
1 1 1 18  16 6  o 0 115.4   13.8  ?     ?   298.071   64.1145      184.884    64.1145      77.8736    -115.885     
1 1 1 18  16 7  o 0 163.8   16.6  ?     ?   184.776   87.6358      369.632    87.6358      210.628    87.6358      
1 1 1 18  16 8  o 0 -8.7    16.5  ?     ?   37.247    -89.5713     1.08101    90.4287      33.0206    90.4287      
1 1 1 18  16 9  o 0 -10.8   16.5  ?     ?   116.532   -122.295     20.1104    57.7053      118.344    57.7053      
1 1 1 18  16 10 f 1 12.5    18.7  ?     ?   85.532    122.775      54.5786    122.775      17.7336    -57.225      
1 1 1 18  16 11 o 0 72      22    ?     ?   167.733   -178.692     176.516    -178.692     36.1248    -178.692     
1 1 1 18  16 12 < 0 2.7     22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -18 18 1  < 0 8.2     12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 18  18 0  < 0 13.9    13    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 18  18 1  < 0 36.9    14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 1  28 < 0 10.9    16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 1  27 o 0 6.5     13.8  ?     ?   111.206   -111.522     7.32363    -111.522     94.763     68.4781      
1 1 1 -19 1  26 o 0 64.4    12.4  ?     ?   222.263   -156.017     137.992    -156.017     75.6345    23.9827      
1 1 1 -19 1  25 o 0 -14.6   12.2  ?     ?   47.6269   -103.36      23.9145    76.6399      71.8264    76.6399      
1 1 1 -19 1  24 o 0 14.9    11.6  ?     ?   90.952    -173.733     9.98689    -173.733     74.5933    6.26671      
1 1 1 -19 1  23 o 0 79.3    11.2  ?     ?   330.401   30.0397      86.0949    30.0397      221.718    -149.96      
1 1 1 -19 1  22 o 0 82.3    11.4  ?     ?   144.697   30.6128      237.075    30.6128      101.409    30.6128      
1 1 1 -19 1  21 o 0 108.7   9.2   ?     ?   320.566   -22.1792     150.896    -22.1792     165.628    157.821      
1 1 1 -19 1  20 o 0 380.3   11.5  ?     ?   431.307   -19.1051     477.276    -19.1051     39.8031    -19.1051     
1 1 1 -19 1  19 o 0 541.2   13.5  ?     ?   408.793   -32.9804     602.797    -32.9804     232.313    -32.9804     
1 1 1 -19 1  18 o 0 211.3   8.2   ?     ?   334.706   158.412      283.916    158.412      21.9751    -21.5879     
1 1 1 -19 1  17 o 0 146.6   7.3   ?     ?   250.155   158.055      220.316    158.055      8.11899    -21.9454     
1 1 1 -19 1  16 o 0 462.8   11    ?     ?   365.76    19.4475      551.294    19.4475      207.637    19.4475      
1 1 1 -19 1  15 o 0 307.3   9.3   ?     ?   482.77    -8.96979     275.586    -8.96979     186.707    171.03       
1 1 1 -19 1  14 o 0 1127    24.9  ?     ?   683.734   -101.056     800.527    -101.056     158.868    -101.056     
1 1 1 -19 1  13 o 0 87      4.1   ?     ?   263.236   97.125       67.3487    97.125       184.44     -82.875      
1 1 1 -19 1  12 o 0 607.4   12.3  ?     ?   550.322   -105.461     526.875    -105.461     2.37447    74.539       
1 1 1 -19 1  11 o 0 1861.5  37.8  ?     ?   775.882   -28.5906     1219.82    -28.5906     439.811    -28.5906     
1 1 1 -19 1  10 o 0 586.1   12.9  ?     ?   292.29    48.9869      770.933    48.9869      475.816    48.9869      
1 1 1 -19 1  9  o 0 1245.6  22.3  ?     ?   761.213   -82.5466     872.126    -82.5466     100.671    -82.5466     
1 1 1 -19 1  8  o 0 769.4   14.2  ?     ?   517.635   -118.113     766.693    -118.113     228.346    -118.113     
1 1 1 -19 1  7  o 0 849.8   16.6  ?     ?   502.14    81.4407      855.668    81.4407      336.601    81.4407      
1 1 1 -19 1  6  o 0 458.5   8.9   ?     ?   362.67    79.97        604.916    79.97        229.25     79.97        
1 1 1 -19 1  5  o 0 302     5.9   ?     ?   400.778   -118.964     374.92     -118.964     40.8718    61.0362      
1 1 1 -19 1  4  o 0 1698.4  29.5  ?     ?   1033.12   -90.9666     852.656    -90.9666     138.565    89.0334      
1 1 1 -19 1  2  o 0 2566.5  44.2  ?     ?   1188.14   47.0548      1135.96    47.0548      6.16902    -132.945     
1 1 1 -19 1  1  o 0 2966.2  51.3  ?     ?   1155.78   14.0096      1340.1     14.0096      227.903    14.0096      
1 1 1 19  1  0  o 0 1091    19.9  ?     ?   877.443   129.391      628.692    129.391      213.659    -50.609      
1 1 1 19  1  1  o 0 409.7   10.6  ?     ?   488.44    163.674      403.759    163.674      66.2319    -16.3255     
1 1 1 19  1  2  o 0 577.9   11    ?     ?   491.269   -82.5469     575.381    -82.5469     101.489    -82.5469     
1 1 1 19  1  3  o 0 684.9   13    ?     ?   538.912   -71.5917     631.942    -71.5917     110.852    -71.5917     
1 1 1 19  1  4  o 0 393.9   8     ?     ?   487.48    58.3482      389.415    58.3482      82.8908    -121.652     
1 1 1 19  1  5  o 0 1702.2  30.6  ?     ?   789.761   -178.425     1184.21    -178.425     354.65     -178.425     
1 1 1 19  1  6  o 0 297     6.7   ?     ?   205.186   -153.725     513.584    -153.725     297.902    -153.725     
1 1 1 19  1  7  o 0 417.6   9.3   ?     ?   395.856   -16.8827     536.161    -16.8827     120.072    -16.8827     
1 1 1 19  1  8  o 0 877.1   19.4  ?     ?   747.866   15.7259      629.44     15.7259      145.087    -164.274     
1 1 1 19  1  9  o 0 1267.7  26.7  ?     ?   874.503   22.3397      791.494    22.3397      112.813    -157.66      
1 1 1 19  1  10 o 0 2708.2  48.2  ?     ?   1233.2    124.593      1219.74    124.593      52.687     -55.4073     
1 1 1 19  1  11 o 0 73.5    7     ?     ?   148.187   75.1874      73.983     75.1874      80.323     -104.813     
1 1 1 19  1  12 o 0 2045.6  38.6  ?     ?   1246.45   -85.4107     813.346    -85.4107     415.195    94.5893      
1 1 1 19  1  13 o 0 138.3   9.9   ?     ?   303.414   -21.6776     157.325    -21.6776     140.531    158.322      
1 1 1 19  1  14 o 0 2319.3  45.5  ?     ?   993.053   157.132      1192.99    157.132      235.194    157.132      
1 1 1 19  1  15 o 0 367.5   15.5  ?     ?   481.747   143.826      366.015    143.826      103.075    -36.1743     
1 1 1 19  1  16 o 0 133.9   13.1  ?     ?   285.221   160.034      164.536    160.034      111.654    -19.966      
1 1 1 19  1  17 o 0 146     12    ?     ?   233.05    169.457      234.291    169.457      14.6463    169.457      
1 1 1 19  1  18 o 0 110.1   13.7  ?     ?   159.79    -147.292     207.446    -147.292     56.5075    -147.292     
1 1 1 19  1  19 o 0 13.6    14.4  ?     ?   41.3475   97.6946      13.6624    -82.3054     57.4585    -82.3054     
1 1 1 19  1  20 o 0 41.4    18.1  ?     ?   90.6258   -152.391     78.0379    -152.391     15.5909    27.6089      
1 1 1 19  1  21 o 0 127.9   20.4  ?     ?   139.647   -91.3595     350.087    -91.3595     209.314    -91.3595     
1 1 1 19  1  22 o 0 62.9    20.2  ?     ?   81.5667   112.574      179.899    112.574      100.37     112.574      
1 1 1 19  1  23 o 0 205.6   20.7  ?     ?   321.971   28.092       360.788    28.092       48.3466    28.092       
1 1 1 19  1  24 o 0 96.1    24.1  ?     ?   131.74    81.4679      295.76     81.4679      157.005    81.4679      
1 1 1 19  1  25 o 0 11.3    28.2  ?     ?   232.752   -73.7025     46.517     106.298      291.23     106.298      
1 1 1 19  1  26 o 0 46.1    28.1  ?     ?   115.408   -85.7752     140.713    -85.7752     27.0002    -85.7752     
1 1 1 19  1  27 o 0 30.1    30.4  ?     ?   111.289   -95.9875     110.154    -95.9875     2.75722    -95.9875     
1 1 1 -19 3  28 < 0 103.6   16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 3  27 o 0 72.8    14.1  ?     ?   197.273   -53.7477     191.46     -53.7477     12.2229    -53.7477     
1 1 1 -19 3  26 o 0 47.8    12.4  ?     ?   220.665   -108.96      91.2561    -108.96      113.893    71.0401      
1 1 1 -19 3  25 o 0 42.5    11.8  ?     ?   95.9142   179.326      147.051    179.326      51.7001    179.326      
1 1 1 -19 3  24 o 0 41.1    8.7   ?     ?   168.958   133.715      100.547    133.715      68.0615    -46.2852     
1 1 1 -19 3  23 o 0 164.4   11.2  ?     ?   349.96    146.743      251.632    146.743      73.6137    -33.2565     
1 1 1 -19 3  22 o 0 -18.4   8.2   ?     ?   60.1842   118.092      45.8405    -61.9082     101.663    -61.9082     
1 1 1 -19 3  21 o 0 132.7   9     ?     ?   177.208   62.0024      327.151    62.0024      156.883    62.0024      
1 1 1 -19 3  20 o 0 348.3   10.5  ?     ?   366.142   47.0971      506.363    47.0971      145.114    47.0971      
1 1 1 -19 3  19 o 0 218.6   8.9   ?     ?   236.415   -173.848     419.476    -173.848     179.876    -173.848     
1 1 1 -19 3  18 o 0 401.3   11.3  ?     ?   515.995   -77.1943     372.906    -77.1943     94.3338    102.806      
1 1 1 -19 3  17 o 0 169.1   7.5   ?     ?   215.366   15.6301      274.044    15.6301      79.1023    15.6301      
1 1 1 -19 3  16 o 0 660.8   14.3  ?     ?   660.374   19.9146      485.631    19.9146      129.667    -160.085     
1 1 1 -19 3  15 o 0 291     9.3   ?     ?   242.084   -78.4669     432.239    -78.4669     204.999    -78.4669     
1 1 1 -19 3  14 f 1 636.6   14.2  ?     ?   550.189   133.212      544.949    133.212      29.7918    133.212      
1 1 1 -19 3  13 o 0 398.1   12.4  ?     ?   654.709   20.9939      227.695    20.9939      386.151    -159.006     
1 1 1 -19 3  12 o 0 2019    40.8  ?     ?   707.464   36.2861      1277.54    36.2861      601.449    36.2861      
1 1 1 -19 3  11 o 0 961.5   17.5  ?     ?   447.214   -129.646     898.987    -129.646     469.259    -129.646     
1 1 1 -19 3  10 o 0 1346    23.8  ?     ?   755.456   -84.6442     935.656    -84.6442     176.745    -84.6442     
1 1 1 -19 3  9  o 0 470.9   9.2   ?     ?   372.945   126.241      587.691    126.241      211.372    126.241      
1 1 1 -19 3  8  o 0 70.1    3.2   ?     ?   310.188   102.916      1.65918    102.916      312.563    -77.0836     
1 1 1 -19 3  7  o 0 66.5    3.2   ?     ?   144.963   142.809      61.5538    142.809      85.7923    -37.1913     
1 1 1 -19 3  6  f 1 264     5.9   ?     ?   471.615   39.1809      249.157    39.1809      245.157    -140.819     
1 1 1 -19 3  5  o 0 1439.2  25    ?     ?   820.22    88.9116      975.659    88.9116      125.727    88.9116      
1 1 1 -19 3  4  o 0 438.1   8.9   ?     ?   421.786   107.063      530.818    107.063      92.911     107.063      
1 1 1 -19 3  2  o 0 264.2   6.9   ?     ?   243.467   23.2448      441.702    23.2448      188.229    23.2448      
1 1 1 -19 3  1  o 0 2540.3  51.5  ?     ?   1077.4    54.7522      1331.41    54.7522      208.62     54.7522      
1 1 1 19  3  0  o 0 1351.9  25.9  ?     ?   782.723   76.4906      882.179    76.4906      133.712    76.4906      
1 1 1 19  3  1  o 0 85.7    2.7   ?     ?   274.671   77.2719      70.7987    77.2719      214.202    -102.728     
1 1 1 19  3  2  o 0 350.6   7.1   ?     ?   521.677   37.5867      330.565    37.5867      211.957    -142.413     
1 1 1 19  3  3  o 0 179.1   4.2   ?     ?   319.334   -46.7926     247.13     -46.7926     85.6404    133.207      
1 1 1 19  3  4  o 0 267.8   6.2   ?     ?   308.976   52.8143      403.709    52.8143      81.2136    52.8143      
1 1 1 19  3  5  o 0 1560.7  31.8  ?     ?   797.428   -15.8714     1083.74    -15.8714     250.547    -15.8714     
1 1 1 19  3  6  f 1 817.5   15.1  ?     ?   435.785   42.2807      895.041    42.2807      433.21     42.2807      
1 1 1 19  3  7  o 0 329.9   7.3   ?     ?   675.282   -88.5051     145.952    -88.5051     549.815    91.4949      
1 1 1 19  3  8  o 0 2361.5  41.8  ?     ?   1092.77   -156.012     1193.2     -156.012     68.4545    -156.012     
1 1 1 19  3  9  o 0 629     15.1  ?     ?   659.422   7.31954      493.472    7.31954      184.054    -172.68      
1 1 1 19  3  10 o 0 850.9   18.5  ?     ?   668.651   -40.8025     669.996    -40.8025     23.6241    139.198      
1 1 1 19  3  11 o 0 77      7     ?     ?   254.212   74.0323      47.997     74.0323      201.71     -105.968     
1 1 1 19  3  12 o 0 541.4   13.9  ?     ?   503.775   2.27185      515.55     2.27185      22.5102    2.27185      
1 1 1 19  3  13 o 0 2044.2  38.3  ?     ?   1111.12   -26.0323     946.255    -26.0323     122.496    153.968      
1 1 1 19  3  14 f 1 31.2    10.5  ?     ?   183.588   -171.776     67.4606    8.22371      248.878    8.22371      
1 1 1 19  3  15 o 0 585.7   18    ?     ?   460.707   8.91381      611.833    8.91381      166.679    8.91381      
1 1 1 19  3  16 o 0 129.4   12.7  ?     ?   320.307   -159.105     148.27     -159.105     153.031    20.8948      
1 1 1 19  3  17 o 0 80.3    14.8  ?     ?   121.777   2.01928      98.2187    2.01928      15.619     -177.981     
1 1 1 19  3  18 o 0 158.3   14.5  ?     ?   376.412   -101.235     168.228    -101.235     184.355    78.7652      
1 1 1 19  3  19 o 0 241.7   17.1  ?     ?   279.959   -108.709     435.241    -108.709     141.258    -108.709     
1 1 1 19  3  20 o 0 167.1   17.5  ?     ?   202.861   -108.148     379.333    -108.148     171.606    -108.148     
1 1 1 19  3  21 o 0 123.9   18.2  ?     ?   181.672   8.89733      313.391    8.89733      131.922    8.89733      
1 1 1 19  3  22 o 0 242.9   21.9  ?     ?   282.33    67.1567      456.296    67.1567      182.569    67.1567      
1 1 1 19  3  23 o 0 42.7    25.1  ?     ?   145.719   71.8025      101.462    71.8025      39.8115    -108.198     
1 1 1 19  3  24 o 0 208.9   26.7  ?     ?   318.223   30.5941      364.329    30.5941      32.4736    30.5941      
1 1 1 19  3  25 o 0 290.8   33    ?     ?   264.081   40.3792      547.107    40.3792      281.526    40.3792      
1 1 1 19  3  26 o 0 -19.1   38.3  ?     ?   167.578   52.5401      6.34577    52.5401      154.92     -127.46      
1 1 1 -19 5  27 < 0 30.5    14.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 5  26 o 0 35.3    15.5  ?     ?   164.972   -101.06      80.6314    -101.06      67.6805    78.9401      
1 1 1 -19 5  25 o 0 26.1    13.3  ?     ?   140.404   -143.893     57.9856    -143.893     71.4547    36.1072      
1 1 1 -19 5  24 o 0 45.7    10.3  ?     ?   99.9082   -71.6253     159.32     -71.6253     60.835     -71.6253     
1 1 1 -19 5  23 o 0 161.2   13.9  ?     ?   123.811   87.4125      432.977    87.4125      310.47     87.4125      
1 1 1 -19 5  22 o 0 25.6    7.8   ?     ?   88.1328   -37.1851     54.3647    -37.1851     26.138     142.815      
1 1 1 -19 5  21 o 0 131     9.7   ?     ?   234.35    149.905      284.716    149.905      69.2261    149.905      
1 1 1 -19 5  20 o 0 227.4   9.8   ?     ?   375.767   70.6285      329.771    70.6285      28.1386    -109.372     
1 1 1 -19 5  19 o 0 453.5   12.6  ?     ?   538.34    39.5996      467.566    39.5996      58.9187    -140.4       
1 1 1 -19 5  18 o 0 423.6   11.6  ?     ?   414.36    46.7383      540.482    46.7383      124.256    46.7383      
1 1 1 -19 5  17 o 0 198.7   8.1   ?     ?   289.078   -71.8656     292.885    -71.8656     33.4577    -71.8656     
1 1 1 -19 5  16 o 0 265.2   8.6   ?     ?   413.09    159.712      288.379    159.712      82.1732    -20.2884     
1 1 1 -19 5  15 o 0 427.8   12.2  ?     ?   483.197   -130.937     427.201    -130.937     9.6403     49.0634      
1 1 1 -19 5  14 o 0 774.5   18.1  ?     ?   731.927   -83.8541     515.077    -83.8541     165.704    96.1459      
1 1 1 -19 5  13 o 0 52.8    5.3   ?     ?   295.331   2.28264      47.587     -177.717     327.53     -177.717     
1 1 1 -19 5  12 o 0 932     17.3  ?     ?   725.885   23.2795      622.993    23.2795      51.3104    -156.72      
1 1 1 -19 5  11 o 0 404.1   10.6  ?     ?   280.522   -4.80821     535.067    -4.80821     272.926    -4.80821     
1 1 1 -19 5  10 f 1 2734.1  47.2  ?     ?   1194.76   -89.6189     1138.65    -89.6189     4.59332    90.3811      
1 1 1 -19 5  9  o 0 466     9.4   ?     ?   345.896   -100.154     560.491    -100.154     229.568    -100.154     
1 1 1 -19 5  8  o 0 725.9   16    ?     ?   685.219   -87.4904     533.386    -87.4904     159.882    92.5096      
1 1 1 -19 5  7  o 0 822     15    ?     ?   762.189   -69.4492     552.041    -69.4492     212.908    110.551      
1 1 1 -19 5  6  o 0 1287.1  22.8  ?     ?   885.751   -30.9669     772.787    -30.9669     119.221    149.033      
1 1 1 -19 5  5  o 0 217.7   4.7   ?     ?   190.802   8.77412      375.08     8.77412      182.368    8.77412      
1 1 1 -19 5  3  o 0 332.5   7.3   ?     ?   396.499   108.669      405.832    108.669      3.61395    108.669      
1 1 1 -19 5  2  o 0 152.3   4.6   ?     ?   540.399   -112.604     4.70957    67.3962      553.727    67.3962      
1 1 1 19  5  0  f 1 516.3   16.1  ?     ?   258.562   -39.1314     740.666    -39.1314     471.765    -39.1314     
1 1 1 19  5  1  o 0 510.7   14.3  ?     ?   290.303   -100.018     714.45     -100.018     413.531    -100.018     
1 1 1 19  5  2  o 0 2308.4  40    ?     ?   1171.11   -65.9071     1072.13    -65.9071     116.466    114.093      
1 1 1 19  5  3  o 0 1327.3  23.9  ?     ?   747.563   -68.0148     941.886    -68.0148     182.192    -68.0148     
1 1 1 19  5  4  o 0 151     6     ?     ?   388.117   -47.5352     129.884    -47.5352     264.864    132.465      
1 1 1 19  5  5  o 0 13      2.4   ?     ?   11.5768   118.267      7.88244    -61.7327     19.6608    -61.7327     
1 1 1 19  5  6  o 0 486.5   9.7   ?     ?   713.275   156.194      292.561    156.194      432.951    -23.8063     
1 1 1 19  5  7  o 0 1452.3  32.8  ?     ?   842.358   82.204       928.514    82.204       72.4486    82.204       
1 1 1 19  5  8  o 0 1114.6  29.6  ?     ?   761.602   -174.759     733.109    -174.759     9.80784    5.24106      
1 1 1 19  5  9  o 0 2124.3  40.7  ?     ?   1001.85   -171.22      1075.82    -171.22      100.628    -171.22      
1 1 1 19  5  10 f 1 2132.6  38.1  ?     ?   821.398   -134.673     1243.42    -134.673     441.971    -134.673     
1 1 1 19  5  11 o 0 1622.7  33.2  ?     ?   760.126   -84.4227     1044.86    -84.4227     319.027    -84.4227     
1 1 1 19  5  12 o 0 626.8   18.1  ?     ?   641.598   -3.01315     469.102    -3.01315     141.158    176.987      
1 1 1 19  5  13 o 0 188.8   11.1  ?     ?   185.648   -138.226     304.444    -138.226     126.067    -138.226     
1 1 1 19  5  14 o 0 621.8   16.4  ?     ?   411.075   -41.4523     680.032    -41.4523     287.026    -41.4523     
1 1 1 19  5  15 o 0 34.8    11.3  ?     ?   237.258   75.2983      57.2826    -104.702     278.167    -104.702     
1 1 1 19  5  16 o 0 89.3    11.7  ?     ?   169.383   13.4427      155.312    13.4427      2.81147    -166.557     
1 1 1 19  5  17 o 0 47.5    13.4  ?     ?   204.369   -75.4154     23.757     -75.4154     165.796    104.585      
1 1 1 19  5  18 o 0 131     14.4  ?     ?   328.258   127.426      183.789    127.426      157.604    -52.5742     
1 1 1 19  5  19 o 0 152.3   18.6  ?     ?   328.861   100.605      239.442    100.605      94.1399    -79.3946     
1 1 1 19  5  20 o 0 59.2    17.3  ?     ?   216.794   -85.4034     112.993    -85.4034     101.56     94.5966      
1 1 1 19  5  21 o 0 142.7   18.9  ?     ?   313.59    -70.2626     248.695    -70.2626     51.4503    109.737      
1 1 1 19  5  22 o 0 11.1    24.3  ?     ?   72.8734   -162.537     32.5035    -162.537     37.5158    17.4628      
1 1 1 19  5  23 o 0 56.5    23.6  ?     ?   243.851   145.888      69.0907    145.888      182.967    -34.1123     
1 1 1 19  5  24 o 0 -34.7   25.3  ?     ?   110.428   -133.054     25.7029    46.9459      135.792    46.9459      
1 1 1 19  5  25 o 0 6.5     23.6  ?     ?   99.6657   -95.7711     36.6753    -95.7711     59.6673    84.2289      
1 1 1 -19 7  26 < 1 127.2   17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 7  25 o 0 1.9     11.9  ?     ?   20.8223   -100.791     7.68562    -100.791     10.77      79.209       
1 1 1 -19 7  24 o 0 122.3   14.7  ?     ?   208.71    -110.401     290.873    -110.401     101.615    -110.401     
1 1 1 -19 7  23 o 0 -17.9   9.8   ?     ?   26.5999   171.14       16.3081    -8.8602      41.2284    -8.8602      
1 1 1 -19 7  22 o 0 -5.2    9.9   ?     ?   171.458   -136.798     102.247    43.2016      269.084    43.2016      
1 1 1 -19 7  21 o 0 112     9.8   ?     ?   260.891   127.073      217.909    127.073      18.4661    -52.9266     
1 1 1 -19 7  20 o 0 15.7    8.3   ?     ?   46.5165   -60.8852     6.85497    -60.8852     35.3565    119.115      
1 1 1 -19 7  19 o 0 12.1    7.5   ?     ?   128.447   -134.306     27.8739    45.6938      145.147    45.6938      
1 1 1 -19 7  18 o 0 227.6   9.3   ?     ?   361.617   -76.1497     340.263    -76.1497     1.5355     103.85       
1 1 1 -19 7  17 o 0 44.7    6.8   ?     ?   245.001   108.688      33.0702    108.688      204.567    -71.3118     
1 1 1 -19 7  16 o 0 208.1   11.5  ?     ?   372.271   154.504      280.351    154.504      90.3052    -25.496      
1 1 1 -19 7  15 f 1 192.1   6.9   ?     ?   256.995   96.2756      300.555    96.2756      70.9124    96.2756      
1 1 1 -19 7  14 f 1 109.1   5.7   ?     ?   199.59    63.6121      159.663    63.6121      18.4937    -116.388     
1 1 1 -19 7  13 o 0 61.6    4.9   ?     ?   282.031   -138.628     8.56735    -138.628     243.696    41.3717      
1 1 1 -19 7  12 o 0 160.1   5.7   ?     ?   386.495   -34.2469     136.107    -34.2469     219.329    145.753      
1 1 1 -19 7  11 o 0 526.6   15.4  ?     ?   446.762   12.2106      542.431    12.2106      129.002    12.2106      
1 1 1 -19 7  10 o 0 999.4   18.4  ?     ?   728.467   70.9548      659.409    70.9548      8.7702     -109.045     
1 1 1 -19 7  9  o 0 1111.8  20.1  ?     ?   618.335   106.57       833.771    106.57       263.623    106.57       
1 1 1 -19 7  8  o 0 5.6     2.4   ?     ?   26.0306   138.132      21.0763    -41.8683     45.1925    -41.8683     
1 1 1 -19 7  7  o 0 89.6    3.4   ?     ?   311.318   -116.602     43.5868    -116.602     249.883    63.3982      
1 1 1 -19 7  6  o 0 2037.8  36.1  ?     ?   1081.22   74.2228      930.859    74.2228      92.1765    -105.777     
1 1 1 -19 7  5  f 1 555.1   10.9  ?     ?   488.615   94.3714      523.865    94.3714      57.6716    94.3714      
1 1 1 -19 7  4  o 0 208.1   5.5   ?     ?   545.33    -125.26      75.814     -125.26      443.234    54.7396      
1 1 1 -19 7  3  o 0 1890    33.4  ?     ?   908.308   -109.034     1026.26    -109.034     159.816    -109.034     
1 1 1 -19 7  2  o 0 624.3   14.8  ?     ?   415.928   176.487      688.605    176.487      270.164    176.487      
1 1 1 -19 7  1  f 1 615.9   16.6  ?     ?   583.614   -3.19703     525.773    -3.19703     65.1333    176.803      
1 1 1 19  7  0  o 0 1197.3  24.6  ?     ?   676.093   101.03       903.715    101.03       232.099    101.03       
1 1 1 19  7  1  f 1 376.5   8     ?     ?   549.5     121.073      305.641    121.073      250.388    -58.9267     
1 1 1 19  7  2  o 0 190.5   5.4   ?     ?   403       -118.238     178.834    -118.238     227.272    61.7622      
1 1 1 19  7  3  o 0 148     4.7   ?     ?   361.718   -89.4812     129.622    -89.4812     216.804    90.5188      
1 1 1 19  7  4  o 0 1633.7  29.1  ?     ?   1151.82   -128.535     667.081    -128.535     436.227    51.4647      
1 1 1 19  7  5  f 1 414.5   11.1  ?     ?   250.109   -15.0911     571.564    -15.0911     330.834    -15.0911     
1 1 1 19  7  6  o 0 198.6   7.2   ?     ?   281.562   64.4541      272.703    64.4541      3.31194    64.4541      
1 1 1 19  7  7  o 0 305.2   9.6   ?     ?   481.728   -170.83      266.064    -170.83      194.204    9.17008      
1 1 1 19  7  8  o 0 1269.9  33.3  ?     ?   855.002   -125.694     738.914    -125.694     65.7895    54.3057      
1 1 1 19  7  9  o 0 2196.6  51.3  ?     ?   782.267   -174.364     1295.91    -174.364     561.508    -174.364     
1 1 1 19  7  10 o 0 213.2   11.2  ?     ?   296.737   -88.8911     289.762    -88.8912     4.54452    -88.8912     
1 1 1 19  7  11 o 0 132.5   12.8  ?     ?   241.482   173.983      180.696    173.983      47.8036    -6.01737     
1 1 1 19  7  12 o 0 42.4    9.2   ?     ?   140.335   -132.279     11.3235    47.7205      143.56     47.7205      
1 1 1 19  7  13 o 0 -15.4   10.1  ?     ?   48.9933   22.5764      40.6011    -157.424     85.5933    -157.424     
1 1 1 19  7  14 f 1 336     13.6  ?     ?   103.718   111.25       544.109    111.25       448.036    111.25       
1 1 1 19  7  15 f 1 83.3    11.5  ?     ?   136.983   -77.9301     139.516    -77.9301     13.354     -77.9301     
1 1 1 19  7  16 o 0 124.6   14.4  ?     ?   337.611   -56.4303     159.339    -56.4303     187.788    123.57       
1 1 1 19  7  17 o 0 223.8   17.6  ?     ?   252.843   -4.26292     432.417    -4.26292     178.687    -4.26292     
1 1 1 19  7  18 o 0 39.5    16    ?     ?   166.637   -146.602     70.463     -146.602     92.7956    33.3979      
1 1 1 19  7  19 o 0 129     17.7  ?     ?   232.581   -47.0682     286.654    -47.0682     66.1395    -47.0682     
1 1 1 19  7  20 o 0 311.3   20    ?     ?   384.273   4.3757       455.111    4.3757       92.3223    4.3757       
1 1 1 19  7  21 o 0 138.6   21.2  ?     ?   230.092   -46.7964     300.953    -46.7964     83.6629    -46.7964     
1 1 1 19  7  22 o 0 28.2    30.4  ?     ?   86.6361   -37.8307     96.5993    -37.8307     7.90762    -37.8307     
1 1 1 19  7  23 o 0 111.3   29.1  ?     ?   114.479   -4.58983     333.962    -4.58983     221.756    -4.58983     
1 1 1 19  7  24 o 0 1.2     30.5  ?     ?   59.4115   0.447418     56.154     0.447418     0.41947    0.447418     
1 1 1 -19 9  24 < 0 -3.1    15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 9  23 o 0 54.1    14.1  ?     ?   145.179   -108.292     165.497    -108.292     38.7511    -108.292     
1 1 1 -19 9  22 o 0 19.1    12.5  ?     ?   10.198    -0.538448    11.1196    -0.538448    1.99554    -0.538448    
1 1 1 -19 9  21 f 1 26.7    11.6  ?     ?   51.3913   32.7077      64.2377    32.7077      14.8547    32.7077      
1 1 1 -19 9  20 o 0 26.3    11.7  ?     ?   202.398   -116.505     1.99349    -116.505     192.093    63.4947      
1 1 1 -19 9  19 o 0 22.4    9.5   ?     ?   311.507   -146.314     95.4997    33.6858      373.473    33.6858      
1 1 1 -19 9  18 o 0 67.6    8.5   ?     ?   336.232   -107.537     48.0161    -107.537     252.304    72.4629      
1 1 1 -19 9  17 o 0 72.7    7     ?     ?   257.286   -98.6458     127.412    -98.6458     103.652    81.3542      
1 1 1 -19 9  16 o 0 509.6   13.4  ?     ?   489.487   -89.4574     565.64     -89.4574     110.843    -89.4574     
1 1 1 -19 9  15 o 0 1149    23.1  ?     ?   660.315   -107.178     926.031    -107.178     296.877    -107.178     
1 1 1 -19 9  14 o 0 30.7    5.6   ?     ?   68.7624   -141.554     19.7609    -141.554     47.4468    38.4459      
1 1 1 -19 9  13 o 0 121     5.5   ?     ?   238.023   54.0812      227.242    54.0812      7.12477    -125.919     
1 1 1 -19 9  12 o 0 27.4    4.3   ?     ?   153.58    44.6537      24.5943    -135.346     159.454    -135.346     
1 1 1 -19 9  11 o 0 52.4    4.1   ?     ?   135.079   -73.5642     56.7049    -73.5642     62.6737    106.436      
1 1 1 -19 9  10 o 0 7.2     3.9   ?     ?   98.2428   -0.429677    70.1495    179.57       156.733    179.57       
1 1 1 -19 9  9  o 0 70.2    4.3   ?     ?   320.113   -140.167     8.9596     -140.167     274.703    39.8325      
1 1 1 -19 9  8  o 0 155.8   4.8   ?     ?   303.888   -34.0616     184.152    -34.0616     92.2253    145.938      
1 1 1 -19 9  7  o 0 29.3    3.1   ?     ?   178.119   76.3583      60.6004    -103.642     223.316    -103.642     
1 1 1 -19 9  6  o 0 828.2   16.4  ?     ?   602.168   -102.987     661.744    -102.987     109.483    -102.987     
1 1 1 -19 9  5  o 0 1275.1  24.1  ?     ?   793.469   -34.5841     789.974    -34.5841     50.9258    -34.5841     
1 1 1 -19 9  4  o 0 23.4    2.7   ?     ?   269.19    101.331      132.825    -78.6691     377.681    -78.6691     
1 1 1 -19 9  3  o 0 1799.5  32.7  ?     ?   1173.24   8.8423       722.286    8.8423       347.5      -171.158     
1 1 1 -19 9  2  o 0 460.6   10.3  ?     ?   656.688   1.20112      284.827    1.20112      315.124    -178.799     
1 1 1 -19 9  1  o 0 1783    32.9  ?     ?   863.229   126.152      993.472    126.152      203.655    126.152      
1 1 1 19  9  0  o 0 289.8   7.5   ?     ?   222.071   -144.01      421.107    -144.01      217.45     -144.01      
1 1 1 19  9  1  o 0 366     17.8  ?     ?   485.16    75.9563      330.864    75.9563      114.457    -104.044     
1 1 1 19  9  2  o 0 881.3   20.1  ?     ?   309.141   90.8642      920.633    90.8642      636.738    90.8642      
1 1 1 19  9  3  o 0 653.8   14.3  ?     ?   605.075   -45.4738     507.499    -45.4738     48.2065    134.526      
1 1 1 19  9  4  o 0 1179.4  22.2  ?     ?   729.201   -57.0108     776.589    -57.0108     107.13     -57.0108     
1 1 1 19  9  5  o 0 323.9   10.1  ?     ?   588.243   -149.426     201.07     -149.426     353.09     30.5743      
1 1 1 19  9  6  o 0 1129.8  24.1  ?     ?   730.006   178.501      771.093    178.501      92.5091    178.501      
1 1 1 19  9  7  o 0 358     10.3  ?     ?   555.748   54.7203      275.738    54.7203      239.918    -125.28      
1 1 1 19  9  8  o 0 332.4   10.5  ?     ?   526.022   57.3544      269.954    57.3544      216.976    -122.646     
1 1 1 19  9  9  o 0 23.3    7.2   ?     ?   174.145   -92.5594     66.543     87.4406      223.935    87.4406      
1 1 1 19  9  10 o 0 115.4   8.1   ?     ?   369.146   16.9558      79.7993    16.9558      252.703    -163.044     
1 1 1 19  9  11 o 0 52.1    9     ?     ?   116.111   44.6133      56.0769    44.6133      49.0115    -135.387     
1 1 1 19  9  12 o 0 94.7    9.6   ?     ?   84.7095   38.9138      137.672    38.9138      61.3429    38.9138      
1 1 1 19  9  13 o 0 228.6   12.8  ?     ?   190.819   -147.673     466.294    -147.673     273.114    -147.673     
1 1 1 19  9  14 o 0 524.4   17.4  ?     ?   348.047   -160.357     727.382    -160.357     383.06     -160.357     
1 1 1 19  9  15 o 0 71.9    12.6  ?     ?   133.26    -131.813     185.14     -131.813     54.086     -131.813     
1 1 1 19  9  16 o 0 165.7   16.8  ?     ?   199.359   98.0394      373.595    98.0394      182.044    98.0394      
1 1 1 19  9  17 o 0 57.2    15.6  ?     ?   241.21    9.71773      93.6906    9.71773      130.752    -170.282     
1 1 1 19  9  18 o 0 66.7    20.1  ?     ?   141.378   -40.5886     184.731    -40.5886     53.6511    -40.5886     
1 1 1 19  9  19 o 0 85.1    22.3  ?     ?   216.153   50.0787      183.693    50.0787      16.9023    -129.921     
1 1 1 19  9  20 o 0 32.7    25.4  ?     ?   133.636   165.83       77.3251    165.83       56.1977    -14.1697     
1 1 1 19  9  21 f 1 -81.5   33.7  ?     ?   46.5782   62.4563      6.85158    -117.544     52.0013    -117.544     
1 1 1 19  9  22 o 0 173.5   31.6  ?     ?   163.545   54.2692      415.233    54.2692      262.198    54.2692      
1 1 1 19  9  23 o 0 44.9    30.5  ?     ?   163.952   178.741      101.807    178.741      48.518     -1.25909     
1 1 1 -19 11 22 < 0 42.7    12.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 11 21 o 0 131.9   13.8  ?     ?   180.048   -144.18      326.829    -144.18      172.72     -144.18      
1 1 1 -19 11 20 o 0 90.7    12.6  ?     ?   208.381   -152.075     213.306    -152.075     31.0461    -152.075     
1 1 1 -19 11 19 o 0 101.5   13.3  ?     ?   145.128   -70.3837     283.278    -70.3837     152.296    -70.3837     
1 1 1 -19 11 18 o 0 33.8    10.7  ?     ?   143.216   -17.7694     85.7099    -17.7694     49.3768    162.231      
1 1 1 -19 11 17 f 1 169.7   11.3  ?     ?   248.435   -95.1206     335.124    -95.1207     99.1301    -95.1207     
1 1 1 -19 11 16 o 0 23.1    8.4   ?     ?   33.0829   -95.5444     26.6908    -95.5444     2.37029    84.4556      
1 1 1 -19 11 15 o 0 40      8.1   ?     ?   111.004   77.6654      108.684    77.6654      11.1971    77.6654      
1 1 1 -19 11 14 o 0 55.5    6.9   ?     ?   159.341   -58.8773     143.006    -58.8773     2.46897    -58.8773     
1 1 1 -19 11 13 o 0 49.5    5.6   ?     ?   149.884   -117.564     120.338    -117.564     16.2607    62.4358      
1 1 1 -19 11 12 o 0 27      5.8   ?     ?   61.5135   79.2575      41.0939    79.2575      15.3657    -100.743     
1 1 1 -19 11 11 o 0 5.2     4.8   ?     ?   94.4184   -82.3421     60.4091    97.6579      149.125    97.6579      
1 1 1 -19 11 10 o 0 123.3   7.7   ?     ?   256.777   -55.8805     212.793    -55.8805     34.2687    124.119      
1 1 1 -19 11 9  o 0 72.4    4.6   ?     ?   118.885   -70.4675     153.021    -70.4675     37.9898    -70.4675     
1 1 1 -19 11 8  o 0 201.6   6.6   ?     ?   366.196   56.4381      269.237    56.4381      86.9062    -123.562     
1 1 1 -19 11 7  o 0 482.6   11.7  ?     ?   522.171   -11.1666     431.733    -11.1666     20.1236    168.833      
1 1 1 -19 11 6  o 0 695.3   14.7  ?     ?   628.374   -70.5117     529.476    -70.5117     16.5318    109.488      
1 1 1 -19 11 5  o 0 618.5   13.2  ?     ?   407.193   -120.374     648.76     -120.374     293.653    -120.374     
1 1 1 -19 11 4  o 0 339.1   8.5   ?     ?   437.838   -73.9098     349.669    -73.9098     30.0397    106.09       
1 1 1 -19 11 3  o 0 14.2    3.5   ?     ?   267.4     -143.818     153.803    36.1823      386.319    36.1823      
1 1 1 -19 11 2  o 0 13      3.5   ?     ?   118.25    87.5612      67.1555    -92.4388     170.204    -92.4388     
1 1 1 -19 11 1  o 0 425.7   10.2  ?     ?   243.955   98.653       578.501    98.653       365.544    98.653       
1 1 1 19  11 0  o 0 1366.7  32.1  ?     ?   654.834   121.359      966.418    121.359      391.031    121.359      
1 1 1 19  11 1  o 0 239.2   7.7   ?     ?   353.877   25.6834      291.511    25.6834      19.5831    -154.317     
1 1 1 19  11 2  o 0 107.1   6.8   ?     ?   349.188   -105.108     75.0782    -105.108     231.917    74.8921      
1 1 1 19  11 3  o 0 132.2   6.4   ?     ?   280.266   85.477       169.182    85.477       77.1321    -94.523      
1 1 1 19  11 4  o 0 104.7   6.6   ?     ?   474.194   102.363      23.326     -77.6366     439.744    -77.6366     
1 1 1 19  11 5  o 0 425.1   11.5  ?     ?   700.908   -172.1       233.389    -172.1       386.732    7.89994      
1 1 1 19  11 6  o 0 46.8    7     ?     ?   205.738   -171.708     21.6873    -171.708     160.023    8.29185      
1 1 1 19  11 7  o 0 273.4   10.1  ?     ?   247.522   -12.1651     418.261    -12.1651     200.13     -12.1651     
1 1 1 19  11 8  o 0 7.8     7.4   ?     ?   56.4093   -122.138     34.6356    57.8622      90.6129    57.8622      
1 1 1 19  11 9  o 0 114.9   9.6   ?     ?   247.642   39.8527      207.082    39.8527      37.8773    -140.147     
1 1 1 19  11 10 o 0 72.6    10.4  ?     ?   261.446   -133.464     106.867    -133.464     146.293    46.5362      
1 1 1 19  11 11 o 0 272.8   12.5  ?     ?   436.143   -129.349     330.55     -129.349     90.0021    50.6508      
1 1 1 19  11 12 o 0 639.3   18.9  ?     ?   352.163   -168.937     823.166    -168.937     490.828    -168.937     
1 1 1 19  11 13 o 0 15.9    11.8  ?     ?   90.5253   112.324      1.54483    -67.6761     86.5321    -67.6761     
1 1 1 19  11 14 o 0 84.6    13.7  ?     ?   284.74    163.265      135.525    163.265      123.666    -16.7351     
1 1 1 19  11 15 o 0 65.9    13.6  ?     ?   288.91    160.369      80.2417    160.369      182.116    -19.6314     
1 1 1 19  11 16 o 0 132.3   16.1  ?     ?   312.427   155.056      214.681    155.056      69.6288    -24.9438     
1 1 1 19  11 17 f 1 40.8    16.9  ?     ?   64.121    -38.903      113.281    -38.903      50.0645    -38.903      
1 1 1 19  11 18 o 0 72.3    18.9  ?     ?   201.327   94.2022      164.921    94.2022      32.5378    -85.7978     
1 1 1 19  11 19 o 0 29.5    23.3  ?     ?   118.788   117.903      73.3709    117.903      38.3151    -62.0975     
1 1 1 19  11 20 o 0 55.2    26    ?     ?   120.316   115.95       159.209    115.95       50.808     115.95       
1 1 1 19  11 21 o 0 64.1    29.2  ?     ?   106.342   163.318      188.202    163.318      93.0237    163.318      
1 1 1 -19 13 19 < 1 10.3    14.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 13 18 f 1 22.6    13.4  ?     ?   121.538   31.3375      59.9698    31.3375      42.3938    -148.663     
1 1 1 -19 13 17 o 0 131.7   13.4  ?     ?   225.709   -171.439     285.353    -171.439     94.8311    -171.439     
1 1 1 -19 13 16 o 0 128.9   11.9  ?     ?   138.989   -162.981     340.991    -162.981     221.03     -162.981     
1 1 1 -19 13 15 f 1 111.6   11    ?     ?   280.777   41.8019      195.364    41.8019      55.5726    -138.198     
1 1 1 -19 13 14 o 0 146.3   9.9   ?     ?   278.182   91.3421      261.544    91.3421      3.47431    91.3421      
1 1 1 -19 13 13 o 0 37.8    8.1   ?     ?   94.7571   -140.227     117.858    -140.227     29.9301    -140.227     
1 1 1 -19 13 12 o 0 26.4    6.8   ?     ?   163.299   135.86       38.2767    135.86       102.327    -44.1402     
1 1 1 -19 13 11 o 0 59.9    7.4   ?     ?   289.645   93.7231      62.287     93.7231      186.614    -86.2769     
1 1 1 -19 13 10 o 0 -9.8    6.1   ?     ?   192.329   136.375      140.559    -43.6247     306.874    -43.6247     
1 1 1 -19 13 9  o 0 134.7   6.2   ?     ?   188.27    132.084      308.365    132.084      145.23     132.084      
1 1 1 -19 13 8  o 0 209.3   7.6   ?     ?   385.077   142.564      285.223    142.564      50.2177    -37.4356     
1 1 1 -19 13 7  o 0 162.1   6.9   ?     ?   184.506   148.792      355.668    148.792      190.047    148.792      
1 1 1 -19 13 6  o 0 34.6    4.8   ?     ?   105.249   -144.254     77.0728    -144.254     17.813     35.746       
1 1 1 -19 13 5  o 0 245.9   8.3   ?     ?   410.498   107.065      311.045    107.065      60.4568    -72.935      
1 1 1 -19 13 4  o 0 142.7   7.1   ?     ?   247.087   21.2235      268.628    21.2235      40.4501    21.2235      
1 1 1 -19 13 3  o 0 119.9   6.2   ?     ?   90.1951   -7.31154     286.048    -7.31154     202.515    -7.31154     
1 1 1 -19 13 2  o 0 17.2    5     ?     ?   100.428   123.775      10.3353    -56.225      103.569    -56.225      
1 1 1 -19 13 1  o 0 76.8    5.1   ?     ?   218.823   -113.823     146.443    -113.823     57.0992    66.1773      
1 1 1 19  13 0  o 0 17.7    5.3   ?     ?   130.218   74.9119      18.0587    -105.088     140.474    -105.088     
1 1 1 19  13 1  o 0 140.1   6.8   ?     ?   274.323   129.258      247.127    129.258      10.7948    -50.7423     
1 1 1 19  13 2  o 0 2.4     5.9   ?     ?   80.7113   44.0774      54.9807    -135.923     130.845    -135.923     
1 1 1 19  13 3  o 0 28.2    6.2   ?     ?   121.429   -54.4509     32.3799    -54.4509     81.6751    125.549      
1 1 1 19  13 4  o 0 131.1   8.4   ?     ?   177.388   76.761       311.061    76.761       147.418    76.761       
1 1 1 19  13 5  o 0 196     9.5   ?     ?   364.997   69.4196      278.937    69.4196      57.2332    -110.58      
1 1 1 19  13 6  o 0 303.5   11.3  ?     ?   408.954   169.716      395.888    169.716      20.0137    169.716      
1 1 1 19  13 7  o 0 89.4    9.5   ?     ?   185.403   -138.53      212.042    -138.53      42.0706    -138.53      
1 1 1 19  13 8  o 0 189.7   10.9  ?     ?   344.34    -52.0637     293.493    -52.0637     13.3978    127.936      
1 1 1 19  13 9  o 0 17.3    10.3  ?     ?   116.646   -99.4902     4.11483    -99.4902     99.4816    80.5098      
1 1 1 19  13 10 o 0 27.4    11.6  ?     ?   226.818   163.345      9.89827    -16.6549     211.295    -16.6549     
1 1 1 19  13 11 o 0 106.7   14.5  ?     ?   213.408   110.603      237.663    110.603      47.3659    110.603      
1 1 1 19  13 12 o 0 128.1   16    ?     ?   238.837   92.2619      259.741    92.2619      47.8208    92.2619      
1 1 1 19  13 13 o 0 -10.5   15.3  ?     ?   156.226   125.563      70.9871    -54.4367     220.648    -54.4367     
1 1 1 19  13 14 o 0 50.4    13.5  ?     ?   225.165   -11.7876     81.3193    -11.7876     134.721    168.212      
1 1 1 19  13 15 f 1 52      17.7  ?     ?   119.782   -88.6453     154.638    -88.6453     43.7197    -88.6453     
1 1 1 19  13 16 o 0 -14.4   19.1  ?     ?   133.206   163.263      30.4282    -16.7368     149.768    -16.7368     
1 1 1 19  13 17 o 0 119.7   27.9  ?     ?   283.328   119.733      202.705    119.733      45.9972    -60.267      
1 1 1 19  13 18 f 1 21.9    31.5  ?     ?   137.48    94.0457      67.3433    94.0457      53.2873    -85.9543     
1 1 1 19  13 19 < 1 49.8    26.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 15 15 < 1 84.1    16.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 15 14 o 0 7.2     11.1  ?     ?   72.3093   -0.766571    21.0474    -0.766571    38.0962    179.233      
1 1 1 -19 15 13 o 0 25.7    10.2  ?     ?   78.3993   95.2094      83.3411    95.2094      18.8534    95.2094      
1 1 1 -19 15 12 o 0 34      10    ?     ?   157.603   135.295      87.1986    135.295      43.4031    -44.7051     
1 1 1 -19 15 11 o 0 39.1    8.3   ?     ?   233.47    36.3013      48.8874    36.3013      148.502    -143.699     
1 1 1 -19 15 10 o 0 92.2    9.6   ?     ?   155.326   134.68       247.273    134.68       112.287    134.68       
1 1 1 -19 15 9  o 0 318.9   12.3  ?     ?   340.617   -159.82      451.818    -159.82      143.657    -159.82      
1 1 1 -19 15 8  o 0 128.1   8.2   ?     ?   191.377   -96.6487     293.948    -96.6487     119.854    -96.6487     
1 1 1 -19 15 7  f 1 280.3   11.2  ?     ?   313.331   -31.7253     430.865    -31.7253     145.072    -31.7253     
1 1 1 -19 15 6  o 0 134.7   8.4   ?     ?   192.828   24.6903      306.387    24.6903      130.614    24.6903      
1 1 1 -19 15 5  o 0 435.2   14.3  ?     ?   307.723   42.4881      623.009    42.4881      341.366    42.4881      
1 1 1 -19 15 4  o 0 78.9    7.1   ?     ?   235.229   137.912      158.34     137.912      50.3313    -42.0879     
1 1 1 -19 15 3  o 0 390.3   13.2  ?     ?   511.395   37.228       393.063    37.228       40.9937    -142.772     
1 1 1 -19 15 2  o 0 24.2    7.7   ?     ?   161.029   -6.43877     28.6575    -6.43877     108.379    173.561      
1 1 1 -19 15 1  o 0 218.2   10.2  ?     ?   409.983   -132.735     265.99     -132.735     83.6638    47.2651      
1 1 1 19  15 0  o 0 49.3    7.9   ?     ?   141.854   -153.844     133.836    -153.844     11.1006    -153.844     
1 1 1 19  15 1  o 0 38.3    8.1   ?     ?   178.436   -172.258     75.5297    -172.258     78.8317    7.74192      
1 1 1 19  15 2  o 0 46.7    8.5   ?     ?   116.716   -116.02      134.918    -116.02      34.0093    -116.02      
1 1 1 19  15 3  o 0 20      8.1   ?     ?   115.216   22.5926      24.5575    22.5926      74.9513    -157.407     
1 1 1 19  15 4  o 0 194.7   11.8  ?     ?   136.077   -165.73      460.924    -165.73      333.535    -165.73      
1 1 1 19  15 5  o 0 22.4    11.3  ?     ?   101.105   -154.752     43.9022    -154.752     50.5646    25.2484      
1 1 1 19  15 6  o 0 37      12    ?     ?   186.508   48.899       58.7928    48.899       115.054    -131.101     
1 1 1 19  15 7  f 1 14.5    10.8  ?     ?   25.1683   -67.3213     12.2979    -67.3213     11.3916    112.679      
1 1 1 19  15 8  o 0 16.2    13.8  ?     ?   127.984   145.464      14.6828    145.464      104.767    -34.5356     
1 1 1 19  15 9  o 0 24.5    17.5  ?     ?   103.94    25.9939      58.6843    25.9939      34.7034    -154.006     
1 1 1 19  15 10 o 0 15.4    17.2  ?     ?   66.3873   136.538      37.1982    136.538      22.1954    -43.4618     
1 1 1 19  15 11 o 0 104.7   24.9  ?     ?   106.254   164.911      296.563    164.911      203.925    164.911      
1 1 1 19  15 12 o 0 114.3   24.1  ?     ?   284.112   1.52805      193.146    1.52805      50.0592    -178.472     
1 1 1 19  15 13 o 0 1.3     19.1  ?     ?   48.0312   96.674       34.0806    96.674       6.89388    -83.326      
1 1 1 19  15 14 o 0 52      25.8  ?     ?   24.9424   126.685      112.489    126.685      91.3419    126.685      
1 1 1 19  15 15 < 1 19.5    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 17 9  < 0 20.9    11.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 17 8  < 0 25.9    11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 17 7  < 0 3.5     9.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -19 17 6  o 0 34.3    11.2  ?     ?   86.5388   -66.313      123.493    -66.313      53.8809    -66.313      
1 1 1 -19 17 5  o 0 21.3    10.4  ?     ?   77.6033   -9.39709     72.8764    -9.39709     10.186     -9.39709     
1 1 1 -19 17 4  o 0 50.6    11.3  ?     ?   207.54    65.4346      106.962    65.4346      61.3301    -114.565     
1 1 1 -19 17 3  o 0 25.8    10.4  ?     ?   82.1478   17.7805      82.3514    17.7805      15.6678    17.7805      
1 1 1 -19 17 2  o 0 44.9    10.9  ?     ?   82.7523   -133.529     157.924    -133.529     90.5588    -133.529     
1 1 1 -19 17 1  o 0 42.3    11.3  ?     ?   101.53    -166.762     143.957    -166.762     61.1072    -166.762     
1 1 1 19  17 0  o 0 202.8   13.7  ?     ?   339.892   -105.599     310.697    -105.599     28.307     -105.599     
1 1 1 19  17 1  o 0 80.3    14.4  ?     ?   154.527   -88.7991     221.463    -88.7991     93.1356    -88.7991     
1 1 1 19  17 2  o 0 225.8   16.4  ?     ?   276.368   -66.7111     392.581    -66.7111     163.272    -66.7111     
1 1 1 19  17 3  o 0 31.5    15.4  ?     ?   85.5954   -61.637      100.25     -61.637      29.3241    -61.637      
1 1 1 19  17 4  o 0 135.8   15.9  ?     ?   213.116   -53.5894     296.701    -53.5894     120.025    -53.5894     
1 1 1 19  17 5  o 0 44.2    12.9  ?     ?   197.768   65.8884      93.172     65.8884      70.4164    -114.112     
1 1 1 19  17 6  o 0 93.4    16.2  ?     ?   243.261   63.182       185.421    63.182       15.2589    -116.818     
1 1 1 19  17 7  < 0 9.9     15.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 19  17 8  < 0 31.1    17.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 0  28 < 0 30.4    20.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 0  27 o 0 30.6    20.8  ?     ?   195.669   180          99.6208    180          79.9436    8.74379e-15  
1 1 1 -20 0  26 o 0 17.1    18.2  ?     ?   124.575   180          60.7054    180          56.4776    7.54197e-15  
1 1 1 -20 0  25 o 0 162.9   19.3  ?     ?   346.142   0            304.548    0            43.4524    180          
1 1 1 -20 0  24 o 0 6.1     18    ?     ?   205.567   0            49.5737    0            150.692    180          
1 1 1 -20 0  23 f 1 213.7   18.2  ?     ?   366.255   0            341.804    0            0.854655   180          
1 1 1 -20 0  22 o 0 -2      12.9  ?     ?   122.367   0            16.676     0            97.9308    180          
1 1 1 -20 0  21 o 0 -4.8    12.6  ?     ?   172.849   0            18.2207    0            149.392    180          
1 1 1 -20 0  20 o 0 8.6     9.5   ?     ?   119.97    0            20.0169    0            99.3765    180          
1 1 1 -20 0  19 o 0 17.2    7.7   ?     ?   223.526   0            57.9344    0            170.438    180          
1 1 1 -20 0  18 o 0 145.2   10.8  ?     ?   358.119   180          261.934    180          64.7799    2.83717e-14  
1 1 1 -20 0  17 o 0 2127.9  76.4  ?     ?   709.195   0            1015.2     0            368.848    0            
1 1 1 -20 0  16 f 1 41.2    11.6  ?     ?   92.1704   0            38.3747    0            48.4835    180          
1 1 1 -20 0  15 o 0 670.4   19.2  ?     ?   573.218   0            578.76     0            31.1575    0            
1 1 1 -20 0  14 o 0 299.9   10.6  ?     ?   1.61904   0            5.32336    0            3.8079     0            
1 1 1 -20 0  13 o 0 204     7.6   ?     ?   501.414   180          314.248    180          164.001    1.34449e-14  
1 1 1 -20 0  12 f 1 136.1   7.1   ?     ?   2.35516   0            3.75181    0            1.48223    0            
1 1 1 -20 0  11 o 0 208     9.8   ?     ?   360.019   0            334.757    0            30.3203    180          
1 1 1 -20 0  10 o 0 246.1   7.8   ?     ?   479.039   180          368.687    180          113.233    2.28465e-14  
1 1 1 -20 0  9  o 0 2310.7  56.7  ?     ?   1397.65   180          1134.05    180          276.887    2.87385e-14  
1 1 1 -20 0  8  o 0 323.7   9.2   ?     ?   304.528   180          423.609    180          115.293    180          
1 1 1 -20 0  7  o 0 1717.2  42.6  ?     ?   951.429   0            1005.31    0            26.1378    0            
1 1 1 -20 0  6  o 0 37.4    2     ?     ?   210.946   0            88.3107    0            129.185    180          
1 1 1 -20 0  5  f 1 7.1     1.5   ?     ?   69.095    180          6.12639    180          65.5822    6.55469e-16  
1 1 1 -20 0  4  o 0 2334.2  56.2  ?     ?   1254.67   180          1087.29    180          110.681    6.89292e-14  
1 1 1 -20 0  3  o 0 34.1    1.9   ?     ?   49.2016   0            19.8892    0            27.1362    180          
1 1 1 -20 0  2  o 0 3572.7  84.5  ?     ?   1407.72   0            1347.68    0            0.772536   0            
1 1 1 -20 0  1  o 0 3222.1  78    ?     ?   1196.39   0            1281.6     0            135.372    0            
1 1 1 20  0  0  o 0 2.4     1.3   ?     ?   110.425   180          2.31558    180          103.653    -3.07548e-14 
1 1 1 20  0  1  o 0 8.4     1.7   ?     ?   88.1535   0            8.57222    0            76.1888    180          
1 1 1 20  0  2  o 0 382.1   11.4  ?     ?   472.982   0            444.019    0            11.7114    180          
1 1 1 20  0  3  o 0 307.7   10    ?     ?   574.155   180          399.255    180          155.071    1.80657e-14  
1 1 1 20  0  4  o 0 18.5    2.7   ?     ?   40.9579   180          9.74385    180          33.1388    2.06313e-15  
1 1 1 20  0  5  f 1 3266.2  79.1  ?     ?   1266.83   180          1411.64    180          76.8407    180          
1 1 1 20  0  6  o 0 57.5    4.2   ?     ?   126.671   180          87.8453    180          45.0172    1.36922e-14  
1 1 1 20  0  7  o 0 501.2   20.9  ?     ?   554.987   0            553.293    0            33.8443    180          
1 1 1 20  0  8  o 0 336.8   10.6  ?     ?   369.609   180          442.72     180          60.7711    180          
1 1 1 20  0  9  o 0 28      6     ?     ?   135.294   180          45.6627    180          93.9471    3.41045e-15  
1 1 1 20  0  10 o 0 7.7     8.2   ?     ?   139.818   180          9.78836    180          134.188    5.11835e-16  
1 1 1 20  0  11 o 0 1328.6  36.1  ?     ?   487.032   0            830.994    0            350.199    0            
1 1 1 20  0  12 f 1 504.1   18    ?     ?   836.65    0            510.118    0            317.33     180          
1 1 1 20  0  13 o 0 1196.9  33.8  ?     ?   557.754   180          783.064    180          236.376    180          
1 1 1 20  0  14 o 0 212.4   21.4  ?     ?   222.384   180          302.27     180          88.0765    180          
1 1 1 20  0  15 o 0 -31.7   18    ?     ?   139.556   180          4.00953    180          131.717    2.13592e-16  
1 1 1 20  0  16 f 1 -7.8    14.7  ?     ?   126.146   0            5.17352    0            117.482    180          
1 1 1 20  0  17 o 0 62.6    20.4  ?     ?   293.313   0            143.589    0            132.624    180          
1 1 1 20  0  18 o 0 155.8   22.6  ?     ?   275.05    0            275.45     0            15.8025    0            
1 1 1 20  0  19 o 0 12.4    20.6  ?     ?   78.798    180          18.6836    180          64.7433    2.02488e-15  
1 1 1 20  0  20 o 0 -10.2   25    ?     ?   63.2858   180          11.8077    180          53.5583    1.54694e-15  
1 1 1 20  0  21 o 0 11.6    27.9  ?     ?   23.3782   0            9.59994    0            13.9652    180          
1 1 1 20  0  22 o 0 17.6    31.9  ?     ?   103.463   180          51.154     180          49.7368    7.21665e-15  
1 1 1 20  0  23 f 1 755.3   47.7  ?     ?   498.488   0            668.775    0            182.395    0            
1 1 1 20  0  24 o 0 48.4    37.5  ?     ?   142.39    0            123.038    0            27.0124    180          
1 1 1 20  0  25 o 0 -44.7   39.9  ?     ?   211.788   0            54.3767    0            168.457    180          
1 1 1 20  0  26 o 0 31      40.5  ?     ?   147.12    0            99.5484    0            45.5457    180          
1 1 1 -20 2  28 < 0 158.5   19.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 2  27 o 0 72.8    13.5  ?     ?   299.776   -143.359     105.828    -143.359     167.536    36.6413      
1 1 1 -20 2  26 o 0 168.5   13.7  ?     ?   262.17    -146.901     347.365    -146.901     102.774    -146.901     
1 1 1 -20 2  25 o 0 105.8   12.2  ?     ?   230.946   -175.556     235.409    -175.556     5.0465     -175.556     
1 1 1 -20 2  24 o 0 65.3    12.3  ?     ?   244.665   105.864      117.164    105.864      127.782    -74.1362     
1 1 1 -20 2  23 o 0 17.9    8.5   ?     ?   136.858   24.1275      0.714527   24.1275      125.76     -155.873     
1 1 1 -20 2  22 o 0 131.9   9.3   ?     ?   211.416   91.1128      307.597    91.1128      110.933    91.1128      
1 1 1 -20 2  21 f 1 131.7   8.8   ?     ?   264.807   -37.9658     257.499    -37.9658     1.05373    -37.9658     
1 1 1 -20 2  20 o 0 46.4    6.7   ?     ?   212.898   -57.4719     63.9       -57.4719     146.693    122.528      
1 1 1 -20 2  19 o 0 124.1   7     ?     ?   330.8     -82.7392     164.008    -82.7392     172.049    97.2608      
1 1 1 -20 2  18 o 0 203.1   7.6   ?     ?   306.938   140.129      290.239    140.129      11.692     140.129      
1 1 1 -20 2  17 o 0 93.6    5.4   ?     ?   289.383   -3.77238     87.1565    -3.77238     175.307    176.228      
1 1 1 -20 2  16 o 0 21.3    4.8   ?     ?   242.753   4.91388      126.752    -175.086     353.339    -175.086     
1 1 1 -20 2  15 o 0 321.2   8.4   ?     ?   83.8927   -173.272     399.766    -173.272     320.895    -173.272     
1 1 1 -20 2  14 o 0 567.9   12.1  ?     ?   546.357   -160.507     490.243    -160.507     19.3814    19.493       
1 1 1 -20 2  13 o 0 461.2   11.4  ?     ?   544.022   -44.9228     391.736    -44.9228     118.872    135.077      
1 1 1 -20 2  12 o 0 1612.6  33.4  ?     ?   857.648   -96.9762     929.306    -96.9762     109.049    -96.9762     
1 1 1 -20 2  11 o 0 2097.4  46.3  ?     ?   1002.95   -134.991     1048.29    -134.991     84.0886    -134.991     
1 1 1 -20 2  10 o 0 11.1    2.4   ?     ?   48.1306   -151.206     34.7491    28.7941      83.108     28.7941      
1 1 1 -20 2  9  o 0 133.8   4     ?     ?   359.132   71.026       118.499    71.026       243.821    -108.974     
1 1 1 -20 2  8  o 0 76.6    2.5   ?     ?   253.056   1.80121      56.6831    1.80121      199.531    -178.199     
1 1 1 -20 2  7  o 0 205.5   4.8   ?     ?   79.3673   50.0371      282.931    50.0371      200.479    50.0371      
1 1 1 -20 2  6  o 0 196.9   4.5   ?     ?   247.073   56.104       325.901    56.104       70.7995    56.104       
1 1 1 -20 2  5  o 0 1057.6  19.1  ?     ?   682.439   -6.81217     846.738    -6.81217     140.676    -6.81217     
1 1 1 -20 2  3  o 0 306.3   8.4   ?     ?   379.005   1.71713      399.985    1.71713      6.67681    1.71713      
1 1 1 -20 2  2  f 1 705.9   13    ?     ?   593.71    76.4684      593.688    76.4684      20.9813    76.4684      
1 1 1 -20 2  1  o 0 194.2   4.1   ?     ?   336.72    1.93873      240.52     1.93873      82.9843    -178.061     
1 1 1 20  2  0  o 0 642.4   12.3  ?     ?   502.367   86.2702      619.667    86.2702      139.301    86.2702      
1 1 1 20  2  1  o 0 852     16    ?     ?   714.379   -14.0902     604.644    -14.0902     80.0243    165.91       
1 1 1 20  2  2  f 1 487.8   9.6   ?     ?   480.742   35.0594      491.397    35.0594      27.185     35.0594      
1 1 1 20  2  3  o 0 312.3   6.5   ?     ?   398.812   -114.235     392.896    -114.235     22.7944    65.7648      
1 1 1 20  2  4  o 0 191.7   4.7   ?     ?   477.748   96.9155      132.545    96.9155      366.33     -83.0845     
1 1 1 20  2  5  o 0 722.4   14.2  ?     ?   666.457   -48.9862     593.289    -48.9862     103.528    131.014      
1 1 1 20  2  6  o 0 86.5    4.6   ?     ?   368.757   -77.3735     3.49832    -77.3735     382.294    102.627      
1 1 1 20  2  7  o 0 7.3     3     ?     ?   307.944   122.842      265.918    -57.1583     583.57     -57.1583     
1 1 1 20  2  8  o 0 1433.8  30.6  ?     ?   809.425   3.83064      962.733    3.83064      128.471    3.83064      
1 1 1 20  2  9  o 0 900.6   21.5  ?     ?   851.852   -25.9148     541.183    -25.9148     335.471    154.085      
1 1 1 20  2  10 o 0 2717.7  48.5  ?     ?   886.409   -89.1918     1567.37    -89.1918     657.154    -89.1918     
1 1 1 20  2  11 o 0 2417.4  44.3  ?     ?   1074.63   -121.112     1157.6     -121.112     99.8487    -121.112     
1 1 1 20  2  12 o 0 659.3   15.6  ?     ?   688.259   -120.82      456.871    -120.82      218.249    59.1796      
1 1 1 20  2  13 o 0 373.8   13.7  ?     ?   329.717   -5.08078     483.097    -5.08078     165.168    -5.08078     
1 1 1 20  2  14 o 0 2830.5  54    ?     ?   1148.24   158.012      1267.51    158.012      165.373    158.012      
1 1 1 20  2  15 o 0 162.2   15.5  ?     ?   324.247   -149.478     193.397    -149.478     120.807    30.5217      
1 1 1 20  2  16 o 0 390.2   15.5  ?     ?   323.656   47.9472      516.202    47.9472      204.315    47.9472      
1 1 1 20  2  17 o 0 80      14.7  ?     ?   109.182   -84.5317     93.4781    -84.5317     8.92059    95.4683      
1 1 1 20  2  18 o 0 304.5   15.7  ?     ?   399.73    -49.0042     369.898    -49.0042     5.83       130.996      
1 1 1 20  2  19 o 0 63.5    15.7  ?     ?   167.899   128.706      127.386    128.706      49.5729    -51.2941     
1 1 1 20  2  20 o 0 78.5    18.9  ?     ?   112.646   -85.9122     211.701    -85.9122     95.9054    -85.9122     
1 1 1 20  2  21 f 1 64.5    18.9  ?     ?   191.382   27.43        148.929    27.43        44.0049    -152.57      
1 1 1 20  2  22 o 0 324.1   22.4  ?     ?   329.104   72.8793      537.405    72.8792      218.168    72.8792      
1 1 1 20  2  23 o 0 215.5   28.5  ?     ?   288.277   112.734      399.257    112.734      118.524    112.734      
1 1 1 20  2  24 o 0 109     26.6  ?     ?   119.722   84.3817      329.284    84.3817      203.848    84.3817      
1 1 1 20  2  25 < 0 -159.1  35.3  ?     ?   ?         ?            75.3811    -26.1742     ?          ?            
1 1 1 -20 4  27 < 0 123.5   15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 4  26 o 0 8.1     13.2  ?     ?   116.769   -96.9429     6.88467    -96.9429     98.8905    83.0571      
1 1 1 -20 4  25 o 0 -20     10.8  ?     ?   89.3982   26.9926      54.5424    -153.007     139.344    -153.007     
1 1 1 -20 4  24 o 0 108     10.2  ?     ?   88.0854   -83.9166     342.49     -83.9166     255.022    -83.9166     
1 1 1 -20 4  23 o 0 55      10.7  ?     ?   74.4156   -143.4       167.362    -143.4       99.0436    -143.4       
1 1 1 -20 4  22 f 1 25.6    8.1   ?     ?   99.5572   31.0421      54.2419    31.0421      37.8088    -148.958     
1 1 1 -20 4  21 o 0 162.7   8.8   ?     ?   286.292   38.887       306.831    38.887       41.7602    38.887       
1 1 1 -20 4  20 o 0 63.9    7.6   ?     ?   166.109   126.196      164.315    126.196      5.0307     126.196      
1 1 1 -20 4  19 o 0 25.8    6.3   ?     ?   98.7261   -26.1678     26.8411    -26.1678     70.3485    153.832      
1 1 1 -20 4  18 o 0 142.6   7.1   ?     ?   306.444   -59.2666     223.378    -59.2666     86.4295    120.733      
1 1 1 -20 4  17 o 0 -7.6    5.7   ?     ?   139.199   -26.2429     116.456    153.757      242.162    153.757      
1 1 1 -20 4  16 o 0 1474.5  27.9  ?     ?   801.977   123.815      928.267    123.815      204.483    123.815      
1 1 1 -20 4  15 o 0 507.3   14.3  ?     ?   311.931   70.1788      628.193    70.1788      338.482    70.1788      
1 1 1 -20 4  14 o 0 232.7   9.3   ?     ?   103.596   53.7549      320.756    53.7549      223.846    53.7549      
1 1 1 -20 4  13 o 0 696.3   17.8  ?     ?   518.419   17.1223      622.51     17.1223      141.365    17.1223      
1 1 1 -20 4  12 o 0 1132.4  23.8  ?     ?   806.051   -39.6437     690.911    -39.6437     61.853     140.356      
1 1 1 -20 4  11 o 0 1656.2  28.7  ?     ?   818.294   -109.868     984.822    -109.868     206.092    -109.868     
1 1 1 -20 4  10 o 0 2325.8  40.2  ?     ?   1378.22   -30.985      797.532    -30.985      520.937    149.015      
1 1 1 -20 4  9  o 0 371.2   7.6   ?     ?   479.727   104.364      367.866    104.364      117.597    -75.6358     
1 1 1 -20 4  8  o 0 412.9   9     ?     ?   350.069   -164.5       538.742    -164.5       187.233    -164.5       
1 1 1 -20 4  7  o 0 694.3   13.1  ?     ?   611.801   -52.46       589.341    -52.46       27.2588    127.54       
1 1 1 -20 4  6  f 1 1367.5  25.9  ?     ?   994.142   -24.2954     715.951    -24.2954     294.376    155.705      
1 1 1 -20 4  5  o 0 972     17.4  ?     ?   762.937   -23.3342     675.645    -23.3342     97.8465    156.666      
1 1 1 -20 4  4  o 0 725.8   15.2  ?     ?   655.171   -141.424     593.825    -141.424     87.1975    38.5762      
1 1 1 -20 4  3  f 1 47.5    4.5   ?     ?   157.391   120.983      5.94543    120.983      158.799    -59.0173     
1 1 1 -20 4  2  o 0 453.2   15.9  ?     ?   371.859   13.3758      589.546    13.3758      205.092    13.3758      
1 1 1 -20 4  1  o 0 637.7   17.5  ?     ?   426.262   74.1794      736.151    74.1794      294.956    74.1794      
1 1 1 20  4  0  o 0 283.6   6.3   ?     ?   490.844   85.8568      264.226    85.8568      240.749    -94.1432     
1 1 1 20  4  1  o 0 1186.6  24.3  ?     ?   704.31    -134.569     915.686    -134.569     189.617    -134.569     
1 1 1 20  4  2  o 0 145.1   4.4   ?     ?   152.752   -45.3973     247.271    -45.3973     89.5013    -45.3973     
1 1 1 20  4  3  f 1 476.4   9.5   ?     ?   407.211   166.252      581.636    166.252      154.512    166.252      
1 1 1 20  4  4  o 0 80.2    3.4   ?     ?   110.56    -134.802     91.6049    -134.802     23.9075    45.1981      
1 1 1 20  4  5  o 0 645     12.3  ?     ?   405.842   154.717      743.582    154.717      328.792    154.717      
1 1 1 20  4  6  f 1 534.4   10.9  ?     ?   413.662   -178.111     625.775    -178.111     200.777    -178.111     
1 1 1 20  4  7  o 0 118.8   4.7   ?     ?   408.787   -118.768     45.7318    -118.768     371.882    61.2318      
1 1 1 20  4  8  o 0 686.7   15.7  ?     ?   762.759   -58.4545     442.964    -58.4545     335.332    121.546      
1 1 1 20  4  9  o 0 226     7.4   ?     ?   387.367   -154.511     242.628    -154.511     136.625    25.4887      
1 1 1 20  4  10 o 0 292.4   8.6   ?     ?   514.031   129.133      226.689    129.133      275.324    -50.8666     
1 1 1 20  4  11 o 0 1769.7  33.6  ?     ?   882.864   -130.584     1008.12    -130.584     148.568    -130.584     
1 1 1 20  4  12 o 0 822.8   19.1  ?     ?   715.842   27.7511      568.485    27.7511      116.844    -152.249     
1 1 1 20  4  13 o 0 779.5   19.4  ?     ?   600.424   -59.2749     635.681    -59.2749     63.2907    -59.2749     
1 1 1 20  4  14 o 0 129.7   15.5  ?     ?   216.44    -31.9043     187.146    -31.9043     21.2202    148.096      
1 1 1 20  4  15 o 0 79.7    11.6  ?     ?   265.45    -91.8136     49.7286    -91.8136     204.467    88.1864      
1 1 1 20  4  16 o 0 379.7   15.3  ?     ?   493.98    144.699      376.884    144.699      83.6193    -35.3015     
1 1 1 20  4  17 o 0 372.2   16.1  ?     ?   406.362   -9.25388     445.085    -9.25388     65.3353    -9.25388     
1 1 1 20  4  18 o 0 10.8    13.2  ?     ?   81.2756   -72.6413     36.1655    107.359      121.348    107.359      
1 1 1 20  4  19 o 0 114.3   16.3  ?     ?   282.889   -25.1662     200.992    -25.1662     88.2346    154.834      
1 1 1 20  4  20 o 0 220.7   19.4  ?     ?   286.537   -49.5421     412.655    -49.5421     126.775    -49.5421     
1 1 1 20  4  21 o 0 42.3    17.9  ?     ?   138.253   61.0114      103.647    61.0114      29.7811    -118.989     
1 1 1 20  4  22 f 1 206.6   25.6  ?     ?   431.43    81.4222      253.982    81.4222      162.583    -98.5778     
1 1 1 20  4  23 o 0 73.7    22    ?     ?   151.277   130.7        218        130.7        60.2678    130.7        
1 1 1 20  4  24 o 0 -31.3   25.7  ?     ?   33.4833   -157.211     0.455576   22.7888      35.3075    22.7888      
1 1 1 20  4  25 o 0 67      30.4  ?     ?   170.459   56.9864      159.761    56.9864      6.51816    -123.014     
1 1 1 20  4  26 o 0 48.7    27.6  ?     ?   218.883   62.5961      72.3442    62.5961      136.306    -117.404     
1 1 1 20  4  27 < 0 -3.9    27.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 6  26 < 0 16      12.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 6  25 o 0 92.6    12.9  ?     ?   211.333   -64.4274     227.832    -64.4274     38.7572    -64.4274     
1 1 1 -20 6  24 f 1 12.2    10.9  ?     ?   78.378    -154.04      14.4229    -154.04      59.3798    25.9601      
1 1 1 -20 6  23 o 0 68.3    11.3  ?     ?   176.894   125.232      181.748    125.232      8.28852    125.232      
1 1 1 -20 6  22 f 1 -4.7    8.9   ?     ?   146.491   152.411      89.8743    -27.5888     229.814    -27.5888     
1 1 1 -20 6  21 o 0 331.9   12.4  ?     ?   300.214   156.537      538.667    156.537      266.008    156.537      
1 1 1 -20 6  20 o 0 144.5   8.6   ?     ?   226.191   77.4583      316.358    77.4583      109.606    77.4583      
1 1 1 -20 6  19 o 0 9       7.8   ?     ?   42.6865   95.5291      13.8138    -84.4709     54.2199    -84.4709     
1 1 1 -20 6  18 o 0 9.1     6.3   ?     ?   59.2826   105.087      28.0769    -74.9134     85.6801    -74.9134     
1 1 1 -20 6  17 o 0 19.3    5.7   ?     ?   62.2668   -72.2712     10.2495    107.729      72.3768    107.729      
1 1 1 -20 6  16 o 0 212.7   7.6   ?     ?   372.408   -79.2253     250.179    -79.2253     81.697     100.775      
1 1 1 -20 6  15 o 0 933.4   18.9  ?     ?   690.471   -13.9169     673.371    -13.9169     58.5008    -13.9169     
1 1 1 -20 6  14 f 1 1644.2  35.3  ?     ?   678.274   -61.0436     1119.42    -61.0436     507.721    -61.0436     
1 1 1 -20 6  13 o 0 650.4   16.5  ?     ?   364.856   -45.7631     716.796    -45.7631     380.098    -45.7631     
1 1 1 -20 6  12 o 0 311     7.7   ?     ?   245.515   -69.9828     451.913    -69.9828     223.847    -69.9828     
1 1 1 -20 6  11 o 0 382.6   8.3   ?     ?   534.394   5.25743      309.888    5.25743      182.333    -174.743     
1 1 1 -20 6  10 o 0 1433.6  25.6  ?     ?   872.96    175.755      808.068    175.755      0.536931   -4.24537     
1 1 1 -20 6  9  o 0 65.9    3.9   ?     ?   262.295   -75.9454     12.2727    -75.9454     235.158    104.055      
1 1 1 -20 6  8  o 0 1392.9  26.8  ?     ?   787.186   -67.0702     861.424    -67.0702     115.402    -67.0702     
1 1 1 -20 6  7  o 0 1002.3  18.6  ?     ?   452.596   -4.69018     914.386    -4.69018     483.684    -4.69018     
1 1 1 -20 6  6  o 0 602.4   11.5  ?     ?   523.286   -23.147      542.545    -23.147      42.7683    -23.147      
1 1 1 -20 6  5  o 0 561.3   10.8  ?     ?   566.407   77.008       501.23     77.008       63.2735    -102.992     
1 1 1 -20 6  4  o 0 904     16.8  ?     ?   607.86    -68.3945     761.755    -68.3945     154.349    -68.3945     
1 1 1 -20 6  3  o 0 2347.6  41.4  ?     ?   1157.83   -51.2415     1090.28    -51.2415     69.1668    128.759      
1 1 1 -20 6  2  o 0 2347.8  57    ?     ?   998.496   -131.395     1248.23    -131.395     246.651    -131.395     
1 1 1 -20 6  1  o 0 928.4   27.7  ?     ?   616.334   -137.058     776.134    -137.058     157.127    -137.058     
1 1 1 20  6  0  f 1 331.1   7.1   ?     ?   174.057   -152.508     539.727    -152.508     364.628    -152.508     
1 1 1 20  6  1  o 0 1448.9  26.3  ?     ?   801.263   -171.037     953.823    -171.037     150.622    -171.037     
1 1 1 20  6  2  o 0 477.2   9.5   ?     ?   461.842   -124.121     513.96     -124.121     50.4055    -124.121     
1 1 1 20  6  3  o 0 1037.7  19.2  ?     ?   746.479   97.9294      734.185    97.9294      15.7578    -82.0706     
1 1 1 20  6  4  o 0 1573.2  28.1  ?     ?   794.496   43.514       1038.17    43.514       239.588    43.514       
1 1 1 20  6  5  o 0 198.3   6.4   ?     ?   304.428   -87.1926     273.36     -87.1926     36.3331    92.8074      
1 1 1 20  6  6  o 0 40.3    4.7   ?     ?   206.14    144.042      39.1438    -35.9576     238.224    -35.9576     
1 1 1 20  6  7  o 0 540.2   16.4  ?     ?   383.127   -87.7205     609.417    -87.7205     239.812    -87.7205     
1 1 1 20  6  8  o 0 362.1   11.2  ?     ?   321.378   -114.142     468.426    -114.142     158.906    -114.142     
1 1 1 20  6  9  o 0 2388.8  60.5  ?     ?   1029.54   -120.082     1170.38    -120.082     193.942    -120.082     
1 1 1 20  6  10 o 0 74.4    7.3   ?     ?   202.431   22.2343      57.4177    22.2343      134.03     -157.766     
1 1 1 20  6  11 o 0 306.8   9.7   ?     ?   238.311   -90.3019     447.832    -90.3019     223.218    -90.3019     
1 1 1 20  6  12 o 0 447.4   14.2  ?     ?   405.417   -21.208      511.122    -21.208      124.923    -21.208      
1 1 1 20  6  13 o 0 819     18.9  ?     ?   544.388   -138.258     727.557    -138.258     211.303    -138.258     
1 1 1 20  6  14 f 1 547.8   16.4  ?     ?   628.821   -177.285     430.493    -177.285     153.468    2.7151       
1 1 1 20  6  15 o 0 242.4   13.5  ?     ?   317.663   -153.441     346.611    -153.441     52.182     -153.441     
1 1 1 20  6  16 o 0 296.5   14.5  ?     ?   274.145   -86.6044     449.186    -86.6044     196.618    -86.6044     
1 1 1 20  6  17 o 0 167.9   13.7  ?     ?   140.636   94.2718      389.24     94.2718      243.893    94.2718      
1 1 1 20  6  18 o 0 636.1   20.7  ?     ?   555.488   139.502      656.763    139.502      96.6019    139.502      
1 1 1 20  6  19 o 0 113     16.1  ?     ?   197.504   -67.5194     273.911    -67.5194     79.5166    -67.5194     
1 1 1 20  6  20 o 0 141.5   20    ?     ?   336.482   -107.951     224.867    -107.951     95.5519    72.0487      
1 1 1 20  6  21 o 0 98.5    20    ?     ?   344.338   -76.4617     118.489    -76.4617     207.94     103.538      
1 1 1 20  6  22 f 1 162.7   25.8  ?     ?   309.753   -148.37      281.746    -148.37      38.6718    31.6305      
1 1 1 20  6  23 o 0 110.4   22.4  ?     ?   195.586   -93.1088     275.189    -93.1088     74.2235    -93.1088     
1 1 1 20  6  24 f 1 31.4    32.2  ?     ?   220.435   -38.1914     23.0678    -38.1914     190.317    141.809      
1 1 1 20  6  25 o 0 -34.8   26.5  ?     ?   76.353    -67.6264     5.90049    -67.6264     65.9639    112.374      
1 1 1 -20 8  25 < 0 8.9     10.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 8  24 o 0 43.6    15    ?     ?   94.0335   147.829      160.542    147.829      77.9433    147.829      
1 1 1 -20 8  23 o 0 -2.5    12    ?     ?   33.0645   140.009      4.48687    -39.9907     34.194     -39.9907     
1 1 1 -20 8  22 o 0 153.4   13    ?     ?   251.175   120.533      313.617    120.533      80.5238    120.533      
1 1 1 -20 8  21 o 0 103.9   10.8  ?     ?   356.582   115.496      112.828    115.496      230.778    -64.5043     
1 1 1 -20 8  20 o 0 41.5    9     ?     ?   150.721   148.514      106.484    148.514      28.7138    -31.4864     
1 1 1 -20 8  19 o 0 1.8     7.8   ?     ?   151.85    -141.262     81.0737    38.7383      217.461    38.7383      
1 1 1 -20 8  18 o 0 6.3     6.7   ?     ?   75.0161   -134.842     30.298     45.1584      98.0682    45.1584      
1 1 1 -20 8  17 o 0 4.2     6.2   ?     ?   39.9893   -171.198     22.0715    8.80175      59.4607    8.80175      
1 1 1 -20 8  16 o 0 207     8.1   ?     ?   358.68    170.074      299.288    170.074      44.7467    -9.92626     
1 1 1 -20 8  15 o 0 7.8     5     ?     ?   70.0553   -164.341     45.6231    15.6595      114.578    15.6595      
1 1 1 -20 8  14 o 0 37.2    5     ?     ?   198.471   90.2652      7.04826    -89.7348     181.416    -89.7348     
1 1 1 -20 8  13 o 0 317.1   8.5   ?     ?   339.3     -144.851     410.85     -144.851     110.568    -144.851     
1 1 1 -20 8  12 o 0 414.2   10    ?     ?   274.888   151.953      555.643    151.953      312.823    151.953      
1 1 1 -20 8  11 o 0 618     14.7  ?     ?   358.549   82.7007      696.443    82.7007      377.701    82.7007      
1 1 1 -20 8  10 o 0 134     4.5   ?     ?   235.329   -147.128     180.312    -147.128     34.6004    32.8724      
1 1 1 -20 8  9  o 0 2133.5  37.5  ?     ?   1142.95   -130.766     940.077    -130.766     109.333    49.2341      
1 1 1 -20 8  8  o 0 2682.9  47.3  ?     ?   1036.08   -104.342     1274.52    -104.342     306.999    -104.342     
1 1 1 -20 8  7  o 0 357.4   7.9   ?     ?   324.559   168.485      442.841    168.485      146.429    168.485      
1 1 1 -20 8  6  o 0 298.1   7     ?     ?   412.559   -133.229     308.752    -133.229     69.4888    46.7711      
1 1 1 -20 8  5  f 1 26.7    2.7   ?     ?   296.483   70.3514      139.186    -109.649     413.325    -109.649     
1 1 1 -20 8  4  o 0 1884.2  34.8  ?     ?   893.778   -87.0471     1025.45    -87.0471     200.901    -87.0471     
1 1 1 -20 8  3  o 0 1027.9  19.1  ?     ?   620.758   -81.145      772.756    -81.145      191.139    -81.145      
1 1 1 -20 8  2  o 0 277.2   6.7   ?     ?   508.335   35.1445      203.213    35.1445      273.975    -144.856     
1 1 1 -20 8  1  o 0 49.9    2.8   ?     ?   192.733   108.481      3.35365    -71.5192     184.537    -71.5192     
1 1 1 20  8  0  o 0 426     9.4   ?     ?   561.73    87.6402      331.141    87.6402      197.226    -92.3598     
1 1 1 20  8  1  o 0 814.3   16.2  ?     ?   534.173   168.017      699.225    168.017      196.223    168.017      
1 1 1 20  8  2  o 0 20.6    3.3   ?     ?   313.003   10.3482      177.336    -169.652     472.296    -169.652     
1 1 1 20  8  3  o 0 1045.6  19.6  ?     ?   672.43    -88.8619     743.365    -88.8619     109.475    -88.8619     
1 1 1 20  8  4  o 0 285.2   9.1   ?     ?   94.0297   -110.771     366.888    -110.771     279.409    -110.771     
1 1 1 20  8  5  f 1 642.2   15.2  ?     ?   674.651   10.036       439.965    10.036       190.563    -169.964     
1 1 1 20  8  6  o 0 322.7   9.1   ?     ?   575.577   43.5816      207.773    43.5816      326.848    -136.418     
1 1 1 20  8  7  o 0 692     15.1  ?     ?   538.007   -65.7127     601.992    -65.7127     103.049    -65.7127     
1 1 1 20  8  8  o 0 907.9   19.5  ?     ?   419.461   -57.6067     892.689    -57.6067     498.792    -57.6067     
1 1 1 20  8  9  o 0 177.3   8.7   ?     ?   224.254   89.2097      268.72     89.2097      58.6872    89.2097      
1 1 1 20  8  10 o 0 260.7   10.7  ?     ?   443.636   -21.7856     248.293    -21.7856     165.894    158.214      
1 1 1 20  8  11 o 0 261.8   11.1  ?     ?   290.784   -89.41       377.681    -89.41       112.838    -89.41       
1 1 1 20  8  12 o 0 43.1    9.6   ?     ?   132.837   -128.937     7.02057    -128.937     113.455    51.0634      
1 1 1 20  8  13 o 0 345.6   14.6  ?     ?   508.272   134.771      318.136    134.771      144.669    -45.2287     
1 1 1 20  8  14 o 0 670.2   20.4  ?     ?   598.953   88.0287      629.99     88.0287      17.4375    88.0287      
1 1 1 20  8  15 o 0 17.3    12.5  ?     ?   204.937   27.2065      84.2887    -152.794     292.676    -152.794     
1 1 1 20  8  16 o 0 60.5    13.5  ?     ?   127.8     -51.5916     152.178    -51.5916     25.2896    -51.5916     
1 1 1 20  8  17 o 0 194.7   18.7  ?     ?   306.696   -13.0802     340.099    -13.0802     42.6777    -13.0802     
1 1 1 20  8  18 o 0 142.5   18.3  ?     ?   323.7     -54.9529     235.569    -54.9529     68.3404    125.047      
1 1 1 20  8  19 o 0 156.1   23.1  ?     ?   192.29    74.1726      362.504    74.1726      182.664    74.1726      
1 1 1 20  8  20 o 0 -40.8   25.7  ?     ?   57.7517   63.0531      15.8475    -116.947     69.8964    -116.947     
1 1 1 20  8  21 o 0 114.1   23.7  ?     ?   143.879   -27.5431     321.757    -27.5431     175.732    -27.5431     
1 1 1 20  8  22 o 0 214.8   29.7  ?     ?   280.429   71.4991      401.763    71.4991      129.169    71.4991      
1 1 1 20  8  23 o 0 69.1    27.6  ?     ?   140.908   60.7859      184.875    60.7859      52.0017    60.7859      
1 1 1 -20 10 23 < 0 28.7    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 10 22 o 0 87.7    13    ?     ?   153.821   -169.783     255.123    -169.783     122.336    -169.783     
1 1 1 -20 10 21 o 0 29.9    11.6  ?     ?   119.759   -103.939     84.5259    -103.939     21.1559    76.0614      
1 1 1 -20 10 20 o 0 84.1    12.4  ?     ?   244.156   -106.017     167.363    -106.017     55.0419    73.9828      
1 1 1 -20 10 19 o 0 106.6   10.3  ?     ?   208.09    -87.4159     247.324    -87.4159     49.1483    -87.4159     
1 1 1 -20 10 18 o 0 91.6    9.3   ?     ?   239.793   -103.718     191.894    -103.718     29.1757    76.2822      
1 1 1 -20 10 17 o 0 528.7   13.8  ?     ?   558.344   -84.0635     518.015    -84.0635     26.7241    -84.0635     
1 1 1 -20 10 16 o 0 281.3   10.4  ?     ?   374.672   -65.4561     401.221    -65.4561     69.8473    -65.4561     
1 1 1 -20 10 15 o 0 311.3   9.5   ?     ?   324.321   -75.5598     486.413    -75.5598     197.142    -75.5598     
1 1 1 -20 10 14 o 0 9.9     6.4   ?     ?   80.354    -78.8978     26.5312    101.102      100.619    101.102      
1 1 1 -20 10 13 o 0 45.8    5.5   ?     ?   132.692   106.862      98.4719    106.862      26.8887    -73.1376     
1 1 1 -20 10 12 o 0 175.9   7.7   ?     ?   252.05    -88.2422     318.424    -88.2422     74.3601    -88.2422     
1 1 1 -20 10 11 f 1 313.6   8.3   ?     ?   500.626   -123.208     309.604    -123.208     180.851    56.7925      
1 1 1 -20 10 10 o 0 112.5   5.2   ?     ?   230.426   -153.686     172.172    -153.686     27.9464    26.3142      
1 1 1 -20 10 9  o 0 394.2   9.7   ?     ?   316.268   74.172       508.117    74.172       231.915    74.172       
1 1 1 -20 10 8  o 0 64.1    3.9   ?     ?   152.577   -93.0843     59.0646    -93.0843     73.6977    86.9157      
1 1 1 -20 10 7  o 0 227.2   6.3   ?     ?   592.221   -55.951      87.724     -55.951      429.948    124.049      
1 1 1 -20 10 6  o 0 4.4     3.1   ?     ?   48.5396   -143.342     37.3886    36.6583      79.9912    36.6583      
1 1 1 -20 10 5  o 0 138.9   5     ?     ?   169.689   167.16       221.958    167.16       72.4912    167.16       
1 1 1 -20 10 4  o 0 90.8    3.8   ?     ?   346.547   47.8966      26.0125    47.8966      286.694    -132.103     
1 1 1 -20 10 3  f 1 115.5   4.3   ?     ?   354.825   176.044      72.5525    176.044      250.107    -3.95569     
1 1 1 -20 10 2  o 0 385.8   9.1   ?     ?   421.166   128.498      409.459    128.498      27.6231    128.498      
1 1 1 -20 10 1  o 0 324.9   8.2   ?     ?   214.277   59.262       471.682    59.262       277.094    59.262       
1 1 1 20  10 0  o 0 431.7   11.2  ?     ?   239.872   -89.6462     583.981    -89.6462     365.075    -89.6462     
1 1 1 20  10 1  o 0 1103.1  22.3  ?     ?   533.337   169.304      908.748    169.304      421.688    169.304      
1 1 1 20  10 2  o 0 1334.3  26.1  ?     ?   519.903   -85.9695     1063.62    -85.9695     588.686    -85.9695     
1 1 1 20  10 3  f 1 790.9   18.9  ?     ?   760.621   -31.6244     489.948    -31.6244     208.378    148.376      
1 1 1 20  10 4  o 0 191.9   7.7   ?     ?   265.048   11.32        267.711    11.32        25.7498    11.32        
1 1 1 20  10 5  o 0 18.3    5.9   ?     ?   296.144   153.164      157.053    -26.8359     421.502    -26.8359     
1 1 1 20  10 6  o 0 886.4   18.6  ?     ?   682.878   120.4        647.302    120.4        38.4181    120.4        
1 1 1 20  10 7  o 0 552     13.7  ?     ?   444.224   89.7828      572.647    89.7828      177.341    89.7828      
1 1 1 20  10 8  o 0 80.8    8.7   ?     ?   117.148   -46.3266     126.89     -46.3266     21.9893    -46.3266     
1 1 1 20  10 9  o 0 139.4   8.5   ?     ?   288.066   -89.7001     193.188    -89.7001     63.993     90.2999      
1 1 1 20  10 10 o 0 15.9    8     ?     ?   166.855   -135.284     78.2788    44.7161      226.725    44.7161      
1 1 1 20  10 11 f 1 858.9   21.3  ?     ?   591.864   163.124      783.872    163.124      188.656    163.124      
1 1 1 20  10 12 o 0 67.7    10.6  ?     ?   173.507   112.153      156.363    112.153      13.4369    -67.8472     
1 1 1 20  10 13 o 0 57.4    11.7  ?     ?   238.779   82.1322      79.2427    82.1322      153.269    -97.8678     
1 1 1 20  10 14 o 0 102.1   12.2  ?     ?   58.8291   -46.7563     247.762    -46.7563     191.743    -46.7563     
1 1 1 20  10 15 o 0 92.2    16.2  ?     ?   157.584   55.8164      248.92     55.8164      103.47     55.8164      
1 1 1 20  10 16 o 0 86.7    18    ?     ?   278.342   88.5538      142.727    88.5538      113.492    -91.4462     
1 1 1 20  10 17 o 0 -7.8    18.6  ?     ?   73.9049   -81.4932     13.181     98.5068      81.3349    98.5068      
1 1 1 20  10 18 o 0 31.7    18.4  ?     ?   199.444   -167.326     25.1727    -167.326     173.015    12.6737      
1 1 1 20  10 19 o 0 50      24.6  ?     ?   139.741   115.308      129.74     115.308      9.07247    -64.692      
1 1 1 20  10 20 o 0 157.9   26.2  ?     ?   329.131   172.625      252.042    172.625      61.2935    -7.37457     
1 1 1 20  10 21 o 0 128     29.2  ?     ?   270.726   140.74       233.177    140.74       16.9974    -39.2602     
1 1 1 20  10 22 o 0 104.4   32    ?     ?   226.738   -175.974     200.266    -175.974     5.11232    4.0259       
1 1 1 -20 12 21 < 0 54.4    17.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 12 20 o 0 165.8   16    ?     ?   245.215   -54.511      329.122    -54.511      122.994    -54.511      
1 1 1 -20 12 19 o 0 5.2     13    ?     ?   153.469   -18.5419     23.0891    161.458      153.157    161.458      
1 1 1 -20 12 18 o 0 52      11.1  ?     ?   158.071   11.3658      146.019    11.3658      8.91939    11.3658      
1 1 1 -20 12 17 o 0 139.6   10.9  ?     ?   315.967   -177.793     224.492    -177.793     58.0734    2.20707      
1 1 1 -20 12 16 o 0 21.9    9.2   ?     ?   43.2702   -69.7283     42.1791    -69.7283     1.76977    -69.7283     
1 1 1 -20 12 15 o 0 227.2   10.4  ?     ?   352.119   51.677       335.683    51.677       6.47031    51.677       
1 1 1 -20 12 14 f 1 92.3    7.8   ?     ?   50.6277   147.734      231.207    147.734      187.02     147.734      
1 1 1 -20 12 13 o 0 86.4    6.7   ?     ?   151.156   -113.513     228.226    -113.513     97.1119    -113.513     
1 1 1 -20 12 12 o 0 127.5   7.1   ?     ?   191.55    -159.559     293.37     -159.559     126.647    -159.559     
1 1 1 -20 12 11 o 0 25.2    6     ?     ?   108.697   82.9868      48.1726    82.9868      47.0727    -97.0132     
1 1 1 -20 12 10 o 0 359.6   9.7   ?     ?   428.785   -74.7471     441.867    -74.7471     54.147     -74.7471     
1 1 1 -20 12 9  o 0 131.5   5.5   ?     ?   248.876   86.2406      256.879    86.2406      30.5437    86.2406      
1 1 1 -20 12 8  o 0 718.6   17.2  ?     ?   618.965   82.8798      620.843    82.8798      45.3615    82.8798      
1 1 1 -20 12 7  o 0 63.5    4.8   ?     ?   104.248   91.7624      154.509    91.7624      57.1223    91.7624      
1 1 1 -20 12 6  o 0 84.4    5     ?     ?   233.384   -15.7402     139.672    -15.7402     83.1741    164.26       
1 1 1 -20 12 5  o 0 137.6   7.1   ?     ?   325.333   6.52015      186.448    6.52015      125.372    -173.48      
1 1 1 -20 12 4  o 0 635.4   17.1  ?     ?   458.079   -76.8429     690.545    -76.8429     250.043    -76.8429     
1 1 1 -20 12 3  o 0 108.5   6.2   ?     ?   272.32    -73.8783     169.703    -73.8783     92.9062    106.122      
1 1 1 -20 12 2  o 0 115.8   5.5   ?     ?   324.696   -17.3469     143.761    -17.3469     170.09     162.653      
1 1 1 -20 12 1  o 0 148.1   5.9   ?     ?   250.294   -136.208     269.102    -136.208     26.7115    -136.208     
1 1 1 20  12 0  o 0 228.2   8.3   ?     ?   373.398   95.0419      306.553    95.0419      58.3895    -84.9581     
1 1 1 20  12 1  o 0 485.9   11.8  ?     ?   390.866   45.0652      615.576    45.0652      233.431    45.0652      
1 1 1 20  12 2  o 0 278.5   8.7   ?     ?   361.582   44.702       391.103    44.702       37.6156    44.702       
1 1 1 20  12 3  o 0 387.3   10.2  ?     ?   295.184   148.11       587.55     148.11       299.12     148.11       
1 1 1 20  12 4  o 0 31.2    6.1   ?     ?   120.02    136.751      20.8218    136.751      96.3413    -43.2494     
1 1 1 20  12 5  o 0 67      6.8   ?     ?   120.898   -118.598     138.688    -118.598     20.834     -118.598     
1 1 1 20  12 6  o 0 84.8    7.8   ?     ?   202.833   78.1596      182.161    78.1596      11.7503    -101.84      
1 1 1 20  12 7  o 0 77.8    8.1   ?     ?   118.168   -126.455     199.4      -126.455     86.6931    -126.455     
1 1 1 20  12 8  o 0 302.2   11.7  ?     ?   437.78    152.343      364.914    152.343      51.4565    -27.6568     
1 1 1 20  12 9  o 0 274.1   12.9  ?     ?   239.498   137.482      504.67     137.482      281.428    137.482      
1 1 1 20  12 10 o 0 26.9    11.3  ?     ?   84.2309   162.948      40.0339    162.948      38.1823    -17.0522     
1 1 1 20  12 11 o 0 67.1    11.2  ?     ?   143.041   -68.3034     187.136    -68.3034     58.1693    -68.3034     
1 1 1 20  12 12 o 0 55.8    11.7  ?     ?   218.503   18.0993      105.679    18.0993      91.1261    -161.901     
1 1 1 20  12 13 o 0 49.5    14.1  ?     ?   239.651   -40.4883     67.6051    -40.4883     147.117    139.512      
1 1 1 20  12 14 f 1 21.5    10.9  ?     ?   44.1516   -162.2       27.7129    -162.2       12.1686    17.8005      
1 1 1 20  12 15 o 0 190.5   18.4  ?     ?   292.064   -176.189     338.203    -176.189     55.0498    -176.189     
1 1 1 20  12 16 o 0 145.5   21.4  ?     ?   212.886   147.032      321.256    147.032      114.699    147.032      
1 1 1 20  12 17 o 0 190.4   27.5  ?     ?   255.429   105.819      369.077    105.819      131.29     105.819      
1 1 1 20  12 18 o 0 108.3   24.6  ?     ?   221.033   90.7316      235.69     90.7316      35.7386    90.7316      
1 1 1 20  12 19 o 0 79.1    29.6  ?     ?   232.658   111.559      136.713    111.559      69.3473    -68.4413     
1 1 1 -20 14 17 < 0 83.1    13.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 14 16 o 0 28.5    12.2  ?     ?   205.88    64.7583      25.829     64.7583      144.326    -115.242     
1 1 1 -20 14 15 o 0 139.6   12.3  ?     ?   205.209   -44.4169     312.045    -44.4169     141.331    -44.4169     
1 1 1 -20 14 14 f 1 25.3    9.6   ?     ?   65.4091   -8.26399     72.6581    -8.26399     16.7795    -8.26399     
1 1 1 -20 14 13 o 0 25.5    10.2  ?     ?   59.1534   51.7818      65.5058    51.7818      13.7553    51.7818      
1 1 1 -20 14 12 o 0 3       8.3   ?     ?   16.6925   6.58855      4.41681    -173.411     19.6408    -173.411     
1 1 1 -20 14 11 o 0 10.4    6.9   ?     ?   92.0679   61.1655      7.05413    -118.834     91.6021    -118.834     
1 1 1 -20 14 10 o 0 29.9    7.1   ?     ?   129.836   -175.08      73.936     -175.08      45.1669    4.91998      
1 1 1 -20 14 9  o 0 67.3    7     ?     ?   118.994   -103.45      202.446    -103.45      96.3972    -103.45      
1 1 1 -20 14 8  o 0 243.6   9.3   ?     ?   234.731   -56.7178     441.646    -56.7178     241.022    -56.7178     
1 1 1 -20 14 7  o 0 317.9   9.9   ?     ?   406.576   -33.0858     404.213    -33.0858     58.0243    -33.0858     
1 1 1 -20 14 6  o 0 58.1    5.9   ?     ?   148.655   -57.0831     152.827    -57.0831     25.685     -57.0831     
1 1 1 -20 14 5  o 0 165.3   7.5   ?     ?   261.23    85.1432      307.169    85.1432      82.8517    85.1432      
1 1 1 -20 14 4  o 0 226.6   8.3   ?     ?   212.241   165.599      440.15     165.599      257.259    165.599      
1 1 1 -20 14 3  o 0 103.1   7.7   ?     ?   130.491   68.8807      273.081    68.8807      160.717    68.8807      
1 1 1 -20 14 2  o 0 55.7    6.2   ?     ?   195.708   -53.6219     119.269    -53.6219     49.6844    126.378      
1 1 1 -20 14 1  o 0 139.9   7.1   ?     ?   348.683   -147.907     196.743    -147.907     104.907    32.0934      
1 1 1 20  14 0  o 0 127.5   7.6   ?     ?   324.168   106.388      195.207    106.388      88.9757    -73.6124     
1 1 1 20  14 1  o 0 180.5   7.5   ?     ?   245.494   173.583      352.571    173.583      137.354    173.583      
1 1 1 20  14 2  o 0 150.6   8.7   ?     ?   298.136   -28.0739     259.463    -28.0739     1.79574    151.926      
1 1 1 20  14 3  o 0 138.1   8.9   ?     ?   243.775   7.6808       277.957    7.6808       64.5151    7.6808       
1 1 1 20  14 4  o 0 158.2   9.5   ?     ?   246.645   18.2427      312.164    18.2427      95.6742    18.2427      
1 1 1 20  14 5  o 0 91.8    8.7   ?     ?   151.483   -98.6637     242.45     -98.6637     109.719    -98.6637     
1 1 1 20  14 6  o 0 109.7   10.6  ?     ?   331.748   -176.498     150.046    -176.498     139.997    3.50233      
1 1 1 20  14 7  o 0 31.7    10.3  ?     ?   54.1267   -114.836     66.9761    -114.836     19.3661    -114.836     
1 1 1 20  14 8  o 0 37.1    12.2  ?     ?   194.832   -10.0107     53.7248    -10.0107     117.113    169.989      
1 1 1 20  14 9  o 0 10.9    11.8  ?     ?   109.099   -13.8569     5.38523    166.143      108.858    166.143      
1 1 1 20  14 10 o 0 86.7    14.3  ?     ?   177.163   143.669      220.056    143.669      52.7146    143.669      
1 1 1 20  14 11 o 0 128.5   16.7  ?     ?   150.553   -62.6673     333.069    -62.6673     190.447    -62.6673     
1 1 1 20  14 12 o 0 135.9   19    ?     ?   298.64    -43.7554     228.825    -43.7554     43.1858    136.245      
1 1 1 20  14 13 o 0 39.6    19.3  ?     ?   80.8644   -143.388     111.034    -143.388     37.7843    -143.388     
1 1 1 20  14 14 f 1 5.6     20.3  ?     ?   92.1291   113.927      24.444     113.927      57.1999    -66.0726     
1 1 1 20  14 15 o 0 14      13.7  ?     ?   112.673   121.652      29.2744    121.652      68.1398    -58.348      
1 1 1 20  14 16 o 0 29      31.1  ?     ?   46.8446   141.524      101.711    141.524      61.3988    141.524      
1 1 1 20  14 17 < 0 194.1   27.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 16 12 < 0 49.4    16.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 16 11 < 0 0.7     9.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -20 16 10 o 0 5.3     10.4  ?     ?   139.919   69.4303      17.6104    -110.57      131.242    -110.57      
1 1 1 -20 16 9  o 0 145.8   10.9  ?     ?   137.924   -175.736     363.796    -175.736     251.351    -175.736     
1 1 1 -20 16 8  o 0 18.3    9.4   ?     ?   77.3907   -20.1941     49.9942    -20.1941     13.4549    159.806      
1 1 1 -20 16 7  o 0 12.7    8     ?     ?   121.546   81.068       2.68743    81.068       98.7996    -98.932      
1 1 1 -20 16 6  o 0 34.7    8.3   ?     ?   104.433   99.613       114.25     99.613       26.6448    99.613       
1 1 1 -20 16 5  f 1 8.6     8.4   ?     ?   108.898   92.5352      16.6536    -87.4648     110.823    -87.4648     
1 1 1 -20 16 4  o 0 321.5   12.8  ?     ?   365.657   100.295      439.684    100.295      123.929    100.295      
1 1 1 -20 16 3  f 1 198.1   12    ?     ?   298.843   83.6081      328.201    83.6081      67.9721    83.6081      
1 1 1 -20 16 2  o 0 18.1    9.3   ?     ?   174.748   164.756      7.22809    -15.2438     159.04     -15.2438     
1 1 1 -20 16 1  o 0 270.5   12.5  ?     ?   412.057   -169.108     338.664    -169.108     20.14      10.8918      
1 1 1 20  16 0  o 0 27.9    9.5   ?     ?   169.917   -147.153     42.0578    -147.153     108.452    32.8468      
1 1 1 20  16 1  o 0 -10.7   10.5  ?     ?   59.1559   -132.871     27.7187    47.1294      80.1035    47.1294      
1 1 1 20  16 2  o 0 98.1    10.4  ?     ?   255.411   -32.4442     187.579    -32.4442     38.4381    147.556      
1 1 1 20  16 3  f 1 198.2   17.5  ?     ?   242.824   -69.5778     378.561    -69.5778     162.826    -69.5778     
1 1 1 20  16 4  o 0 38.5    14.9  ?     ?   111.798   -7.98703     111.857    -7.98703     13.1963    -7.98703     
1 1 1 20  16 5  f 1 58.9    11.7  ?     ?   265.537   90.5936      76.1139    90.5936      158.944    -89.4064     
1 1 1 20  16 6  o 0 128.9   16.7  ?     ?   270.806   60.8823      238.996    60.8823      6.0565     60.8823      
1 1 1 20  16 7  o 0 5.4     11.8  ?     ?   120.345   -73.6948     14.748     106.305      117.959    106.305      
1 1 1 20  16 8  o 0 -4.4    16.3  ?     ?   174.337   158.878      45.0798    -21.1224     192.143    -21.1224     
1 1 1 20  16 9  o 0 116.3   19.5  ?     ?   261.001   107.911      220.202    107.911      0.887561   107.911      
1 1 1 20  16 10 o 0 119     19.7  ?     ?   211.848   144.787      262.929    144.787      85.2929    144.787      
1 1 1 20  16 11 < 0 26.7    23.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 20  16 12 < 0 5.6     23.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 1  28 < 0 -1.4    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 1  27 o 0 1.7     13.9  ?     ?   119.261   -160.808     1.33171    19.192       110.255    19.192       
1 1 1 -21 1  26 o 0 -4.5    12.4  ?     ?   16.5372   115.518      2.60183    -64.4816     18.0521    -64.4816     
1 1 1 -21 1  25 o 0 126.8   12.8  ?     ?   218.197   -13.1187     293.921    -13.1187     75.9983    -13.1187     
1 1 1 -21 1  24 o 0 165.2   13.1  ?     ?   241.453   56.2792      353.561    56.2792      111.558    56.2792      
1 1 1 -21 1  23 o 0 3.3     10    ?     ?   114.805   38.5283      46.6291    -141.472     152.827    -141.472     
1 1 1 -21 1  22 o 0 151     10.5  ?     ?   291.635   163.841      281.247    163.841      9.74122    163.841      
1 1 1 -21 1  21 o 0 67.1    7.1   ?     ?   144.239   160.687      186.378    160.687      47.3179    160.687      
1 1 1 -21 1  20 o 0 133.1   9     ?     ?   238.796   -163.099     274.423    -163.099     38.1004    -163.099     
1 1 1 -21 1  19 o 0 224.2   12    ?     ?   232.121   155.098      432.569    155.098      196.69     155.098      
1 1 1 -21 1  18 o 0 732.1   18.6  ?     ?   438.299   98.4215      744.566    98.4215      346.766    98.4215      
1 1 1 -21 1  17 o 0 413.4   10.5  ?     ?   617.916   15.4635      300.03     15.4635      260.351    -164.536     
1 1 1 -21 1  16 o 0 36.8    5.2   ?     ?   307.928   9.19619      105.864    -170.804     393.198    -170.804     
1 1 1 -21 1  15 o 0 536.2   11.9  ?     ?   267.362   35.0807      692.881    35.0807      441.655    35.0807      
1 1 1 -21 1  14 o 0 357.3   9.3   ?     ?   331.903   -132.409     446.602    -132.409     137.253    -132.409     
1 1 1 -21 1  13 o 0 1348.8  39.4  ?     ?   697.007   -143.479     925.935    -143.479     272.412    -143.479     
1 1 1 -21 1  12 o 0 1253.8  31.5  ?     ?   746.828   148.529      820.653    148.529      107.313    148.529      
1 1 1 -21 1  11 o 0 1204.8  25    ?     ?   797.45    -169.523     747.17     -169.523     18.258     10.4774      
1 1 1 -21 1  10 o 0 214.1   5.9   ?     ?   336.285   -100.305     281.098    -100.305     56.1449    79.6945      
1 1 1 -21 1  9  o 0 272.3   6.5   ?     ?   182.987   -98.807      459.949    -98.807      275.743    -98.807      
1 1 1 -21 1  8  o 0 628.9   11.9  ?     ?   553.686   114.366      585.299    114.366      26.1161    114.366      
1 1 1 -21 1  7  o 0 698.5   13.1  ?     ?   396.937   13.8503      811.642    13.8503      400.444    13.8503      
1 1 1 -21 1  6  o 0 1514.4  26.4  ?     ?   922.483   -42.7947     914.464    -42.7947     35.0128    137.205      
1 1 1 -21 1  5  o 0 815.7   14.7  ?     ?   600.641   -87.8657     730.976    -87.8657     111.65     -87.8657     
1 1 1 -21 1  3  o 0 249.7   5     ?     ?   435.273   42.5537      265.798    42.5537      184.242    -137.446     
1 1 1 -21 1  2  o 0 680.2   12.3  ?     ?   445.826   36.1006      701.311    36.1006      275.018    36.1006      
1 1 1 -21 1  1  o 0 830.3   15.3  ?     ?   603.243   10.0391      687.903    10.0391      110.356    10.0391      
1 1 1 21  1  0  o 0 288.2   6.3   ?     ?   365.342   6.36226      355.461    6.36226      6.27028    6.36226      
1 1 1 21  1  1  o 0 250.8   5.6   ?     ?   495.624   -27.6153     196.433    -27.6153     278.296    152.385      
1 1 1 21  1  2  o 0 295.8   6.8   ?     ?   181.161   128.68       472.897    128.68       298.987    128.68       
1 1 1 21  1  3  o 0 932.3   17.3  ?     ?   753.238   113.762      684.31     113.762      100.175    -66.2378     
1 1 1 21  1  4  o 0 268.6   5.9   ?     ?   336.688   65.9156      382.851    65.9156      31.5676    65.9156      
1 1 1 21  1  5  o 0 119.7   3.6   ?     ?   270.213   -75.3372     159.745    -75.3372     122.546    104.663      
1 1 1 21  1  6  o 0 39.4    2.6   ?     ?   203.964   17.0135      40.0325    -162.987     253.259    -162.987     
1 1 1 21  1  7  o 0 113.5   4.1   ?     ?   264.377   54.1004      145.928    54.1004      126.605    -125.9       
1 1 1 21  1  8  o 0 81.5    4.5   ?     ?   176.542   -101.487     100.433    -101.487     81.4306    78.5127      
1 1 1 21  1  9  o 0 768.5   15.2  ?     ?   561.426   -92.8956     716.043    -92.8956     138.491    -92.8956     
1 1 1 21  1  10 o 0 1156.9  22.2  ?     ?   711.823   -130.129     870.747    -130.129     139.97     -130.129     
1 1 1 21  1  11 o 0 485.8   12.7  ?     ?   637.808   -164.673     340.129    -164.673     287.635    15.3265      
1 1 1 21  1  12 o 0 432.3   12.1  ?     ?   446.499   -105.042     454.842    -105.042     16.8086    -105.042     
1 1 1 21  1  13 o 0 491.2   15.1  ?     ?   314.444   57.4505      622.616    57.4505      319.318    57.4505      
1 1 1 21  1  14 o 0 1962.4  40.2  ?     ?   1065.98   154.75       945.853    154.75       77.8522    -25.2499     
1 1 1 21  1  15 o 0 978.9   24.2  ?     ?   521.858   -39.7595     886.446    -39.7595     380.401    -39.7595     
1 1 1 21  1  16 o 0 725.4   21.3  ?     ?   721.962   47.4836      501.991    47.4836      194.336    -132.516     
1 1 1 21  1  17 o 0 354.8   17.1  ?     ?   495.749   14.1762      348.227    14.1762      117.224    -165.824     
1 1 1 21  1  18 o 0 553.2   19.7  ?     ?   475.515   -17.3177     579.702    -17.3177     132.172    -17.3177     
1 1 1 21  1  19 o 0 9.4     18.8  ?     ?   110.949   2.27757      40.646     -177.722     157.753    -177.722     
1 1 1 21  1  20 o 0 87.3    18.5  ?     ?   110.952   44.2911      237.561    44.2911      123.318    44.2911      
1 1 1 21  1  21 o 0 101.1   21.4  ?     ?   218.507   58.1202      230.498    58.1202      10.9388    58.1202      
1 1 1 21  1  22 o 0 90.7    21.1  ?     ?   180.58    107.415      238.7      107.415      63.1744    107.415      
1 1 1 21  1  23 o 0 35.7    23.9  ?     ?   64.5158   161.553      88.7913    161.553      25.8223    161.553      
1 1 1 21  1  24 o 0 -13.8   25.1  ?     ?   30.189    -129.292     4.14919    -129.292     27.5579    50.7078      
1 1 1 21  1  25 o 0 -30.2   28.6  ?     ?   222.259   82.3789      93.2708    -97.6211     318.48     -97.6211     
1 1 1 21  1  26 o 0 132.8   26.3  ?     ?   312.57    78.9657      227.212    78.9657      79.9859    -101.034     
1 1 1 21  1  27 o 0 51.6    24.6  ?     ?   159.749   40.6014      134.606    40.6014      19.1855    -139.399     
1 1 1 -21 3  27 o 0 38.9    13.2  ?     ?   191.642   -132.562     81.441     -132.562     91.3846    47.4381      
1 1 1 -21 3  26 o 0 33.3    13.4  ?     ?   7.95721   5.46928      24.092     5.46928      16.8446    5.46928      
1 1 1 -21 3  25 o 0 76.1    11.1  ?     ?   210.338   125.025      184.472    125.025      16.1116    -54.9754     
1 1 1 -21 3  24 o 0 51.6    9.3   ?     ?   149.168   -126.921     151.534    -126.921     3.75446    -126.921     
1 1 1 -21 3  23 f 1 51.1    10.2  ?     ?   189.433   13.0759      116.268    13.0759      59.4162    -166.924     
1 1 1 -21 3  22 f 1 297.6   10.9  ?     ?   324.517   -27.8429     481.235    -27.8429     179.725    -27.8429     
1 1 1 -21 3  21 o 0 219.7   10.1  ?     ?   380.122   -88.2507     314.116    -88.2507     48.5162    91.7493      
1 1 1 -21 3  20 o 0 188.1   8.2   ?     ?   282.906   -80.1517     339.898    -80.1517     62.7524    -80.1517     
1 1 1 -21 3  19 o 0 31.4    6.3   ?     ?   195.257   -88.3763     6.56974    91.6237      203.06     91.6237      
1 1 1 -21 3  18 o 0 220.1   7.9   ?     ?   278.687   36.7488      332.73     36.7488      82.1513    36.7488      
1 1 1 -21 3  17 o 0 78.8    5.9   ?     ?   88.4606   -138.361     78.1404    -138.361     1.36937    41.6391      
1 1 1 -21 3  16 o 0 448.9   10.9  ?     ?   413.073   -172.226     506.702    -172.226     132.482    -172.226     
1 1 1 -21 3  15 o 0 49.7    4.8   ?     ?   247.232   79.7039      27.1801    -100.296     257.63     -100.296     
1 1 1 -21 3  14 o 0 32.5    3.9   ?     ?   73.2944   7.40881      17.7198    -172.591     87.3484    -172.591     
1 1 1 -21 3  13 f 1 3419    58.6  ?     ?   1167.42   -80.6652     1436.23    -80.6652     343.736    -80.6652     
1 1 1 -21 3  12 o 0 1438.2  27.5  ?     ?   766.063   -97.9737     908.213    -97.9737     181.243    -97.9737     
1 1 1 -21 3  11 o 0 126.6   4.5   ?     ?   236.234   -1.01207     168.538    -1.01207     56.8705    178.988      
1 1 1 -21 3  10 o 0 674.3   12.7  ?     ?   450.561   -25.5545     670.811    -25.5545     238.76     -25.5545     
1 1 1 -21 3  9  o 0 185.4   4.9   ?     ?   384.534   128.334      193.695    128.334      191.601    -51.6657     
1 1 1 -21 3  8  o 0 356.6   7.8   ?     ?   628.974   -92.0168     220.572    -92.0168     412.13     87.9832      
1 1 1 -21 3  7  o 0 201     5.8   ?     ?   324.671   -70.5434     270.336    -70.5434     57.3776    109.457      
1 1 1 -21 3  6  o 0 775     20.5  ?     ?   621.581   -33.595      652.823    -33.595      23.5769    -33.595      
1 1 1 -21 3  5  o 0 391.4   8.9   ?     ?   511.06    -101.177     385.14     -101.177     145.41     78.8232      
1 1 1 -21 3  4  f 1 400.4   9     ?     ?   629.556   -80.1959     283.87     -80.1959     368.718    99.8041      
1 1 1 -21 3  3  o 0 112.5   3.4   ?     ?   136.326   -121.25      171.822    -121.25      30.9924    -121.25      
1 1 1 -21 3  2  f 1 1207    25.2  ?     ?   600.857   -26.5695     1031.47    -26.5695     406.695    -26.5695     
1 1 1 -21 3  1  o 0 161.1   4     ?     ?   187.807   33.745       282.018    33.745       87.5033    33.745       
1 1 1 21  3  0  o 0 1332.2  24    ?     ?   712.474   163.079      1006.72    163.079      272.814    163.079      
1 1 1 21  3  1  o 0 304.9   7.3   ?     ?   541.187   -136.89      248.046    -136.89      310.622    43.1101      
1 1 1 21  3  2  f 1 720.2   13.8  ?     ?   568.474   -97.0672     677.437    -97.0672     86.3458    -97.0672     
1 1 1 21  3  3  o 0 2214    38.8  ?     ?   1148.76   -107.62      1088.56    -107.62      102.03     72.3802      
1 1 1 21  3  4  f 1 284.7   7     ?     ?   367.329   24.1871      377.618    24.1871      5.61889    -155.813     
1 1 1 21  3  5  o 0 247.6   6.4   ?     ?   266.233   -161.702     401.247    -161.702     122.219    -161.702     
1 1 1 21  3  6  o 0 1642.8  30.3  ?     ?   742.234   -113.534     1151.51    -113.534     390.77     -113.534     
1 1 1 21  3  7  o 0 549.4   11.5  ?     ?   347.767   -155.246     701.48     -155.246     345.131    -155.246     
1 1 1 21  3  8  o 0 257.1   7.3   ?     ?   439.327   41.116       265.929    41.116       183.821    -138.884     
1 1 1 21  3  9  o 0 271.1   8.7   ?     ?   398.952   -47.3921     321.907    -47.3921     85.8589    132.608      
1 1 1 21  3  10 o 0 203.2   7.7   ?     ?   526.489   -179.07      87.2296    -179.07      428.898    0.930379     
1 1 1 21  3  11 o 0 568.6   12.5  ?     ?   453.435   -23.449      585.343    -23.449      142.107    -23.449      
1 1 1 21  3  12 o 0 125.1   8.1   ?     ?   44.7715   119.439      79.3705    119.439      36.3257    119.439      
1 1 1 21  3  13 f 1 677     19.9  ?     ?   466.274   -120.05      668.508    -120.05      219.729    -120.05      
1 1 1 21  3  14 o 0 1512    30.4  ?     ?   801.205   -175.884     977.71     -175.884     202.798    -175.884     
1 1 1 21  3  15 o 0 512.3   15.1  ?     ?   453.283   74.8167      544.167    74.8167      107.992    74.8167      
1 1 1 21  3  16 o 0 302.4   15.2  ?     ?   362.226   -100.811     391.363    -100.811     51.9755    -100.811     
1 1 1 21  3  17 o 0 772.9   22.5  ?     ?   568.085   6.33294      690.219    6.33294      156.546    6.33294      
1 1 1 21  3  18 o 0 187.1   17.1  ?     ?   352.746   -88.4329     276.059    -88.4329     95.6611    91.5671      
1 1 1 21  3  19 o 0 21.8    15.3  ?     ?   211.833   149.425      46.5659    -30.5751     264.369    -30.5751     
1 1 1 21  3  20 o 0 37.6    18.3  ?     ?   87.8431   172.628      83.0604    172.628      5.09411    -7.37157     
1 1 1 21  3  21 o 0 1.2     21.1  ?     ?   106.202   40.3321      8.17952    -139.668     111.294    -139.668     
1 1 1 21  3  22 f 1 25.9    23    ?     ?   74.6027   71.5739      54.892     71.5739      17.5901    -108.426     
1 1 1 21  3  23 f 1 18.1    24.6  ?     ?   85.9196   -43.205      46.1237    -43.205      37.3623    136.795      
1 1 1 21  3  24 o 0 86.5    28.7  ?     ?   205.412   -115.076     190.831    -115.076     24.3985    64.9237      
1 1 1 21  3  25 o 0 65.7    34.8  ?     ?   221.743   -114.438     94.1994    -114.438     128.225    65.5623      
1 1 1 21  3  26 o 0 -20.6   34.6  ?     ?   54.582    141.229      40.3952    141.229      12.0021    -38.7713     
1 1 1 -21 5  27 < 0 32.8    13.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 5  26 o 0 23.4    13.8  ?     ?   99.5236   -48.2416     80.0954    -48.2416     8.90792    131.758      
1 1 1 -21 5  25 o 0 1.8     13.2  ?     ?   97.4832   2.69554      9.40936    -177.304     98.6139    -177.304     
1 1 1 -21 5  24 o 0 20.6    10.5  ?     ?   71.5009   -127.418     49.1477    -127.418     18.4604    52.5823      
1 1 1 -21 5  23 o 0 109     10.7  ?     ?   228.05    81.9956      243.573    81.9956      19.5737    81.9956      
1 1 1 -21 5  22 f 1 134.6   8.7   ?     ?   311.317   65.3794      224.017    65.3794      62.2227    -114.621     
1 1 1 -21 5  21 o 0 14.5    7.8   ?     ?   91.2398   149.676      1.45167    -30.324      85.0578    -30.324      
1 1 1 -21 5  20 o 0 101.4   7.8   ?     ?   230.435   119.417      215.411    119.417      2.49883    -60.5833     
1 1 1 -21 5  19 o 0 8       6.8   ?     ?   63.3201   -68.3749     32.1057    111.625      93.5894    111.625      
1 1 1 -21 5  18 o 0 137.1   7.4   ?     ?   263.535   -98.3526     244.439    -98.3526     18.4017    81.6474      
1 1 1 -21 5  17 o 0 175.8   7.2   ?     ?   388.925   -115.74      180.401    -115.74      166.16     64.26        
1 1 1 -21 5  16 o 0 22.1    5.1   ?     ?   36.9164   70.7383      8.03226    -109.262     41.2012    -109.262     
1 1 1 -21 5  15 f 1 46.5    5     ?     ?   108.032   -35.8745     17.6933    -35.8745     79.7854    144.125      
1 1 1 -21 5  14 o 0 187.6   7.5   ?     ?   280.579   -19.1936     255.218    -19.1936     3.91812    160.806      
1 1 1 -21 5  13 o 0 336.6   8.2   ?     ?   454.882   93.5409      335.616    93.5409      87.4123    -86.4591     
1 1 1 -21 5  12 o 0 1200.9  21.9  ?     ?   552.563   -49.9948     947        -49.9948     437.309    -49.9948     
1 1 1 -21 5  11 o 0 797.7   15.2  ?     ?   725.185   33.4614      523.676    33.4614      149.233    -146.539     
1 1 1 -21 5  10 o 0 247.2   6     ?     ?   714.139   67.4499      18.0058    -112.55      693.081    -112.55      
1 1 1 -21 5  9  o 0 893.5   19.5  ?     ?   617.691   113.42       690.997    113.42       104.189    113.42       
1 1 1 -21 5  8  o 0 227.8   5.4   ?     ?   284.342   -30.5807     314.978    -30.5807     43.645     -30.5807     
1 1 1 -21 5  7  f 1 871.6   16    ?     ?   692.596   161.647      641.573    161.647      60.6056    -18.3527     
1 1 1 -21 5  6  o 0 2291.7  39.7  ?     ?   1145.38   27.7662      1074.04    27.7662      71.4321    -152.234     
1 1 1 -21 5  5  o 0 86.9    2.8   ?     ?   279.585   -45.7621     68.1957    -45.7621     212.245    134.238      
1 1 1 -21 5  4  o 0 786.2   16.5  ?     ?   616.319   -45.0697     663.151    -45.0697     43.3934    -45.0697     
1 1 1 -21 5  3  f 1 606     14.8  ?     ?   356.159   -167.145     736.932    -167.145     376.201    -167.145     
1 1 1 -21 5  2  o 0 1316.3  45.1  ?     ?   252.345   99.3339      1367.91    99.3339      1113.21    99.3339      
1 1 1 -21 5  1  o 0 1197.6  34.6  ?     ?   813.791   137.215      785.249    137.215      37.15      -42.7851     
1 1 1 21  5  0  o 0 46.3    2.6   ?     ?   327.898   97.0268      87.5082    -82.9732     417.362    -82.9732     
1 1 1 21  5  1  o 0 463     9.1   ?     ?   512.106   -170.013     454.745    -170.013     61.3383    9.98705      
1 1 1 21  5  2  o 0 574.5   13.3  ?     ?   712.671   141.321      381.08     141.321      338.251    -38.6788     
1 1 1 21  5  3  f 1 1202.9  25.2  ?     ?   698.275   80.2509      898.248    80.2509      188.94     80.2509      
1 1 1 21  5  4  o 0 145.3   7     ?     ?   242.162   34.0999      223.883    34.0999      21.0534    -145.9       
1 1 1 21  5  5  o 0 1260    22.3  ?     ?   674.482   -48.4666     964.434    -48.4666     281.98     -48.4666     
1 1 1 21  5  6  o 0 1047.8  20.6  ?     ?   763.988   -130.473     729.635    -130.473     43.2402    49.5265      
1 1 1 21  5  7  f 1 1742    35.5  ?     ?   835.46    -16.0689     1086.52    -16.0689     227.395    -16.0689     
1 1 1 21  5  8  o 0 2714.7  54.8  ?     ?   1091.5    -95.0024     1256.45    -95.0024     197.264    -95.0024     
1 1 1 21  5  9  o 0 1159.9  23    ?     ?   667.984   -94.1525     844.803    -94.1525     197.877    -94.1525     
1 1 1 21  5  10 o 0 118.2   7.4   ?     ?   67.7773   167.151      109.958    167.151      44.4859    167.151      
1 1 1 21  5  11 o 0 213.6   9.6   ?     ?   335.952   -110.936     260.309    -110.936     58.9745    69.0638      
1 1 1 21  5  12 o 0 801.9   18.6  ?     ?   594.877   -63.1385     671.6      -63.1385     93.1495    -63.1385     
1 1 1 21  5  13 o 0 1201.4  25.4  ?     ?   556.169   140.679      997.435    140.679      465.381    140.679      
1 1 1 21  5  14 o 0 167.3   9.9   ?     ?   228.9     -128.308     253.571    -128.308     35.6488    -128.308     
1 1 1 21  5  15 f 1 217.9   12.8  ?     ?   309.723   -153.126     306.082    -153.126     17.4156    -153.126     
1 1 1 21  5  16 o 0 61.1    13.4  ?     ?   176.565   -148.472     77.1521    -148.472     87.0412    31.5281      
1 1 1 21  5  17 o 0 546.7   20.8  ?     ?   483.605   70.4039      632.304    70.4039      127.719    70.4039      
1 1 1 21  5  18 o 0 116.3   14.2  ?     ?   245.776   108.334      237.543    108.334      12.7189    -71.6658     
1 1 1 21  5  19 o 0 210.1   16.9  ?     ?   183.029   -28.6874     479.457    -28.6874     297.518    -28.6874     
1 1 1 21  5  20 o 0 4       18.2  ?     ?   125.403   -87.7607     19.9915    92.2393      140.619    92.2393      
1 1 1 21  5  21 o 0 161.3   20.3  ?     ?   238.186   84.543       347.301    84.543       119.17     84.543       
1 1 1 21  5  22 f 1 48.1    21.6  ?     ?   222.534   -153.496     63.6359    -153.496     150.652    26.5038      
1 1 1 21  5  23 o 0 42.2    22.8  ?     ?   101.439   -118.194     132.239    -118.194     26.8919    -118.194     
1 1 1 21  5  24 o 0 77.2    24.6  ?     ?   68.9055   -26.0903     254.707    -26.0903     186.194    -26.0903     
1 1 1 21  5  25 o 0 47.4    27.3  ?     ?   192.975   53.1247      88.198     53.1247      95.4508    -126.875     
1 1 1 21  5  26 o 0 -0.9    30.4  ?     ?   125.65    62.3656      42.468     62.3656      76.1871    -117.634     
1 1 1 -21 7  25 o 0 2.4     13.1  ?     ?   108.833   -66.8509     2.61303    -66.8509     93.1271    113.149      
1 1 1 -21 7  24 o 0 21.2    10.6  ?     ?   106.464   13.9691      60.3662    13.9691      34.2091    -166.031     
1 1 1 -21 7  23 o 0 41.4    11.9  ?     ?   16.6544   -117.207     55.1533    -117.207     39.6656    -117.207     
1 1 1 -21 7  22 o 0 92.9    9.8   ?     ?   222.217   51.3957      208.524    51.3957      7.73189    -128.604     
1 1 1 -21 7  21 f 1 105     9.4   ?     ?   363.381   105.679      114.165    105.679      214.357    -74.3205     
1 1 1 -21 7  20 o 0 51.5    8.1   ?     ?   100.65    50.7048      152.69     50.7048      62.0145    50.7048      
1 1 1 -21 7  19 o 0 48.9    6.4   ?     ?   87.7634   27.4631      140.855    27.4631      61.3008    27.4631      
1 1 1 -21 7  18 o 0 0.5     6.5   ?     ?   131.97    90.484       87.4535    -89.516      211.301    -89.516      
1 1 1 -21 7  17 o 0 84.5    6.3   ?     ?   111.733   36.6554      219.587    36.6554      111.982    36.6554      
1 1 1 -21 7  16 f 1 18.1    5.4   ?     ?   127.631   -24.0961     35.7019    155.904      162.53     155.904      
1 1 1 -21 7  15 o 0 1050.1  20.9  ?     ?   703.067   -17.3948     729.554    -17.3948     108.925    -17.3948     
1 1 1 -21 7  14 o 0 292.7   9.8   ?     ?   360.471   -121.423     366.855    -121.423     46.1981    -121.423     
1 1 1 -21 7  13 o 0 640.1   18.8  ?     ?   629.587   -117.525     497.24     -117.525     61.9656    62.4753      
1 1 1 -21 7  12 o 0 57.1    4.1   ?     ?   224.261   -122.499     5.44283    -122.499     199.362    57.5006      
1 1 1 -21 7  11 f 1 1623.7  29    ?     ?   814.558   -78.5927     974.892    -78.5927     222.481    -78.5927     
1 1 1 -21 7  10 o 0 1553.8  30.1  ?     ?   912.486   -136.928     858.306    -136.928     14.893     -136.928     
1 1 1 -21 7  9  o 0 1217.8  22.4  ?     ?   861.862   -126.016     681.541    -126.016     107.701    53.9836      
1 1 1 -21 7  8  o 0 457.5   9.6   ?     ?   392.826   -64.35       503.326    -64.35       141.873    -64.35       
1 1 1 -21 7  7  o 0 126     3.9   ?     ?   93.1717   -21.819      138.777    -21.819      52.6786    -21.819      
1 1 1 -21 7  6  f 1 737.6   15.2  ?     ?   377.12    12.0618      767.326    12.0618      411.074    12.0618      
1 1 1 -21 7  5  o 0 1888.6  33.1  ?     ?   810.848   -87.1633     1102.83    -87.1633     338.258    -87.1633     
1 1 1 -21 7  4  o 0 2067.1  39.3  ?     ?   1180.49   -98.1366     852.041    -98.1366     264.199    81.8634      
1 1 1 -21 7  3  f 1 3263.9  56.6  ?     ?   1117.51   -69.52       1417.83    -69.52       353.254    -69.52       
1 1 1 -21 7  2  o 0 484.2   17.9  ?     ?   635.39    9.21937      328.544    9.21937      274.772    -170.781     
1 1 1 -21 7  1  f 1 387.9   10.7  ?     ?   508.614   0.626809     337.341    0.626809     148.765    -179.373     
1 1 1 21  7  0  o 0 3403.7  75.6  ?     ?   861.04    -166.56      1716.5     -166.56      898.693    -166.56      
1 1 1 21  7  1  f 1 22      2.6   ?     ?   69.7602   28.3343      31.5016    -151.666     98.189     -151.666     
1 1 1 21  7  2  o 0 607.9   12.8  ?     ?   457.049   94.265       602.725    94.265       167.602    94.265       
1 1 1 21  7  3  f 1 2896.7  51.4  ?     ?   1140.42   70.212       1258       70.212       166.005    70.212       
1 1 1 21  7  4  o 0 774     17.1  ?     ?   574.507   40.1502      640.429    40.1502      93.0143    40.1502      
1 1 1 21  7  5  o 0 733     14.6  ?     ?   583.07    -27.5701     599.816    -27.5701     44.3824    -27.5701     
1 1 1 21  7  6  f 1 129.8   5.6   ?     ?   497.296   -97.3424     18.629     82.6576      494.431    82.6576      
1 1 1 21  7  7  o 0 222.5   7.3   ?     ?   358.247   -68.0401     254.195    -68.0401     81.9433    111.96       
1 1 1 21  7  8  o 0 196.9   8.3   ?     ?   422.342   -0.1712      165.109    -0.1712      230.444    179.829      
1 1 1 21  7  9  o 0 7.9     6     ?     ?   166.006   124.364      126.36     -55.6364     281.467    -55.6364     
1 1 1 21  7  10 o 0 617.9   16.1  ?     ?   619.816   -18.9464     490.696    -18.9464     95.2166    161.054      
1 1 1 21  7  11 f 1 344.4   12.4  ?     ?   569.821   -109.715     248.826    -109.715     290.714    70.285       
1 1 1 21  7  12 o 0 169.1   11.1  ?     ?   232.921   44.0873      270.651    44.0873      56.6697    44.0873      
1 1 1 21  7  13 o 0 341.6   14.2  ?     ?   413.393   39.7772      390.873    39.7772      12.8174    39.7772      
1 1 1 21  7  14 o 0 96.3    15.3  ?     ?   101.039   44.2135      155.971    44.2135      63.2309    44.2135      
1 1 1 21  7  15 o 0 47.4    12.7  ?     ?   95.9853   -146.985     77.3062    -146.985     21.6173    33.0148      
1 1 1 21  7  16 f 1 71.4    12.6  ?     ?   340.413   66.755       20.8276    66.755       329.681    -113.245     
1 1 1 21  7  17 o 0 -9.7    13.3  ?     ?   19.642    -59.988      12.5477    120.012      32.1888    120.012      
1 1 1 21  7  18 o 0 10.8    14.5  ?     ?   50.0205   39.5813      3.09468    -140.419     51.9351    -140.419     
1 1 1 21  7  19 o 0 27.2    19    ?     ?   32.3226   -90.7345     29.7165    -90.7345     0.829887   89.2655      
1 1 1 21  7  20 o 0 22.4    24.2  ?     ?   38.5213   92.6627      31.5904    92.6627      4.66485    -87.3373     
1 1 1 21  7  21 f 1 61.7    24    ?     ?   175.372   -100.979     146.65     -100.979     33.5225    79.021       
1 1 1 21  7  22 o 0 67.1    25.6  ?     ?   185.52    13.3029      151.441    13.3029      37.9481    -166.697     
1 1 1 21  7  23 o 0 -64.6   36.2  ?     ?   60.9085   32.088       0.968791   32.088       58.5715    -147.912     
1 1 1 21  7  24 o 0 -15.9   32.8  ?     ?   64.3138   -152.319     41.3316    -152.319     18.8497    27.6806      
1 1 1 -21 9  24 < 0 10.6    13.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 9  23 o 0 75.3    12.8  ?     ?   181.804   171.58       203.876    171.58       45.9796    171.58       
1 1 1 -21 9  22 o 0 85.1    11.9  ?     ?   216.148   106.798      197.624    106.798      5.66135    106.798      
1 1 1 -21 9  21 f 1 14.9    10.7  ?     ?   121.453   170.288      10.8936    170.288      101.06     -9.71224     
1 1 1 -21 9  20 o 0 8       9.9   ?     ?   62.9694   167.244      1.38967    -12.7563     61.7857    -12.7563     
1 1 1 -21 9  19 o 0 14.5    7.8   ?     ?   42.2876   33.1337      7.09755    33.1337      30.3664    -146.866     
1 1 1 -21 9  18 o 0 30.2    7.6   ?     ?   72.5305   -107.839     68.1435    -107.839     3.82245    -107.839     
1 1 1 -21 9  17 o 0 -1.6    6.9   ?     ?   11.8718   -178.959     7.1291     1.04064      17.7154    1.04064      
1 1 1 -21 9  16 o 0 96.2    7.1   ?     ?   144.171   161.205      253.89     161.205      120.879    161.205      
1 1 1 -21 9  15 o 0 545.9   13.7  ?     ?   379.048   169.753      690.546    169.753      331.911    169.753      
1 1 1 -21 9  14 o 0 46.9    4.8   ?     ?   114.872   21.1211      105.538    21.1211      4.00976    -158.879     
1 1 1 -21 9  13 o 0 76      6.3   ?     ?   220.383   -153.043     129.313    -153.043     86.1865    26.9567      
1 1 1 -21 9  12 o 0 16.7    5.6   ?     ?   102.103   -174.466     41.4795    5.5342       130.522    5.5342       
1 1 1 -21 9  11 f 1 452.4   10.2  ?     ?   651.623   -178.254     297.941    -178.254     276.966    1.74577      
1 1 1 -21 9  10 o 0 77.6    4.1   ?     ?   146.144   -14.5148     91.7318    -14.5148     36.1978    165.485      
1 1 1 -21 9  9  o 0 122.1   4.7   ?     ?   235.037   -108.054     173.15     -108.054     33.7277    71.9457      
1 1 1 -21 9  8  f 1 198.2   5.4   ?     ?   40.5257   -87.4363     151.507    -87.4363     115.473    -87.4363     
1 1 1 -21 9  7  o 0 5.6     2.7   ?     ?   202.543   -79.5299     160.88     100.47       344.692    100.47       
1 1 1 -21 9  6  f 1 408.7   9.8   ?     ?   415.804   164.132      438.88     164.132      58.066     164.132      
1 1 1 -21 9  5  o 0 23.6    2.8   ?     ?   281.87    15.2268      138.906    -164.773     396.641    -164.773     
1 1 1 -21 9  4  o 0 1743.5  32.4  ?     ?   807.492   132.655      1046.35    132.655      305.77     132.655      
1 1 1 -21 9  3  o 0 1583.1  29.9  ?     ?   648.808   127.975      1095.28    127.975      491.492    127.975      
1 1 1 -21 9  2  o 0 893.3   18    ?     ?   704.423   160.855      600.232    160.855      39.4043    -19.1455     
1 1 1 -21 9  1  o 0 858.9   20.1  ?     ?   619.175   121.459      649.621    121.459      86.4899    121.459      
1 1 1 21  9  0  o 0 560.4   14.5  ?     ?   416.227   -12.3317     578.579    -12.3317     198.819    -12.3317     
1 1 1 21  9  1  o 0 2995    53.7  ?     ?   1216.04   114.87       1210.28    114.87       99.7698    114.87       
1 1 1 21  9  2  o 0 932.2   18.3  ?     ?   798.47    -72.767      549.258    -72.767      180.317    107.233      
1 1 1 21  9  3  o 0 1095.1  21.3  ?     ?   659.699   -56.9023     800.901    -56.9023     181.775    -56.9023     
1 1 1 21  9  4  o 0 244     7.2   ?     ?   477.368   47.9695      196.078    47.9695      246.439    -132.031     
1 1 1 21  9  5  o 0 1401.9  26.5  ?     ?   740.928   72.3666      926.766    72.3666      240.449    72.3666      
1 1 1 21  9  6  f 1 1435.8  27.7  ?     ?   726.217   73.1757      954.949    73.1757      279.634    73.1757      
1 1 1 21  9  7  o 0 265.8   9.2   ?     ?   476.36    26.9433      226.036    26.9433      213.906    -153.057     
1 1 1 21  9  8  f 1 195.4   8.6   ?     ?   248.251   -34.0648     301.365    -34.0648     76.2203    -34.0648     
1 1 1 21  9  9  o 0 187.8   8.9   ?     ?   377.362   -48.0771     203.738    -48.0771     135.813    131.923      
1 1 1 21  9  10 o 0 155     9.1   ?     ?   73.2515   133.926      183.087    133.926      117.39     133.926      
1 1 1 21  9  11 f 1 216.3   10.8  ?     ?   213.139   116.809      367.202    116.809      174.114    116.809      
1 1 1 21  9  12 o 0 30.1    9.6   ?     ?   102.126   -90.4211     18.7619    -90.4211     84.7203    89.5789      
1 1 1 21  9  13 o 0 75.1    11    ?     ?   249.866   81.6361      108.532    81.6361      143.439    -98.3639     
1 1 1 21  9  14 o 0 140.7   12.4  ?     ?   315.199   44.5022      223.771    44.5022      86.8803    -135.498     
1 1 1 21  9  15 o 0 336.4   15.6  ?     ?   479.74    36.7885      392.917    36.7885      69.3167    -143.212     
1 1 1 21  9  16 o 0 153.4   15    ?     ?   172.356   66.0889      377.585    66.0889      216.665    66.0889      
1 1 1 21  9  17 o 0 6.4     17.1  ?     ?   109.645   108.3        12.4211    -71.7004     114.103    -71.7004     
1 1 1 21  9  18 o 0 45.9    18    ?     ?   142.437   -170.463     117.224    -170.463     15.567     9.53687      
1 1 1 21  9  19 o 0 174.8   22.2  ?     ?   280.659   168.082      330.485    168.082      48.6162    168.082      
1 1 1 21  9  20 o 0 11.2    21.2  ?     ?   85.0791   -133.027     36.3431    -133.027     49.0504    46.9725      
1 1 1 21  9  21 f 1 63.3    22    ?     ?   117.191   93.7824      196.821    93.7824      83.5422    93.7824      
1 1 1 21  9  22 o 0 44.6    33.9  ?     ?   180.664   88.9345      85.3948    88.9345      81.0116    -91.0655     
1 1 1 21  9  24 < 0 -0.2    25.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 11 22 < 0 28.7    14.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 11 21 o 0 40.5    9.6   ?     ?   152.1     25.6007      121.794    25.6007      7.44007    -154.399     
1 1 1 -21 11 20 o 0 73.2    11.9  ?     ?   196.702   -18.7351     182.546    -18.7351     13.978     -18.7351     
1 1 1 -21 11 19 o 0 28.2    10.7  ?     ?   109.346   -38.2396     74.7892    -38.2396     23.1881    141.76       
1 1 1 -21 11 18 o 0 156.4   11.8  ?     ?   290.191   -33.7301     270.97     -33.7301     0.793676   146.27       
1 1 1 -21 11 17 o 0 85.1    9.6   ?     ?   153.629   -97.9933     234.681    -97.9933     90.5196    -97.9933     
1 1 1 -21 11 16 o 0 268.3   10.7  ?     ?   249.683   12.569       472.577    12.569       254.787    12.569       
1 1 1 -21 11 15 o 0 116.9   8.3   ?     ?   135.932   42.6658      304.252    42.6658      185.703    42.6658      
1 1 1 -21 11 14 o 0 30      5.9   ?     ?   82.2057   68.3437      67.5069    68.3437      4.49713    -111.656     
1 1 1 -21 11 13 o 0 30.2    5.7   ?     ?   144.777   100.178      60.1149    100.178      67.6648    -79.8217     
1 1 1 -21 11 12 o 0 92.2    5.2   ?     ?   233.076   -57.5638     185.039    -57.5638     27.4374    122.436      
1 1 1 -21 11 11 o 0 -0.7    5.9   ?     ?   139.072   -149.518     103.152    30.4823      232.948    30.4823      
1 1 1 -21 11 10 o 0 83.5    5     ?     ?   254.253   34.0316      138.903    34.0316      99.86      -145.968     
1 1 1 -21 11 9  o 0 544.9   13.1  ?     ?   341.559   11.3297      707.537    11.3297      379.226    11.3297      
1 1 1 -21 11 8  o 0 104.6   4.7   ?     ?   204.897   35.6464      208.887    35.6464      10.912     35.6464      
1 1 1 -21 11 7  f 1 41.7    3.9   ?     ?   218.455   13.1224      21.1093    13.1224      192.051    -166.878     
1 1 1 -21 11 6  o 0 224.1   6.6   ?     ?   304.564   117.327      307.728    117.327      44.766     117.327      
1 1 1 -21 11 5  o 0 117.2   4.6   ?     ?   275.64    90.3536      154.679    90.3536      84.1969    -89.6464     
1 1 1 -21 11 4  o 0 27.1    3.6   ?     ?   114.832   -117.079     13.8914    62.9211      113.73     62.9211      
1 1 1 -21 11 3  o 0 121.2   5     ?     ?   333.468   -151.443     123.593    -151.443     167.134    28.5572      
1 1 1 -21 11 2  f 1 856.9   17.2  ?     ?   661.875   -58.4091     622.284    -58.4091     45.9947    -58.4091     
1 1 1 -21 11 1  o 0 157.7   6     ?     ?   368.167   -54.1715     154.747    -54.1715     164.754    125.828      
1 1 1 21  11 0  o 0 668.2   15.5  ?     ?   482.163   -85.0885     632.556    -85.0885     210.929    -85.0885     
1 1 1 21  11 1  o 0 1657.2  36.1  ?     ?   863.876   -17.257      944.055    -17.257      188.231    -17.257      
1 1 1 21  11 2  f 1 422.1   10.4  ?     ?   416.161   2.11065      458.083    2.11065      92.0532    2.11065      
1 1 1 21  11 3  o 0 43.4    5.5   ?     ?   181.772   7.98787      20.135     7.98787      140.27     -172.012     
1 1 1 21  11 4  o 0 45      6     ?     ?   118.203   -136.776     36.2159    -136.776     68.0168    43.2239      
1 1 1 21  11 5  o 0 866.7   20.2  ?     ?   685.558   -127.757     617.636    -127.757     13.8133    -127.757     
1 1 1 21  11 6  o 0 372.6   11.5  ?     ?   551.283   172.437      302.058    172.437      182.702    -7.56333     
1 1 1 21  11 7  f 1 166.9   9     ?     ?   155.831   93.4927      367.988    93.4927      212.805    93.4927      
1 1 1 21  11 8  o 0 48.1    7.5   ?     ?   123.837   148.91       81.2008    148.91       41.1716    -31.0904     
1 1 1 21  11 9  o 0 163.2   9.1   ?     ?   188.614   50.268       343.86     50.268       158.053    50.268       
1 1 1 21  11 10 o 0 126.6   10.6  ?     ?   445.142   -153.762     74.9905    -153.762     354.325    26.2378      
1 1 1 21  11 11 o 0 136.7   10.7  ?     ?   183.715   -178.464     325.078    -178.464     151.565    -178.464     
1 1 1 21  11 12 o 0 308     14.8  ?     ?   374.937   -32.8754     440.177    -32.8754     87.6768    -32.8754     
1 1 1 21  11 13 o 0 38.7    10.4  ?     ?   214.974   45.1968      51.6013    45.1968      144.481    -134.803     
1 1 1 21  11 14 o 0 155.6   14    ?     ?   272.763   62.2223      296.09     62.2223      47.7423    62.2223      
1 1 1 21  11 15 o 0 118     15.9  ?     ?   218.938   86.3665      262.9      86.3665      63.0222    86.3665      
1 1 1 21  11 16 o 0 -2.3    16.6  ?     ?   169.234   25.3437      59.4744    -154.656     220.403    -154.656     
1 1 1 21  11 17 o 0 189.1   21.7  ?     ?   302.667   30.0166      326.508    30.0166      30.5679    30.0166      
1 1 1 21  11 18 o 0 76.4    24.7  ?     ?   250.555   41.8918      119.67     41.8918      117.081    -138.108     
1 1 1 21  11 19 o 0 19.1    22.4  ?     ?   71.4458   99.7934      64.1142    99.7934      1.46963    -80.2066     
1 1 1 21  11 20 o 0 19.8    28.3  ?     ?   86.5494   126.435      80.7595    126.435      2.99591    126.435      
1 1 1 21  11 21 < 0 51.7    30.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 13 19 < 0 37.4    16.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 13 18 o 0 85.4    14    ?     ?   241.578   148.936      172.721    148.936      28.2574    -31.064      
1 1 1 -21 13 17 f 1 52.1    12.6  ?     ?   109.995   47.2933      174.167    47.2933      81.5026    47.2933      
1 1 1 -21 13 16 o 0 136.8   10.5  ?     ?   289.483   6.18858      242.954    6.18858      5.14591    -173.811     
1 1 1 -21 13 15 o 0 204.3   13.4  ?     ?   175.674   17.5175      442.585    17.5175      287.47     17.5175      
1 1 1 -21 13 14 o 0 100     9.2   ?     ?   191.919   -93.416      238.129    -93.416      61.3107    -93.416      
1 1 1 -21 13 13 o 0 319.9   11.8  ?     ?   381.117   -48.9714     430.62     -48.9714     79.3812    -48.9714     
1 1 1 -21 13 12 f 1 14.5    6.2   ?     ?   115.572   -116.494     2.69057    63.5056      106.846    63.5056      
1 1 1 -21 13 11 o 0 18.5    6.6   ?     ?   147.415   16.7022      6.04052    16.7022      120.896    -163.298     
1 1 1 -21 13 10 o 0 126.8   7.3   ?     ?   316.355   -33.5319     195.101    -33.5319     76.6585    146.468      
1 1 1 -21 13 9  o 0 11.1    5.3   ?     ?   100.565   60.2813      20.6692    -119.719     107.566    -119.719     
1 1 1 -21 13 8  o 0 85.3    5.5   ?     ?   131.481   169.554      233.564    169.554      119.77     169.554      
1 1 1 -21 13 7  o 0 99.2    5.9   ?     ?   81.4262   -124.753     268.281    -124.753     197.463    -124.753     
1 1 1 -21 13 6  o 0 23.1    4.5   ?     ?   132.536   -135.695     22.8208    -135.695     95.9144    44.3051      
1 1 1 -21 13 5  o 0 92.1    5.4   ?     ?   241.872   93.527       175.711    93.527       41.8269    -86.473      
1 1 1 -21 13 4  f 1 16.3    5.2   ?     ?   155.856   -129.602     22.5123    50.398       163.895    50.398       
1 1 1 -21 13 3  o 0 63.2    5.6   ?     ?   186.523   112.045      141.428    112.045      27.409     -67.9552     
1 1 1 -21 13 2  o 0 95.7    5.8   ?     ?   197.605   -174.755     217.749    -174.755     38.432     -174.755     
1 1 1 -21 13 1  o 0 197.6   7.3   ?     ?   299.098   -146.322     323.336    -146.322     46.7436    -146.322     
1 1 1 21  13 0  o 0 148.9   6.7   ?     ?   238.049   84.0893      290.906    84.0892      68.1314    84.0892      
1 1 1 21  13 1  o 0 113.9   6.8   ?     ?   271.01    45.6955      195.36     45.6955      58.3128    -134.304     
1 1 1 21  13 2  o 0 297.4   9.5   ?     ?   257.018   -44.2625     516.72     -44.2625     280.214    -44.2625     
1 1 1 21  13 3  o 0 39      6.9   ?     ?   131.308   -155.671     90.6963    -155.671     30.0544    24.3288      
1 1 1 21  13 4  f 1 110.4   7.3   ?     ?   226.892   165.883      231.208    165.883      21.7135    165.883      
1 1 1 21  13 5  o 0 6.5     7.5   ?     ?   37.1594   158.062      15.4993    -21.9383     49.5815    -21.9383     
1 1 1 21  13 6  o 0 50.3    8.4   ?     ?   85.8111   62.2483      129.117    62.2483      50.569     62.2483      
1 1 1 21  13 7  o 0 85.7    9.7   ?     ?   180.2     -54.3368     214.066    -54.3368     53.6203    -54.3368     
1 1 1 21  13 8  o 0 35.2    9.1   ?     ?   79.5162   95.721       86.0773    95.7209      15.4855    95.7209      
1 1 1 21  13 9  o 0 108.2   10.8  ?     ?   380.976   119.327      108.014    119.327      230.323    -60.6734     
1 1 1 21  13 10 o 0 22      12.7  ?     ?   170.595   90.3154      3.41149    90.3154      147.502    -89.6846     
1 1 1 21  13 11 o 0 34.1    13.9  ?     ?   197.054   -89.1469     38.7937    -89.1469     136.287    90.8531      
1 1 1 21  13 12 f 1 56      12.1  ?     ?   127.016   -76.2497     172.436    -76.2497     49.8959    -76.2497     
1 1 1 21  13 13 o 0 67.5    16.5  ?     ?   166.972   -44.603      176.132    -44.603      16.7195    -44.603      
1 1 1 21  13 14 o 0 -6.4    13.9  ?     ?   139.499   -111.181     55.1697    68.8193      188.576    68.8193      
1 1 1 21  13 15 o 0 11.1    18.9  ?     ?   136.217   -172.401     10.9659    -172.401     114.13     7.59877      
1 1 1 21  13 16 o 0 6.1     23    ?     ?   41.5336   144.317      28.5049    144.317      8.59174    -35.6829     
1 1 1 21  13 17 f 1 9.7     22.2  ?     ?   57.0066   96.2755      47.4273    96.2755      2.72189    -83.7245     
1 1 1 21  13 18 < 0 86.7    26.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 15 15 < 0 71.1    13    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 15 14 < 0 40.3    11    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 15 13 f 1 34.6    10.5  ?     ?   164.797   148.679      85.5477    148.679      50.0792    -31.3211     
1 1 1 -21 15 12 o 0 35.2    10.5  ?     ?   94.8988   103.946      122.947    103.946      44.8372    103.946      
1 1 1 -21 15 11 o 0 -8.2    8.7   ?     ?   82.578    22.3543      39.1923    -157.646     108.543    -157.646     
1 1 1 -21 15 10 o 0 31.7    8.3   ?     ?   85.8828   -148.219     106.43     -148.219     33.8311    -148.219     
1 1 1 -21 15 9  o 0 40      8     ?     ?   66.737    -84.4181     129.602    -84.4181     71.637     -84.4181     
1 1 1 -21 15 8  o 0 276.4   10.3  ?     ?   377.009   24.4526      367.11     24.4526      26.3557    24.4526      
1 1 1 -21 15 7  o 0 182.9   8.4   ?     ?   316.329   32.449       286.701    32.449       0.665134   -147.551     
1 1 1 -21 15 6  o 0 11.4    6.1   ?     ?   149.288   142.844      35.0006    -37.1564     170.231    -37.1564     
1 1 1 -21 15 5  o 0 124.1   8     ?     ?   212.422   179.009      270.157    179.009      76.9407    179.009      
1 1 1 -21 15 4  o 0 212.2   9.5   ?     ?   264.059   -154.254     380.731    -154.254     139.669    -154.254     
1 1 1 -21 15 3  o 0 136.7   8.8   ?     ?   188.198   -39.4839     315.234    -39.4839     142.877    -39.4839     
1 1 1 -21 15 2  o 0 281.7   10.4  ?     ?   279.942   -95.7487     468.236    -95.7487     211.161    -95.7487     
1 1 1 -21 15 1  o 0 45.8    7.2   ?     ?   289.643   176.314      20.4882    176.314      236.977    -3.68621     
1 1 1 21  15 0  o 0 47.7    8.3   ?     ?   179.428   17.6556      111.267    17.6556      50.8011    -162.344     
1 1 1 21  15 1  o 0 14.8    7.5   ?     ?   148.912   -38.3333     16.6797    141.667      151.171    141.667      
1 1 1 21  15 2  o 0 59.7    8.1   ?     ?   160.625   -90.1025     161.276    -90.1025     11.146     -90.1025     
1 1 1 21  15 3  o 0 43.8    9.9   ?     ?   177.201   45.5327      97.244     45.5327      68.2186    -134.467     
1 1 1 21  15 4  o 0 54.6    10.4  ?     ?   206.736   27.0568      109.288    27.0568      83.482     -152.943     
1 1 1 21  15 5  o 0 317.4   14.3  ?     ?   305.611   40.7957      497.443    40.7957      213.006    40.7957      
1 1 1 21  15 6  o 0 22.2    9.8   ?     ?   142.699   -55.5174     30.2123    -55.5174     103.288    124.483      
1 1 1 21  15 7  o 0 38.8    12.7  ?     ?   65.5077   12.6018      117.459    12.6018      56.3443    12.6018      
1 1 1 21  15 8  o 0 146.9   14.8  ?     ?   237.641   31.231       301.826    31.231       88.2777    31.231       
1 1 1 21  15 9  o 0 143.5   16.5  ?     ?   215.903   91.1874      312.951    91.1874      119.654    91.1874      
1 1 1 21  15 10 o 0 13      16.9  ?     ?   95.9034   84.8261      32.2517    84.826       51.4696    -95.174      
1 1 1 21  15 11 o 0 95.4    22.3  ?     ?   143.64    13.9713      255.979    13.9713      131.166    13.9713      
1 1 1 21  15 12 o 0 116.3   26.1  ?     ?   245.831   -59.5728     223.74     -59.5728     13.9898    -59.5728     
1 1 1 21  15 13 f 1 48.4    27.1  ?     ?   214.29    164.8        63.9166    164.8        119.249    -15.1995     
1 1 1 21  15 14 < 0 13.6    21.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 17 8  < 0 19.6    11.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 17 7  < 0 13.7    9.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 17 6  < 0 -1.3    10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -21 17 5  o 0 20.6    11.6  ?     ?   148.115   53.5686      34.9036    53.5686      84.0039    -126.431     
1 1 1 -21 17 4  o 0 19.5    10.3  ?     ?   91.3715   110.716      61.4444    110.716      12.1926    -69.2844     
1 1 1 -21 17 3  o 0 36.2    10.3  ?     ?   166.275   -174.917     90.216     -174.917     44.2414    5.0834       
1 1 1 -21 17 2  f 1 31.8    11.7  ?     ?   171.374   133.571      63.7523    133.571      75.9488    -46.4286     
1 1 1 -21 17 1  o 0 28.9    11.5  ?     ?   134.014   -160.283     79.1646    -160.283     29.7908    19.7166      
1 1 1 21  17 0  o 0 50.3    12.3  ?     ?   151.012   -121.187     148.672    -121.187     23.4285    -121.187     
1 1 1 21  17 1  o 0 7.6     11.7  ?     ?   37.9855   -27.3068     21.966     -27.3068     9.52588    152.693      
1 1 1 21  17 2  f 1 92.5    12.9  ?     ?   172.726   48.2248      240.875    48.2248      97.0574    48.2248      
1 1 1 21  17 3  o 0 273.6   20.5  ?     ?   222.93    75.8974      494.46     75.8974      310.022    75.8974      
1 1 1 21  17 4  o 0 111.8   15.6  ?     ?   183.79    116.917      271.09     116.917      119.292    116.917      
1 1 1 21  17 5  < 0 108.6   18.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 21  17 6  < 0 -9.8    16.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 21  17 7  < 0 37.2    19.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 21  17 8  < 0 25.2    15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 0  28 < 0 20.9    22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 0  27 o 0 30.4    21    ?     ?   77.7065   0            81.6242    0            10.6879    0            
1 1 1 -22 0  26 o 0 24.9    19.4  ?     ?   53.7144   0            44.4529    0            5.69961    180          
1 1 1 -22 0  25 o 0 249     22    ?     ?   214.975   0            374.786    0            160.247    0            
1 1 1 -22 0  24 o 0 119     16.7  ?     ?   356.905   180          260.663    180          96.7258    1.89091e-14  
1 1 1 -22 0  23 o 0 43.7    15.4  ?     ?   22.2066   180          30.8377    180          10.3178    180          
1 1 1 -22 0  22 o 0 5.9     14.2  ?     ?   20.5667   0            4.63627    0            14.4875    180          
1 1 1 -22 0  21 o 0 452.8   17.9  ?     ?   410.118   180          506.111    180          111.262    180          
1 1 1 -22 0  20 o 0 141.7   10.4  ?     ?   239.272   180          284.72     180          48.2912    180          
1 1 1 -22 0  19 o 0 12.5    8.4   ?     ?   50.6165   0            9.71716    0            41.6308    180          
1 1 1 -22 0  18 o 0 56.5    7.9   ?     ?   374.805   0            156.333    0            183.196    180          
1 1 1 -22 0  17 o 0 284.1   12.6  ?     ?   318.117   0            367.087    0            79.1898    0            
1 1 1 -22 0  16 o 0 76.7    6.8   ?     ?   7.3415    180          6.21144    180          0.62349    6.9903e-14   
1 1 1 -22 0  15 o 0 1008.5  41    ?     ?   393.27    0            704.303    0            335.683    0            
1 1 1 -22 0  14 f 1 82.2    9.7   ?     ?   422.832   180          187.891    180          207.169    6.36377e-15  
1 1 1 -22 0  13 o 0 735.4   23.7  ?     ?   896.45    180          593.159    180          244.923    1.69932e-14  
1 1 1 -22 0  12 o 0 461.1   13.2  ?     ?   531.567   180          472.227    180          33.9141    9.77021e-14  
1 1 1 -22 0  11 o 0 661.9   18    ?     ?   543.371   180          568.439    180          48.6406    180          
1 1 1 -22 0  10 o 0 932.1   33.7  ?     ?   494.293   0            712.84     0            218.921    0            
1 1 1 -22 0  9  f 1 338     9.3   ?     ?   241.97    0            424.399    0            180.501    0            
1 1 1 -22 0  8  o 0 3083.6  74.6  ?     ?   1452.99   0            1305.14    0            156.36     180          
1 1 1 -22 0  7  f 1 453.1   12.8  ?     ?   745.703   0            501.731    0            254.1      180          
1 1 1 -22 0  6  f 1 989.1   25.5  ?     ?   673.494   180          759.831    180          60.0673    180          
1 1 1 -22 0  5  o 0 3.9     1.6   ?     ?   97.0377   180          3.97446    180          95.6352    2.91604e-16  
1 1 1 -22 0  4  o 0 6.9     1.5   ?     ?   76.6563   180          6.52303    180          72.2784    6.33248e-16  
1 1 1 -22 0  3  o 0 9.3     1.2   ?     ?   54.0783   0            6.38595    0            49.2791    180          
1 1 1 -22 0  2  f 1 1863.3  45.6  ?     ?   1087.96   0            1048.77    0            78.3848    180          
1 1 1 -22 0  1  o 0 1392.9  35.3  ?     ?   919.617   0            838.902    0            37.9496    180          
1 1 1 22  0  0  o 0 333.3   14.3  ?     ?   572.579   -2.606e-14   410.908    0            135.967    180          
1 1 1 22  0  1  o 0 17.4    1.8   ?     ?   22.7047   0            4.69309    0            17.0326    180          
1 1 1 22  0  2  f 1 84.7    4.6   ?     ?   361.947   0            212.51     0            165.09     180          
1 1 1 22  0  3  o 0 794.2   21.6  ?     ?   753.564   0            690.841    0            92.7077    180          
1 1 1 22  0  4  o 0 1898    47.8  ?     ?   692.867   0            1069.34    0            347.802    0            
1 1 1 22  0  5  o 0 655.1   18.2  ?     ?   526.009   0            629.096    0            80.7196    0            
1 1 1 22  0  6  f 1 112.7   5.4   ?     ?   257.269   180          235.881    180          36.2063    4.57132e-14  
1 1 1 22  0  7  f 1 366.6   17.5  ?     ?   618.196   180          459.973    180          179.119    1.80188e-14  
1 1 1 22  0  8  o 0 192.2   13.7  ?     ?   307.997   0            326.108    0            9.54862    0            
1 1 1 22  0  9  f 1 855.7   22.8  ?     ?   1090.5    0            701.846    0            423.239    180          
1 1 1 22  0  10 o 0 69.6    9.4   ?     ?   19.8316   0            17.1225    0            3.4389     180          
1 1 1 22  0  11 o 0 3838.6  92.4  ?     ?   1346.26   180          1405.08    180          82.6964    180          
1 1 1 22  0  12 o 0 1231.5  34.1  ?     ?   770.784   180          793.529    180          38.7918    180          
1 1 1 22  0  13 o 0 13.6    11.9  ?     ?   66.557    180          6.87935    180          57.2063    8.43794e-16  
1 1 1 22  0  14 f 1 739.6   27.3  ?     ?   317.645   180          609.702    180          303.573    180          
1 1 1 22  0  15 o 0 48.9    17.2  ?     ?   427.807   0            132.096    0            282.16     180          
1 1 1 22  0  16 o 0 418.2   22.2  ?     ?   431.54    0            465.915    0            58.8778    0            
1 1 1 22  0  17 o 0 49.4    19.6  ?     ?   146.881   0            70.2736    0            67.4836    180          
1 1 1 22  0  18 o 0 50.9    22.3  ?     ?   37.133    0            23.643     0            11.2736    180          
1 1 1 22  0  19 o 0 127.4   27.4  ?     ?   310.317   0            276.25     0            51.06      180          
1 1 1 22  0  20 o 0 472.9   33.1  ?     ?   465.049   0            541.79     0            63.1954    0            
1 1 1 22  0  21 o 0 12.5    28.2  ?     ?   196.415   0            64.0146    0            133.281    180          
1 1 1 22  0  22 o 0 20.9    31.2  ?     ?   98.6092   0            53.1056    0            43.0915    180          
1 1 1 22  0  23 o 0 34.9    32    ?     ?   127.62    0            88.5916    0            35.9755    180          
1 1 1 22  0  24 o 0 -8.4    37.4  ?     ?   11.8119   180          5.95826    180          6.45078    6.48098e-15  
1 1 1 22  0  26 o 0 9.8     35    ?     ?   4.49915   180          3.78863    180          0.578381   4.59623e-14  
1 1 1 22  0  27 o 0 11.4    31.6  ?     ?   13.9783   0            13.6829    0            0.214456   0            
1 1 1 -22 2  27 o 0 98.6    15    ?     ?   215.303   -50.7911     241.369    -50.7911     46.5297    -50.7911     
1 1 1 -22 2  26 o 0 15.6    13.7  ?     ?   138.328   -32.8555     15.3294    -32.8555     112.749    147.144      
1 1 1 -22 2  25 o 0 26.3    14.9  ?     ?   114.736   110.639      63.8423    110.639      45.9224    -69.3608     
1 1 1 -22 2  24 o 0 342     14.1  ?     ?   363.866   -14.8004     509.113    -14.8004     147.538    -14.8004     
1 1 1 -22 2  23 o 0 104.1   9     ?     ?   303.772   -38.6031     169.165    -38.6031     111.929    141.397      
1 1 1 -22 2  22 o 0 168.7   9.7   ?     ?   284.634   -113.129     317.909    -113.129     55.0791    -113.129     
1 1 1 -22 2  21 o 0 456     15.2  ?     ?   425.743   -116.806     582.339    -116.806     175.141    -116.806     
1 1 1 -22 2  20 o 0 226     10.7  ?     ?   317.822   -160.425     373.26     -160.425     61.1624    -160.425     
1 1 1 -22 2  19 o 0 78      6.3   ?     ?   217.765   69.412       140.748    69.412       78.8782    -110.588     
1 1 1 -22 2  18 o 0 113.7   6.6   ?     ?   208.293   114.132      192.015    114.132      4.34971    114.132      
1 1 1 -22 2  17 o 0 254.1   8.5   ?     ?   295.617   3.18392      359.81     3.18392      93.6167    3.18392      
1 1 1 -22 2  16 o 0 944.3   28.4  ?     ?   579.981   64.0898      788.383    64.0898      262.098    64.0898      
1 1 1 -22 2  15 o 0 433.6   10    ?     ?   654.427   25.1732      275.794    25.1732      335.067    -154.827     
1 1 1 -22 2  14 o 0 488.2   10.7  ?     ?   519.977   -35.1163     445.456    -35.1163     49.0943    144.884      
1 1 1 -22 2  13 f 1 1136.7  22.7  ?     ?   686.987   -146.811     795.289    -146.811     151.8      -146.811     
1 1 1 -22 2  12 o 0 517.3   10.6  ?     ?   607.975   95.3146      385.739    95.3146      191.593    -84.6854     
1 1 1 -22 2  11 o 0 1000.3  19.4  ?     ?   618.854   103.518      769.884    103.518      179.163    103.518      
1 1 1 -22 2  10 o 0 894.6   16.5  ?     ?   845.94    12.7105      488.969    12.7105      322.296    -167.289     
1 1 1 -22 2  9  o 0 1001.7  18.1  ?     ?   648.438   150.622      799.462    150.622      149.876    150.622      
1 1 1 -22 2  8  o 0 489.8   13.4  ?     ?   736.136   -161.77      270.572    -161.77      469.542    18.2295      
1 1 1 -22 2  7  f 1 430     9.9   ?     ?   564.557   -88.694      366.682    -88.694      205.622    91.306       
1 1 1 -22 2  6  o 0 760.1   18.2  ?     ?   741.286   -7.14974     524.2      -7.14974     225.387    172.85       
1 1 1 -22 2  5  o 0 664.1   12.3  ?     ?   662.573   -50.1553     533.353    -50.1553     147.606    129.845      
1 1 1 -22 2  4  o 0 732.3   13.4  ?     ?   679.209   -155.611     580.76     -155.611     118.586    24.389       
1 1 1 -22 2  3  o 0 1552.2  27    ?     ?   714.665   -140.066     1146.64    -140.066     409.63     -140.066     
1 1 1 -22 2  2  o 0 251.8   5.1   ?     ?   296.122   -73.1942     384.647    -73.1942     78.8409    -73.1942     
1 1 1 -22 2  1  o 0 539.8   10.4  ?     ?   396.143   -30.0133     663.95     -30.0133     254.322    -30.0133     
1 1 1 22  2  0  o 0 174.3   5.7   ?     ?   308.507   17.9717      243.531    17.9717      74.3029    -162.028     
1 1 1 22  2  1  o 0 372     8     ?     ?   482.892   -165.401     391.919    -165.401     106.642    14.5989      
1 1 1 22  2  2  o 0 2794.5  48.4  ?     ?   1157.53   -130.611     1360.85    -130.611     163.193    -130.611     
1 1 1 22  2  3  o 0 625.6   12.1  ?     ?   781.707   -143.307     382.829    -143.307     427.591    36.6927      
1 1 1 22  2  5  o 0 261.3   6.7   ?     ?   337.696   -144.701     368.411    -144.701     14.2625    -144.701     
1 1 1 22  2  6  o 0 798.4   15.5  ?     ?   647.819   118.067      656.305    118.067      8.21724    -61.9325     
1 1 1 22  2  7  f 1 457.8   9.7   ?     ?   436.331   123.511      524.849    123.511      74.9911    123.511      
1 1 1 22  2  8  o 0 245.5   7     ?     ?   484.519   -65.9834     207.394    -65.9834     289.231    114.017      
1 1 1 22  2  9  o 0 54.9    4.5   ?     ?   212.978   148.537      10.9568    148.537      207.038    -31.4628     
1 1 1 22  2  10 o 0 713     15.8  ?     ?   557.774   -172.434     624.487    -172.434     76.7964    -172.434     
1 1 1 22  2  11 o 0 259.2   8.7   ?     ?   430.307   21.5906      255.166    21.5906      166.234    -158.409     
1 1 1 22  2  12 o 0 537.6   14.4  ?     ?   565.017   -19.106      455.497    -19.106      96.0163    160.894      
1 1 1 22  2  13 f 1 444.9   15.4  ?     ?   240.451   76.1742      616.767    76.1742      384.822    76.1742      
1 1 1 22  2  14 o 0 498.2   16.6  ?     ?   319.421   89.4965      640.989    89.4965      331.3      89.4965      
1 1 1 22  2  15 o 0 617.8   18.6  ?     ?   441.909   -120.044     656.744    -120.044     230.397    -120.044     
1 1 1 22  2  16 o 0 307.9   15.7  ?     ?   456.342   11.8652      323.438    11.8652      105.337    -168.135     
1 1 1 22  2  17 o 0 50.6    15.3  ?     ?   78.5542   88.7938      44.5973    88.7938      29.421     -91.2062     
1 1 1 22  2  18 o 0 72.6    13    ?     ?   281.469   -14.6247     55.7357    -14.6247     207.803    165.375      
1 1 1 22  2  19 o 0 106.8   17.7  ?     ?   330.186   164.436      125.998    164.436      220.704    -15.5637     
1 1 1 22  2  20 o 0 211.6   17.7  ?     ?   232.667   -157.985     437.23     -157.985     198.917    -157.985     
1 1 1 22  2  21 o 0 53.7    19.2  ?     ?   112.838   110.482      155.712    110.482      45.7379    110.482      
1 1 1 22  2  22 o 0 265.9   22.5  ?     ?   277.246   -156.081     496.16     -156.081     227.101    -156.081     
1 1 1 22  2  23 o 0 -14.1   25.4  ?     ?   136.826   -108.04      25.2128    71.9605      158.038    71.9605      
1 1 1 22  2  24 o 0 119.9   29.3  ?     ?   361.161   -99.1849     134.639    -99.1849     245.447    80.8151      
1 1 1 22  2  25 o 0 52.1    33.1  ?     ?   116.121   -103.227     156.725    -103.227     39.7108    -103.227     
1 1 1 22  2  26 o 0 29.2    37.4  ?     ?   80.0403   138.255      117.655    138.255      40.4489    138.255      
1 1 1 -22 4  27 < 0 19.5    12.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 4  26 o 0 72.6    15.6  ?     ?   192.418   121.25       189.202    121.25       16.2353    121.25       
1 1 1 -22 4  25 o 0 18.4    10.2  ?     ?   130.049   123.946      29.5011    123.946      90.3708    -56.0545     
1 1 1 -22 4  24 o 0 72.6    9.3   ?     ?   177.898   -143.83      195.471    -143.83      20.1529    -143.83      
1 1 1 -22 4  23 o 0 72.8    9.7   ?     ?   197.488   38.6004      180.044    38.6004      15.2952    -141.4       
1 1 1 -22 4  22 o 0 105.8   8.1   ?     ?   144.773   7.59785      289.592    7.59785      157.412    7.59785      
1 1 1 -22 4  21 o 0 26.9    6.8   ?     ?   121.24    -43.0545     55.3653    -43.0545     56.0571    136.946      
1 1 1 -22 4  20 o 0 94.8    7.3   ?     ?   165.215   -20.7034     247.189    -20.7034     89.9294    -20.7034     
1 1 1 -22 4  19 o 0 30.5    5.6   ?     ?   238.956   -32.2931     18.5803    147.707      252.092    147.707      
1 1 1 -22 4  18 o 0 69.2    6.2   ?     ?   104.593   6.24351      145.458    6.24351      40.4904    6.24351      
1 1 1 -22 4  17 o 0 8.1     6     ?     ?   30.9351   158.365      19.8529    -21.6354     47.5856    -21.6354     
1 1 1 -22 4  16 o 0 212.4   7.3   ?     ?   287.946   -123.951     303.186    -123.951     45.2042    -123.951     
1 1 1 -22 4  15 o 0 341.2   10.4  ?     ?   589.36    -67.6086     241.567    -67.6086     290.519    112.391      
1 1 1 -22 4  14 o 0 335.4   9.6   ?     ?   303.202   173.68       448.024    173.68       166.448    173.68       
1 1 1 -22 4  13 o 0 406     8.9   ?     ?   241.957   -75.133      565.989    -75.133      337.039    -75.133      
1 1 1 -22 4  12 o 0 1900.4  33.3  ?     ?   995.637   -37.1605     946.715    -37.1605     23.6315    -37.1605     
1 1 1 -22 4  11 o 0 631.4   14.3  ?     ?   711.162   129.417      395.427    129.417      276.452    -50.583      
1 1 1 -22 4  10 o 0 329.6   6.8   ?     ?   431.525   126.215      336.958    126.215      72.8709    -53.7849     
1 1 1 -22 4  9  o 0 2144.4  37.6  ?     ?   866.363   -154.131     1190.35    -154.131     363.64     -154.131     
1 1 1 -22 4  8  o 0 942.1   17.3  ?     ?   578.446   124.932      808.436    124.932      224.836    124.932      
1 1 1 -22 4  7  o 0 960.7   17.6  ?     ?   709.269   106.809      709.949    106.809      0.245393   106.809      
1 1 1 -22 4  5  o 0 472.7   10.5  ?     ?   411.911   -160.994     554.84     -160.994     140.174    -160.994     
1 1 1 -22 4  4  o 0 1815.6  36    ?     ?   931.706   156.359      1046.38    156.359      106.228    156.359      
1 1 1 -22 4  3  o 0 713.4   20.1  ?     ?   837.135   48.5699      389.852    48.5699      456.53     -131.43      
1 1 1 -22 4  2  o 0 212.5   7.2   ?     ?   441.649   32.2136      196.107    32.2136      261.408    -147.786     
1 1 1 -22 4  1  o 0 973.9   19.3  ?     ?   673.364   -157.408     781.565    -157.408     83.1095    -157.408     
1 1 1 22  4  0  o 0 2275.7  45.7  ?     ?   913.032   -139.853     1334.37    -139.853     391.969    -139.853     
1 1 1 22  4  1  o 0 717.7   15.6  ?     ?   682.505   -132.784     556.63     -132.784     149.21     47.2155      
1 1 1 22  4  2  o 0 459.2   10.4  ?     ?   529.173   -61.1925     436.905    -61.1925     99.0398    118.808      
1 1 1 22  4  3  o 0 221.8   5.6   ?     ?   409.05    -68.1829     235.863    -68.1829     179.058    111.817      
1 1 1 22  4  4  o 0 1156.3  21.4  ?     ?   595.573   -18.9014     972.766    -18.9014     367.946    -18.9014     
1 1 1 22  4  5  o 0 1512.5  27    ?     ?   595.543   -20.9444     1205.65    -20.9444     600.454    -20.9444     
1 1 1 22  4  6  o 0 5466.2  99.2  ?     ?   1833.5    -46.4081     1635.57    -46.4081     227.912    133.592      
1 1 1 22  4  7  o 0 1745.9  36.1  ?     ?   944.004   18.1658      1002.27    18.1658      43.2709    18.1658      
1 1 1 22  4  8  o 0 1574.4  35.8  ?     ?   774.123   -117.384     1058.07    -117.384     263.022    -117.384     
1 1 1 22  4  9  o 0 1737.6  34.1  ?     ?   950.085   -146.122     927.442    -146.122     2.22539    -146.122     
1 1 1 22  4  10 o 0 537.7   14.3  ?     ?   551.763   20.936       465.426    20.936       70.6443    -159.064     
1 1 1 22  4  11 o 0 560.3   15    ?     ?   467.422   123.025      563.5      123.025      116.599    123.025      
1 1 1 22  4  12 o 0 1138.1  27.6  ?     ?   586.241   14.1469      907.225    14.1469      348.69     14.1469      
1 1 1 22  4  13 o 0 996.3   22.7  ?     ?   562.772   153.046      856.829    153.046      314.986    153.046      
1 1 1 22  4  14 o 0 2043.5  39.6  ?     ?   806.705   167.866      1250.15    167.866      477.024    167.866      
1 1 1 22  4  15 o 0 174.4   11.9  ?     ?   156.727   169.253      300.321    169.253      154        169.253      
1 1 1 22  4  16 o 0 89.2    12.3  ?     ?   95.3024   123.352      140.117    123.352      50.8668    123.352      
1 1 1 22  4  17 o 0 51      12.7  ?     ?   270.259   -19.6717     0.759803   160.328      252.313    160.328      
1 1 1 22  4  18 o 0 183.5   17.9  ?     ?   154.266   157.964      418.422    157.964      257.359    157.964      
1 1 1 22  4  19 o 0 31      15.8  ?     ?   156.035   133.623      25.9877    133.623      132.959    -46.3774     
1 1 1 22  4  20 o 0 14.9    18.8  ?     ?   48.9697   149.45       10.449     149.45       38.2368    -30.5504     
1 1 1 22  4  21 o 0 104.1   19.2  ?     ?   113.841   175.55       305.959    175.55       196.462    175.55       
1 1 1 22  4  22 o 0 118.2   24.8  ?     ?   59.6715   -82.1013     324.387    -82.1013     266.75     -82.1013     
1 1 1 22  4  23 o 0 10.5    23.9  ?     ?   82.0997   -173.059     35.9861    -173.059     49.3538    6.94054      
1 1 1 22  4  24 o 0 -14.1   29.3  ?     ?   44.9126   -175.849     18.8585    -175.849     26.1835    4.15082      
1 1 1 22  4  25 o 0 -40.9   24.2  ?     ?   98.1548   -117.133     22.5892    62.8669      118.07     62.8669      
1 1 1 22  4  26 o 0 22.8    25.2  ?     ?   148       -58.4271     59.1937    -58.4271     81.8292    121.573      
1 1 1 -22 6  26 < 0 33.9    12.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 6  25 o 0 48.9    12.4  ?     ?   163.551   -44.5735     140.97     -44.5736     4.23096    135.426      
1 1 1 -22 6  24 o 0 23.8    11.6  ?     ?   28.0744   -170.452     40.7216    -170.452     15.1661    -170.452     
1 1 1 -22 6  23 o 0 4.9     8.9   ?     ?   87.2862   -16.5849     22.5792    163.415      107.522    163.415      
1 1 1 -22 6  22 o 0 118.5   9.8   ?     ?   251.743   38.5321      243.377    38.5321      2.48763    -141.468     
1 1 1 -22 6  21 f 1 53.5    9.9   ?     ?   133.819   122.42       157.205    122.42       34.8947    122.42       
1 1 1 -22 6  20 o 0 2.9     7.8   ?     ?   38.5019   147.658      17.8184    -32.3422     52.7498    -32.3422     
1 1 1 -22 6  19 o 0 22.6    6.7   ?     ?   147.671   24.8623      14.3859    24.8623      124.362    -155.138     
1 1 1 -22 6  18 o 0 9.6     6.6   ?     ?   141.715   -94.5624     70.0029    85.4376      206.69     85.4376      
1 1 1 -22 6  17 o 0 12.6    5.3   ?     ?   102.561   25.6891      49.6525    -154.311     151.233    -154.311     
1 1 1 -22 6  16 o 0 62.4    5.5   ?     ?   216.292   -56.8915     94.7812    -56.8915     121.264    123.108      
1 1 1 -22 6  15 o 0 249.6   7.7   ?     ?   226.485   -6.97121     404.273    -6.97121     202.301    -6.97121     
1 1 1 -22 6  14 o 0 300.1   10.7  ?     ?   308.479   -175.013     407.382    -175.013     132.612    -175.013     
1 1 1 -22 6  13 o 0 1253.8  23.5  ?     ?   877.821   149.183      707.567    149.183      96.6391    -30.8174     
1 1 1 -22 6  12 o 0 123.1   4.7   ?     ?   178.785   69.1109      173.193    69.1109      8.31486    69.1109      
1 1 1 -22 6  11 o 0 427.2   9.3   ?     ?   557.377   30.5061      344.927    30.5061      178.516    -149.494     
1 1 1 -22 6  10 o 0 2095.8  36.9  ?     ?   939.42    93.7258      1083.43    93.7258      219.517    93.7258      
1 1 1 -22 6  9  o 0 2312.6  40.8  ?     ?   803.228   36.6529      1310.91    36.6529      568.427    36.6529      
1 1 1 -22 6  8  o 0 238.9   7.9   ?     ?   330.016   17.6634      295.197    17.6634      15.3284    -162.337     
1 1 1 -22 6  7  o 0 1384.9  25    ?     ?   676.387   62.0754      954.515    62.0754      315.416    62.0754      
1 1 1 -22 6  6  o 0 378.6   8.4   ?     ?   541.357   -111.987     299.886    -111.987     213.509    68.0131      
1 1 1 -22 6  5  o 0 345.3   8.2   ?     ?   382.869   96.7275      396.016    96.7275      31.7646    96.7275      
1 1 1 -22 6  4  o 0 891.4   17.5  ?     ?   556.974   -141.156     785.952    -141.156     226.552    -141.156     
1 1 1 -22 6  3  o 0 2519.4  56.3  ?     ?   935.288   153.413      1380.25    153.413      449.995    153.413      
1 1 1 -22 6  2  o 0 270     7.4   ?     ?   378.377   67.2616      329.59     67.2616      47.4322    -112.738     
1 1 1 -22 6  1  o 0 989.6   24.9  ?     ?   909.629   83.0921      536.201    83.0921      371.437    -96.9079     
1 1 1 22  6  0  o 0 208.1   5.3   ?     ?   324.204   -87.9834     278.593    -87.9834     44.0734    92.0166      
1 1 1 22  6  1  o 0 401.3   8.4   ?     ?   356.2     74.333       516.423    74.333       161.359    74.333       
1 1 1 22  6  2  o 0 1978.4  35.2  ?     ?   1070.23   47.7967      987.344    47.7967      80.8339    -132.203     
1 1 1 22  6  3  o 0 2131.4  38.2  ?     ?   741.016   73.9326      1386.93    73.9326      646.642    73.9326      
1 1 1 22  6  4  o 0 1195.9  22.4  ?     ?   619.267   -24.7552     905.763    -24.7552     310.743    -24.7552     
1 1 1 22  6  5  o 0 3484.2  60.5  ?     ?   1376.19   -79.3525     1282.04    -79.3525     40.3477    100.648      
1 1 1 22  6  6  o 0 354.3   10    ?     ?   374.658   -108.022     417.054    -108.022     57.2021    -108.022     
1 1 1 22  6  7  o 0 19.1    5.7   ?     ?   110.522   174.459      58.3466    -5.54052     164.396    -5.54052     
1 1 1 22  6  8  o 0 404.3   14.6  ?     ?   711.448   -116.122     178.281    -116.122     503.32     63.8782      
1 1 1 22  6  9  o 0 960.3   29.5  ?     ?   573.747   -162.338     787.951    -162.338     246.58     -162.338     
1 1 1 22  6  10 o 0 495.8   17.4  ?     ?   501.463   -13.3906     463.839    -13.3906     8.05722    166.609      
1 1 1 22  6  11 o 0 431.7   13.4  ?     ?   480.6     -30.1288     431.478    -30.1288     25.9443    149.871      
1 1 1 22  6  12 o 0 191.1   9.7   ?     ?   341.378   77.4528      227.148    77.4528      96.5331    -102.547     
1 1 1 22  6  13 o 0 68.6    9.1   ?     ?   294.076   92.9395      21.3291    92.9395      250.512    -87.0605     
1 1 1 22  6  14 o 0 57.8    11.3  ?     ?   185.998   -23.0982     38.8077    -23.0982     132.293    156.902      
1 1 1 22  6  15 o 0 39.8    10.7  ?     ?   209.302   24.7015      4.00147    -155.299     197.185    -155.299     
1 1 1 22  6  16 o 0 245.6   15.1  ?     ?   378.93    68.5093      346.696    68.5093      45.8961    -111.491     
1 1 1 22  6  17 o 0 169     13.3  ?     ?   260.928   -5.7061      333.491    -5.7061      69.5534    -5.7061      
1 1 1 22  6  18 o 0 53.4    13.3  ?     ?   100.599   80.2257      152.173    80.2257      52.7921    80.2257      
1 1 1 22  6  19 o 0 81.7    14.3  ?     ?   159.071   -32.6835     230.759    -32.6835     78.6328    -32.6835     
1 1 1 22  6  20 o 0 74.4    18.4  ?     ?   113.752   90.6582      224.753    90.6582      116.393    90.6582      
1 1 1 22  6  21 f 1 85.3    23.5  ?     ?   221.875   6.26389      183.559    6.26389      29.016     -173.736     
1 1 1 22  6  22 o 0 133.1   24.1  ?     ?   241.446   7.86426      285.421    7.86426      37.7124    7.86426      
1 1 1 22  6  23 o 0 -1.3    29.6  ?     ?   224.723   45.0695      54.1291    -134.93      276.597    -134.93      
1 1 1 22  6  24 o 0 56      32.2  ?     ?   180.843   86.6726      114.234    86.6726      59.4376    -93.3274     
1 1 1 22  6  25 o 0 127     29.8  ?     ?   209.905   75.6028      292.023    75.6028      94.5454    75.6028      
1 1 1 -22 8  25 < 1 13.2    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 8  24 o 0 -2.1    11.6  ?     ?   71.6958   -83.4912     0.150881   -83.4912     62.3421    96.5088      
1 1 1 -22 8  23 o 0 7.1     12.5  ?     ?   107.265   -171.672     6.04779    -171.672     88.3431    8.32816      
1 1 1 -22 8  22 o 0 115.6   15.6  ?     ?   197.171   44.7329      280.623    44.7329      99.032     44.7329      
1 1 1 -22 8  21 o 0 94.7    10.2  ?     ?   106.475   147.212      295.056    147.212      192.463    147.212      
1 1 1 -22 8  20 o 0 33.4    8.4   ?     ?   86.4179   2.54148      97.0906    2.54148      16.4285    2.54148      
1 1 1 -22 8  19 o 0 -1.6    7.6   ?     ?   63.2554   121.587      35.8492    -58.4125     92.2414    -58.4125     
1 1 1 -22 8  18 o 0 15.5    7     ?     ?   57.99     119.336      5.28513    119.336      46.717     -60.6638     
1 1 1 -22 8  17 o 0 126.7   7.5   ?     ?   272.236   78.7945      233.265    78.7945      19.4031    -101.206     
1 1 1 -22 8  16 o 0 325.5   9.5   ?     ?   472.824   115.814      364.54     115.814      85.6686    -64.1862     
1 1 1 -22 8  15 o 0 106.4   6.1   ?     ?   256.033   -155.112     195.848    -155.112     49.9659    24.888       
1 1 1 -22 8  14 o 0 201.8   7.7   ?     ?   126.297   -110.16      433.477    -110.16      309.097    -110.16      
1 1 1 -22 8  13 o 0 160.2   6.3   ?     ?   445.083   -58.8793     108.323    -58.8793     282.749    121.121      
1 1 1 -22 8  12 o 0 826.2   16    ?     ?   663.957   -41.9272     609.668    -41.9272     22.2568    -41.9272     
1 1 1 -22 8  11 o 0 346.2   8     ?     ?   527.07    -48.8518     293.077    -48.8518     172.148    131.148      
1 1 1 -22 8  10 o 0 1595.5  28.8  ?     ?   767.738   -47.2429     1009.12    -47.2429     327.444    -47.2429     
1 1 1 -22 8  9  o 0 271.6   7.7   ?     ?   451.995   -30.7609     250.468    -30.7609     161.625    149.239      
1 1 1 -22 8  8  o 0 73.1    3.4   ?     ?   547.705   14.6923      172.842    -165.308     674.664    -165.308     
1 1 1 -22 8  7  o 0 1808.1  32    ?     ?   988.27    80.6034      910.93     80.6034      9.58628    -99.3966     
1 1 1 -22 8  6  o 0 511.8   10.6  ?     ?   519.056   -117.478     449.77     -117.478     22.8555    62.5221      
1 1 1 -22 8  5  o 0 2512    44.1  ?     ?   914.487   -38.0111     1284.05    -38.0111     448.489    -38.0111     
1 1 1 -22 8  4  o 0 1159.7  21.8  ?     ?   693.185   -76.0801     794.353    -76.0801     159.117    -76.0801     
1 1 1 -22 8  3  o 0 911.7   19    ?     ?   740.451   60.4272      588.912    60.4272      91.3257    -119.573     
1 1 1 -22 8  2  o 0 811.5   19    ?     ?   787.823   2.74255      474.649    2.74255      250.57     -177.257     
1 1 1 -22 8  1  o 0 106.1   4     ?     ?   283.016   138.575      96.5051    138.575      164.429    -41.4253     
1 1 1 22  8  0  o 0 1636.3  35.2  ?     ?   1332.83   40.4562      501.091    40.4562      729.515    -139.544     
1 1 1 22  8  1  o 0 3.9     3.3   ?     ?   167.827   71.82        140.197    -108.18      295.328    -108.18      
1 1 1 22  8  2  o 0 272.4   6.9   ?     ?   371.92    -28.6363     309.713    -28.6363     34.3422    151.364      
1 1 1 22  8  3  o 0 1014.8  19.5  ?     ?   856.877   -107.618     561.568    -107.618     231.423    72.382       
1 1 1 22  8  4  o 0 50.9    5.1   ?     ?   198.618   150.117      5.9472     -29.8831     189.752    -29.8831     
1 1 1 22  8  5  o 0 130.7   6.3   ?     ?   77.0792   151.953      128.338    151.953      57.0416    151.953      
1 1 1 22  8  6  o 0 141.4   6     ?     ?   221.283   178.399      196.23     178.399      8.25333    -1.60129     
1 1 1 22  8  7  o 0 288.9   9.7   ?     ?   99.669    8.67815      391.484    8.67815      298.165    8.67815      
1 1 1 22  8  8  o 0 95.1    7     ?     ?   303.571   -46.2355     65.2932    -46.2355     218.372    133.765      
1 1 1 22  8  9  o 0 41.4    7.9   ?     ?   130.664   -111.861     11.4229    68.1392      133.212    68.1392      
1 1 1 22  8  10 o 0 1774.4  34.8  ?     ?   830.65    -98.4715     1074.38    -98.4715     318.576    -98.4715     
1 1 1 22  8  11 o 0 640.8   17.1  ?     ?   640.116   -122.866     499.248    -122.866     81.1124    57.1344      
1 1 1 22  8  12 o 0 12.9    9.8   ?     ?   265.828   27.4438      152.303    -152.556     394.434    -152.556     
1 1 1 22  8  13 o 0 273.6   12.7  ?     ?   527.642   60.3102      211.114    60.3102      267.28     -119.69      
1 1 1 22  8  14 o 0 26.1    11.6  ?     ?   276.951   -31.8937     95.6491    148.106      377.722    148.106      
1 1 1 22  8  15 o 0 52.5    12.4  ?     ?   106.867   -112.263     126.702    -112.263     20.357     -112.263     
1 1 1 22  8  16 o 0 35.9    13.5  ?     ?   195.982   30.9246      39.6227    30.9246      150.979    -149.075     
1 1 1 22  8  17 o 0 6.7     17.3  ?     ?   89.5115   71.028       12.454     -108.972     98.9388    -108.972     
1 1 1 22  8  18 o 0 41      22    ?     ?   173.13    116.96       73.7607    116.96       88.2093    -63.0398     
1 1 1 22  8  19 o 0 417.7   26.7  ?     ?   468.352   150.612      501.405    150.612      61.0413    150.612      
1 1 1 22  8  20 o 0 45.2    22    ?     ?   143.421   -88.5469     114.94     -88.5469     30.2921    91.4531      
1 1 1 22  8  21 o 0 19.3    32.3  ?     ?   59.0924   -35.0006     74.1288    -35.0006     14.3418    -35.0006     
1 1 1 22  8  22 o 0 75.9    31.2  ?     ?   165.668   68.7157      167.098    68.7157      6.53755    68.7157      
1 1 1 22  8  23 o 0 25.3    28.2  ?     ?   161.065   -110.227     54.4208    -110.227     95.0559    69.7732      
1 1 1 22  8  24 < 0 -9.1    30.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 10 23 < 0 137.8   17.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 10 22 o 0 36      11.4  ?     ?   136.045   22.8773      110.662    22.8773      5.88597    -157.123     
1 1 1 -22 10 21 o 0 41.3    11.7  ?     ?   138.178   21.6162      128.831    21.6162      9.39436    21.6162      
1 1 1 -22 10 20 o 0 15.4    11.1  ?     ?   52.0637   -3.20826     25.2088    -3.20826     21.8615    176.792      
1 1 1 -22 10 19 o 0 21.1    9.5   ?     ?   92.9171   -107.059     47.7666    -107.059     40.0656    72.9408      
1 1 1 -22 10 18 o 0 84.6    8.2   ?     ?   195.095   4.2526       205.707    4.2526       20.8499    4.2526       
1 1 1 -22 10 17 o 0 28.6    7.4   ?     ?   142.435   -32.0373     59.7957    -32.0373     65.706     147.963      
1 1 1 -22 10 16 o 0 42.2    7     ?     ?   246.94    105.172      41.079     105.172      176.552    -74.8277     
1 1 1 -22 10 15 o 0 155.6   7.3   ?     ?   314.144   131.539      258.653    131.54       19.5183    -48.4605     
1 1 1 -22 10 14 o 0 16.4    5.3   ?     ?   112.93    -96.4925     4.20215    83.5075      107.58     83.5075      
1 1 1 -22 10 13 o 0 27.3    5.2   ?     ?   121.555   -44.9479     28.7692    -44.9479     85.2527    135.052      
1 1 1 -22 10 12 o 0 151.5   5.9   ?     ?   344.489   -43.1365     211.549    -43.1365     113.887    136.863      
1 1 1 -22 10 11 o 0 265.3   6.9   ?     ?   263.2     123.43       450.49     123.43       195.753    123.43       
1 1 1 -22 10 10 o 0 161.4   5.6   ?     ?   216.678   39.5068      319.721    39.5068      108.724    39.5068      
1 1 1 -22 10 9  o 0 165.4   5.4   ?     ?   180.16    -104.975     289.299    -104.975     133.044    -104.975     
1 1 1 -22 10 8  o 0 119.8   4.7   ?     ?   195.354   165.452      203.386    165.452      33.081     165.452      
1 1 1 -22 10 7  o 0 892.7   17.6  ?     ?   643.076   86.8263      667.451    86.8263      109.113    86.8263      
1 1 1 -22 10 6  o 0 393.9   9.4   ?     ?   487.849   121.912      373.042    121.912      52.2852    -58.0884     
1 1 1 -22 10 5  o 0 470.3   12.9  ?     ?   601.766   156.501      360.083    156.501      166.486    -23.4993     
1 1 1 -22 10 4  o 0 146.7   4.9   ?     ?   342.949   169.984      155.353    169.984      145.696    -10.0156     
1 1 1 -22 10 3  o 0 594.3   12.8  ?     ?   678.516   169.4        413.083    169.4        184.144    -10.6003     
1 1 1 -22 10 2  o 0 349.3   8.9   ?     ?   335.05    -167.646     429.545    -167.646     127.69     -167.646     
1 1 1 -22 10 1  o 0 224.7   8.2   ?     ?   492.94    -27.2935     151.239    -27.2935     293.65     152.706      
1 1 1 22  10 0  o 0 6       3.7   ?     ?   27.2282   141.212      21.2489    -38.7877     45.9687    -38.7877     
1 1 1 22  10 1  o 0 151.5   5.9   ?     ?   300.893   112.438      178.147    112.438      95.2309    -67.5625     
1 1 1 22  10 2  o 0 811.6   16.7  ?     ?   635.37    -7.06802     614.941    -7.06802     37.4672    -7.06802     
1 1 1 22  10 3  o 0 1235.1  24    ?     ?   711.415   35.0697      852.985    35.0697      219.901    35.0697      
1 1 1 22  10 4  o 0 994.5   20.5  ?     ?   874.351   98.4241      557.438    98.4241      220.264    -81.5759     
1 1 1 22  10 5  o 0 802.1   17.9  ?     ?   631.952   118.298      625.658    118.298      64.0883    118.298      
1 1 1 22  10 6  o 0 50.2    6.8   ?     ?   151.6     73.5036      23.6941    73.5036      110.832    -106.496     
1 1 1 22  10 7  o 0 156     8.2   ?     ?   300.831   30.3723      214.044    30.3723      54.7369    -149.628     
1 1 1 22  10 8  o 0 134.9   8.5   ?     ?   256.676   -82.2005     205.12     -82.2005     23.6653    97.7995      
1 1 1 22  10 9  o 0 33      7.4   ?     ?   183.198   114.692      16.2938    -65.3075     179.117    -65.3075     
1 1 1 22  10 10 o 0 353.2   11.8  ?     ?   554.695   139.97       320.135    139.97       234.637    -40.0298     
1 1 1 22  10 11 o 0 213.2   11.6  ?     ?   276.515   156.018      371.589    156.018      96.1067    156.018      
1 1 1 22  10 12 o 0 566.8   17    ?     ?   460.672   -6.80978     657.01     -6.80978     208.043    -6.80978     
1 1 1 22  10 13 o 0 214.5   14.1  ?     ?   367.647   32.3165      315.887    32.3165      34.7207    -147.684     
1 1 1 22  10 14 o 0 347.5   18.2  ?     ?   422.126   30.9004      452.164    30.9004      51.7564    30.9004      
1 1 1 22  10 15 o 0 21.1    13.3  ?     ?   165.101   60.6519      2.36397    60.6519      149.454    -119.348     
1 1 1 22  10 16 o 0 51.5    17.4  ?     ?   42.9077   77.9286      98.8396    77.9286      59.4849    77.9286      
1 1 1 22  10 17 o 0 61.4    18.6  ?     ?   90.144    -77.9541     185.377    -77.9541     102.537    -77.9541     
1 1 1 22  10 18 o 0 304.6   23.5  ?     ?   374.206   -44.0963     441.904    -44.0963     71.3016    -44.0963     
1 1 1 22  10 19 o 0 26.9    25.1  ?     ?   111.441   -41.4497     74.2916    -41.4497     36.0525    138.55       
1 1 1 22  10 20 o 0 22.8    25.4  ?     ?   95.5626   26.2527      75.5238    26.2527      13.2805    -153.747     
1 1 1 22  10 21 o 0 90.9    30.5  ?     ?   206.932   23.5809      188.307    23.5809      0.134552   23.5809      
1 1 1 -22 12 20 < 0 -3      14.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 12 19 f 1 84.3    12.7  ?     ?   137.114   103.308      252.27     103.308      136.075    103.308      
1 1 1 -22 12 18 o 0 25.8    10.1  ?     ?   134.453   165.201      58.998     165.201      56.756     -14.7986     
1 1 1 -22 12 17 o 0 -10.7   9.4   ?     ?   73.8879   113.917      38.9328    -66.0834     104.526    -66.0834     
1 1 1 -22 12 16 o 0 62.3    9     ?     ?   161.002   -16.6386     168.246    -16.6386     18.9798    -16.6386     
1 1 1 -22 12 15 o 0 51.1    7.7   ?     ?   59.1614   26.3275      152.358    26.3275      97.4431    26.3275      
1 1 1 -22 12 14 o 0 119.4   8     ?     ?   136.854   -28.3534     307.435    -28.3534     189.449    -28.3534     
1 1 1 -22 12 13 f 1 194.2   7.8   ?     ?   144.931   -18.6688     437.321    -18.6688     310.754    -18.6688     
1 1 1 -22 12 12 o 0 20.5    5.4   ?     ?   83.8406   -72.806      30.7809    -72.806      41.9548    107.194      
1 1 1 -22 12 11 o 0 70.5    6.1   ?     ?   227.06    21.8112      140.261    21.8112      57.3198    -158.189     
1 1 1 -22 12 10 f 1 131.1   8     ?     ?   414.766   23.1038      125.879    23.1038      239.184    -156.896     
1 1 1 -22 12 9  o 0 532.7   12.8  ?     ?   501.408   82.4247      562.254    82.4247      109.356    82.4247      
1 1 1 -22 12 8  o 0 185     8.1   ?     ?   303.846   99.0527      308.398    99.0527      32.4841    99.0527      
1 1 1 -22 12 7  o 0 18      3.8   ?     ?   151.145   83.1456      24.737     -96.8544     164.996    -96.8544     
1 1 1 -22 12 6  o 0 22.4    3.9   ?     ?   178.465   102.971      16.109     -77.0286     182.442    -77.0286     
1 1 1 -22 12 5  o 0 18.5    3.7   ?     ?   122.571   123.076      10.8354    -56.9239     125.517    -56.9239     
1 1 1 -22 12 4  o 0 89      4.8   ?     ?   60.6106   -135.327     145.706    -135.327     87.7931    -135.327     
1 1 1 -22 12 3  o 0 254.5   7.6   ?     ?   296.003   54.6121      404.639    54.6121      120.987    54.6121      
1 1 1 -22 12 2  o 0 48      4.5   ?     ?   88.8291   -108.851     73.485     -108.851     11.8458    71.1488      
1 1 1 -22 12 1  o 0 116.6   6.3   ?     ?   120.943   -58.6587     261.178    -58.6587     144.767    -58.6587     
1 1 1 22  12 0  o 0 283.4   8.7   ?     ?   343.577   12.2974      411.525    12.2974      77.3656    12.2974      
1 1 1 22  12 1  o 0 250.8   7.7   ?     ?   427.078   -34.8615     291.421    -34.8615     124.115    145.138      
1 1 1 22  12 2  o 0 181.8   7.7   ?     ?   244.097   -116.404     336.29     -116.404     98.793     -116.404     
1 1 1 22  12 3  o 0 130.2   7.3   ?     ?   232.522   -152.297     247.418    -152.297     21.2817    -152.297     
1 1 1 22  12 4  o 0 352.3   13.1  ?     ?   338.64    -41.5248     504.801    -41.5248     175.749    -41.5248     
1 1 1 22  12 5  o 0 94.7    7.3   ?     ?   187.914   -99.1214     216.078    -99.1214     36.9099    -99.1214     
1 1 1 22  12 6  o 0 35.1    7.9   ?     ?   207.821   -156.49      22.0063    -156.49      175.789    23.5105      
1 1 1 22  12 7  o 0 472     14    ?     ?   510.568   -100.144     499.028    -100.144     14.1852    -100.144     
1 1 1 22  12 8  o 0 96      9.8   ?     ?   210.254   69.8129      214.094    69.8129      18.3046    69.8129      
1 1 1 22  12 9  o 0 97.5    11    ?     ?   278.97    12.0436      162.91     12.0436      96.0371    -167.956     
1 1 1 22  12 10 f 1 28.4    10.2  ?     ?   67.0667   -146.061     53.0029    -146.061     7.78762    33.9387      
1 1 1 22  12 11 o 0 73.9    12.1  ?     ?   221.951   3.0075       155.247    3.0075       44.0703    -176.992     
1 1 1 22  12 12 o 0 80.2    13.3  ?     ?   169.177   -57.9907     206.574    -57.9907     54.7852    -57.9907     
1 1 1 22  12 13 f 1 121.3   15.5  ?     ?   201.108   134.711      278.855    134.711      96.8385    134.711      
1 1 1 22  12 14 o 0 386.9   20.9  ?     ?   457.823   -172.167     462.798    -172.167     17.8006    -172.167     
1 1 1 22  12 15 o 0 136.1   17.9  ?     ?   188.049   169.442      325.559    169.442      143.887    169.442      
1 1 1 22  12 16 o 0 -15.6   19.8  ?     ?   79.1276   50.9859      14.0995    -129.014     90.6137    -129.014     
1 1 1 22  12 17 o 0 94.8    21.7  ?     ?   183.239   58.7571      238.124    58.7571      71.6457    58.7571      
1 1 1 22  12 18 o 0 48.8    24.4  ?     ?   126.496   -73.8662     136.671    -73.8662     24.0877    -73.8662     
1 1 1 22  12 19 f 1 166.2   27.5  ?     ?   211.277   -144.818     356.642    -144.818     168.705    -144.818     
1 1 1 -22 14 17 < 1 95.3    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 14 16 < 0 78.8    11.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 14 15 f 1 50.1    11.6  ?     ?   185.652   -84.5997     119.934    -84.5997     34.1871    95.4003      
1 1 1 -22 14 14 o 0 5.6     8.8   ?     ?   68.9494   30.2158      6.50155    -149.784     64.6859    -149.784     
1 1 1 -22 14 13 o 0 44.6    9.9   ?     ?   70.2515   20.8         151.907    20.8         92.1528    20.8         
1 1 1 -22 14 12 o 0 43      8     ?     ?   74.3291   129.365      143.319    129.365      78.2691    129.365      
1 1 1 -22 14 11 o 0 12.9    7.8   ?     ?   47.2809   -80.0664     11.187     -80.0664     31.9321    99.9336      
1 1 1 -22 14 10 o 0 27.2    6.3   ?     ?   31.0574   62.7719      43.5676    62.7719      15.2724    62.7719      
1 1 1 -22 14 9  o 0 30.8    6     ?     ?   34.4879   -25.6434     57.8511    -25.6434     26.2417    -25.6434     
1 1 1 -22 14 8  o 0 27.7    6.7   ?     ?   73.764    -4.82331     64.8412    -4.82331     2.21674    -4.82331     
1 1 1 -22 14 7  o 0 12      5.6   ?     ?   98.8726   -45.5229     9.98845    134.477      94.3527    134.477      
1 1 1 -22 14 6  o 0 266.6   8.7   ?     ?   305.877   -167.705     419.176    -167.705     156.994    -167.705     
1 1 1 -22 14 5  o 0 233.8   8.5   ?     ?   342.538   148.751      347.103    148.751      54.8596    148.751      
1 1 1 -22 14 4  o 0 231.8   8.9   ?     ?   353.167   -176.885     336.849    -176.885     34.4531    -176.885     
1 1 1 -22 14 3  o 0 114.8   6.3   ?     ?   192.477   -139.162     263.466    -139.162     98.1442    -139.162     
1 1 1 -22 14 2  f 1 92.4    7     ?     ?   248.347   -134.117     175.075    -134.117     39.9017    45.883       
1 1 1 -22 14 1  o 0 59.5    6.6   ?     ?   229.676   -160.802     106.85     -160.802     91.3821    19.1982      
1 1 1 22  14 0  o 0 3.4     5.2   ?     ?   22.4141   126.137      11.8102    -53.8632     31.443     -53.8632     
1 1 1 22  14 1  o 0 11.3    8.2   ?     ?   111.589   15.326       21.3322    -164.674     119.082    -164.674     
1 1 1 22  14 2  f 1 85.4    7.8   ?     ?   78.1798   20.4703      237.553    20.4703      168.74     20.4703      
1 1 1 22  14 3  o 0 14.6    7.1   ?     ?   89.4677   168.755      0.744065   -11.245      79.0286    -11.245      
1 1 1 22  14 4  o 0 91.4    8.7   ?     ?   129.737   -17.3906     250.994    -17.3906     137.612    -17.3906     
1 1 1 22  14 5  o 0 48.7    9.2   ?     ?   101.767   -154.522     138.286    -154.522     49.4955    -154.522     
1 1 1 22  14 6  o 0 30.1    10    ?     ?   188.62    2.89826      33.307     2.89826      132.352    -177.102     
1 1 1 22  14 7  o 0 121.5   11.7  ?     ?   236.212   7.842        248.269    7.842        41.3443    7.842        
1 1 1 22  14 8  o 0 60.3    12.1  ?     ?   170.982   17.0391      156.14     17.0391      0.412999   -162.961     
1 1 1 22  14 9  o 0 9.7     12.1  ?     ?   132.422   88.0805      20.5911    -91.9195     145.693    -91.9195     
1 1 1 22  14 10 o 0 27.8    15.6  ?     ?   157.923   97.3744      42.1457    97.3745      107.569    -82.6255     
1 1 1 22  14 11 o 0 33      16.5  ?     ?   41.9094   -121.605     72.6951    -121.605     33.1407    -121.605     
1 1 1 22  14 12 o 0 111.2   18.6  ?     ?   153.536   146.52       296.989    146.52       157.649    146.52       
1 1 1 22  14 13 o 0 107.4   19.4  ?     ?   244.849   49.3073      218.283    49.3073      1.87786    49.3073      
1 1 1 22  14 14 o 0 193.4   20.5  ?     ?   245.874   2.18967      379.792    2.18967      166.569    2.18967      
1 1 1 22  14 15 f 1 1.8     13.7  ?     ?   32.9529   -112.098     15.0978    -112.098     13.5087    67.902       
1 1 1 22  14 16 < 0 79      23.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 16 12 < 0 26      11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 16 11 < 0 27.7    10.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -22 16 10 o 0 73.1    9.4   ?     ?   158.58    177.248      203.638    177.248      75.7327    177.248      
1 1 1 -22 16 9  o 0 43.5    8.3   ?     ?   148.238   -97.8111     130.299    -97.8111     9.99465    -97.8111     
1 1 1 -22 16 8  o 0 31      8.8   ?     ?   174.157   6.35183      64.5569    6.35183      77.2713    -173.648     
1 1 1 -22 16 7  o 0 13      8     ?     ?   96.4533   48.3005      20.9747    48.3005      57.9852    -131.699     
1 1 1 -22 16 6  o 0 31.8    7.9   ?     ?   140.688   -95.19       85.4255    -95.19       31.8227    84.81        
1 1 1 -22 16 5  o 0 101.4   9.5   ?     ?   152.262   -49.3427     269.353    -49.3427     141.917    -49.3427     
1 1 1 -22 16 4  o 0 3.4     8.7   ?     ?   72.6783   -79.1948     13.6436    100.805      74.7036    100.805      
1 1 1 -22 16 3  o 0 197     11.5  ?     ?   375.147   -50.2264     262.081    -50.2264     60.8799    129.774      
1 1 1 -22 16 2  o 0 16.5    10    ?     ?   165.079   -50.8097     6.54978    129.19       149.073    129.19       
1 1 1 -22 16 1  f 1 62      9.8   ?     ?   55.015    114.433      188.719    114.433      140.861    114.433      
1 1 1 22  16 0  o 0 134.9   10.8  ?     ?   209.13    89.4414      300.007    89.4414      115.568    89.4414      
1 1 1 22  16 1  f 1 49.2    9.8   ?     ?   163.066   -9.59419     129.733    -9.59419     14.7896    170.406      
1 1 1 22  16 2  o 0 6.6     9.8   ?     ?   49.2033   -3.72638     1.24817    176.274      44.6054    176.274      
1 1 1 22  16 3  o 0 -3      11    ?     ?   122.883   81.2141      47.242     -98.7859     155.408    -98.7859     
1 1 1 22  16 4  o 0 26.4    10.9  ?     ?   182.753   77.6569      29.8591    77.6569      127.414    -102.343     
1 1 1 22  16 5  o 0 16.6    12.8  ?     ?   142.883   52.8082      14.7235    52.8082      107.996    -127.192     
1 1 1 22  16 6  o 0 11.5    13.2  ?     ?   139.459   -96.4977     1.23022    83.5023      120.72     83.5023      
1 1 1 22  16 7  o 0 -0.3    11.8  ?     ?   21.3291   76.9591      0.966958   76.9591      17.0179    -103.041     
1 1 1 22  16 8  o 0 44.8    13.7  ?     ?   152.943   127.137      125.166    127.137      3.36749    -52.863      
1 1 1 22  16 9  o 0 -5      21.6  ?     ?   55.6547   -23.5197     31.1757    -23.5197     15.5236    156.48       
1 1 1 22  16 10 < 0 25.4    26    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 22  16 11 < 0 47.9    26.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 1  27 o 0 5.9     11.8  ?     ?   131.495   -117.007     6.10629    62.9925      125.27     62.9925      
1 1 1 -23 1  26 f 1 9       11.3  ?     ?   125.93    -166.395     8.88218    13.6052      126.228    13.6052      
1 1 1 -23 1  25 o 0 122.7   11.6  ?     ?   193.515   -111.975     310.304    -111.975     124.969    -111.975     
1 1 1 -23 1  24 o 0 45.9    11.1  ?     ?   140.807   -40.114      135.822    -40.114      4.23359    139.886      
1 1 1 -23 1  23 o 0 104.6   10.8  ?     ?   311.466   -74.7706     163.053    -74.7706     125.393    105.229      
1 1 1 -23 1  22 o 0 12.1    8.8   ?     ?   87.7947   -110.143     11.5351    69.8573      92.6572    69.8573      
1 1 1 -23 1  21 o 0 167.2   8.3   ?     ?   331.22    -164.699     269.142    -164.699     47.8057    15.301       
1 1 1 -23 1  20 o 0 321.6   10.2  ?     ?   361.919   -171.571     473.077    -171.571     117.562    -171.571     
1 1 1 -23 1  19 o 0 158.2   6.9   ?     ?   351.732   46.1268      213.858    46.1268      140.933    -133.873     
1 1 1 -23 1  18 o 0 89.5    6.7   ?     ?   326.61    46.2245      64.9382    46.2245      229.314    -133.775     
1 1 1 -23 1  17 o 0 340.1   10.1  ?     ?   345.239   -22.9143     434.84     -22.9143     124.038    -22.9143     
1 1 1 -23 1  16 f 1 120.7   7     ?     ?   390.007   -48.3439     74.1717    -48.3439     281.39     131.656      
1 1 1 -23 1  15 o 0 1636    29.2  ?     ?   758.778   5.03798      1050.1     5.03798      342.293    5.03798      
1 1 1 -23 1  14 f 1 628.4   12.6  ?     ?   636.95    -137.621     471.487    -137.621     136.897    42.3795      
1 1 1 -23 1  13 o 0 1063.2  19.3  ?     ?   746.988   -83.909      696.063    -83.909      0.727096   -83.909      
1 1 1 -23 1  12 o 0 971.3   18.1  ?     ?   908.884   68.7496      480.529    68.7496      381.367    -111.25      
1 1 1 -23 1  11 o 0 13.8    2.4   ?     ?   237.156   38.4916      157.252    -141.508     383.259    -141.508     
1 1 1 -23 1  10 o 0 683.7   15.1  ?     ?   561.323   -23.9118     581.086    -23.9118     43.7882    -23.9118     
1 1 1 -23 1  9  o 0 786.6   16.7  ?     ?   649.361   47.6056      628.363    47.6056      20.7439    -132.394     
1 1 1 -23 1  8  o 0 898.5   16.5  ?     ?   581.134   92.741       785.395    92.741       202.539    92.741       
1 1 1 -23 1  6  f 1 172.7   3.9   ?     ?   143.708   91.4583      293.358    91.4583      147.72     91.4583      
1 1 1 -23 1  4  o 0 509.5   9.4   ?     ?   601.997   -152.834     436.339    -152.834     181.501    27.1656      
1 1 1 -23 1  3  o 0 1124    19.9  ?     ?   842.459   129.247      731.962    129.247      133.986    -50.7525     
1 1 1 23  1  1  o 0 116.8   3.1   ?     ?   333.242   -170.528     106.697    -170.528     237.151    9.47186      
1 1 1 23  1  2  o 0 824.4   15.9  ?     ?   519.883   -58.2157     817.71     -58.2157     280.187    -58.2157     
1 1 1 23  1  4  o 0 566.2   11.1  ?     ?   619.404   -102.471     484.022    -102.471     158.653    77.529       
1 1 1 23  1  5  o 0 625     12.3  ?     ?   746.467   -31.3022     412.215    -31.3022     369.957    148.698      
1 1 1 23  1  6  f 1 687.3   15.2  ?     ?   458.617   141.694      735.189    141.694      262.712    141.694      
1 1 1 23  1  7  o 0 903.4   20.2  ?     ?   735.591   174.367      656.216    174.367      97.7394    -5.63266     
1 1 1 23  1  8  o 0 366.2   8.8   ?     ?   235.21    -18.7664     575.842    -18.7664     334.91     -18.7664     
1 1 1 23  1  9  o 0 3598.9  62.9  ?     ?   1314.44   64.5067      1507.32    64.5067      162.609    64.5067      
1 1 1 23  1  10 o 0 723.5   15.4  ?     ?   456.421   144.621      723.726    144.621      275.727    144.621      
1 1 1 23  1  11 o 0 1160.9  22.7  ?     ?   851.387   -175.742     682.227    -175.742     151.346    4.25806      
1 1 1 23  1  12 o 0 608.6   17.3  ?     ?   452.286   -46.9967     622.526    -46.9967     181.079    -46.9967     
1 1 1 23  1  13 o 0 618.4   16.6  ?     ?   487.056   -79.7535     602.647    -79.7535     135.175    -79.7535     
1 1 1 23  1  14 f 1 411.1   14.6  ?     ?   212.039   101.083      609.002    101.083      402.309    101.083      
1 1 1 23  1  15 o 0 323.8   14.1  ?     ?   522.215   -91.0148     273.724    -91.0148     230.332    88.9852      
1 1 1 23  1  16 f 1 27.2    15.3  ?     ?   141.76    -46.9994     45.2075    133.001      179.174    133.001      
1 1 1 23  1  17 o 0 233.6   15.6  ?     ?   279.358   -133.321     368.052    -133.321     104.607    -133.321     
1 1 1 23  1  18 o 0 18.2    13.4  ?     ?   58.9032   -95.5876     21.1885    84.4124      76.3953    84.4124      
1 1 1 23  1  19 o 0 -19     17.7  ?     ?   105.27    68.0185      76.2792    -111.982     186.947    -111.982     
1 1 1 23  1  20 o 0 101.4   20.9  ?     ?   249.533   -110.992     196.001    -110.992     59.944     69.0078      
1 1 1 23  1  21 o 0 314.8   22.7  ?     ?   267.331   106.347      583.117    106.347      322.159    106.347      
1 1 1 23  1  22 o 0 -32.8   23.8  ?     ?   118.817   30.5845      47.5127    -149.415     163.026    -149.415     
1 1 1 23  1  23 o 0 107     25.4  ?     ?   260.113   -8.40972     207.868    -8.40972     45.1379    171.59       
1 1 1 23  1  24 o 0 96.4    28.3  ?     ?   159.343   -45.1115     268.955    -45.1115     100.898    -45.1115     
1 1 1 23  1  25 o 0 92      29.9  ?     ?   167.486   -107.808     242.523    -107.808     73.3487    -107.808     
1 1 1 23  1  26 f 1 86.3    29.6  ?     ?   222.708   -93.8804     175.11     -93.8804     41.3728    86.1196      
1 1 1 23  1  27 < 0 20.9    27    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 3  27 < 0 54.6    10.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 3  26 o 0 91.3    13    ?     ?   218.238   80.7842      221.165    80.7842      23.9529    80.7842      
1 1 1 -23 3  25 o 0 -2.8    12.3  ?     ?   55.7256   159.931      13.4879    -20.0692     66.2157    -20.0692     
1 1 1 -23 3  24 o 0 135.1   10.3  ?     ?   249.997   -51.5398     282.19     -51.5398     34.5901    -51.5398     
1 1 1 -23 3  23 o 0 466.4   16.5  ?     ?   437.116   15.0161      573.41     15.0161      173.189    15.0161      
1 1 1 -23 3  22 o 0 26.7    7.4   ?     ?   63.5841   -164.795     53.3103    -164.795     5.01527    15.2054      
1 1 1 -23 3  21 o 0 99.1    8.2   ?     ?   112.456   -112.695     288.441    -112.695     184.624    -112.695     
1 1 1 -23 3  20 o 0 331.6   9.7   ?     ?   348.945   65.4632      503.369    65.4632      169.776    65.4632      
1 1 1 -23 3  19 o 0 175.2   6.9   ?     ?   206.218   51.933       378.822    51.933       176.457    51.933       
1 1 1 -23 3  18 o 0 108.1   6.2   ?     ?   75.7295   32.3207      219.798    32.3207      143.491    32.3207      
1 1 1 -23 3  17 o 0 877.3   18.3  ?     ?   692.54    36.9845      633.029    36.9845      9.80045    36.9845      
1 1 1 -23 3  16 o 0 547.9   14    ?     ?   606.321   60.1661      441.019    60.1661      104.183    -119.834     
1 1 1 -23 3  15 o 0 92.4    4.9   ?     ?   225.587   13.5902      97.0435    13.5902      111.668    -166.41      
1 1 1 -23 3  14 o 0 469.3   13.3  ?     ?   466.637   134.373      473.087    134.373      38.3398    134.373      
1 1 1 -23 3  13 o 0 120.8   5.3   ?     ?   344.366   -6.99317     88.301     -6.99317     229.939    173.007      
1 1 1 -23 3  12 o 0 238.1   6.1   ?     ?   302.117   -45.1467     313.591    -45.1467     32.718     -45.1467     
1 1 1 -23 3  11 o 0 501.1   9.9   ?     ?   570.269   112.635      402.392    112.635      137.727    -67.3652     
1 1 1 -23 3  10 o 0 2064.6  36    ?     ?   1366.11   144.255      682.369    144.255      617.971    -35.7455     
1 1 1 -23 3  9  o 0 4455.6  75.3  ?     ?   1318.73   155.082      1670.68    155.082      409.808    155.082      
1 1 1 -23 3  8  o 0 1110.6  20.2  ?     ?   768.521   77.4367      760.541    77.4367      6.89363    -102.563     
1 1 1 -23 3  7  o 0 889.2   18.6  ?     ?   717.788   94.3734      647.644    94.3734      71.6292    -85.6266     
1 1 1 -23 3  6  o 0 73.6    3.1   ?     ?   93.643    118.052      67.279     118.052      26.841     -61.9482     
1 1 1 -23 3  5  o 0 96.4    2.6   ?     ?   208.818   -103.249     128.5      -103.249     81.9236    76.7507      
1 1 1 -23 3  4  o 0 511.5   9.5   ?     ?   586.649   -24.7798     437.965    -24.7798     154.489    155.22       
1 1 1 -23 3  3  o 0 183.5   5.3   ?     ?   313.048   -73.1155     255.371    -73.1155     68.635     106.884      
1 1 1 -23 3  2  o 0 230.2   5.5   ?     ?   503.944   -11.9842     170.734    -11.9842     347.163    168.016      
1 1 1 -23 3  1  o 0 3118.1  62.8  ?     ?   1232.61   112.188      1421       112.188      152.534    112.188      
1 1 1 23  3  0  o 0 385     11.6  ?     ?   429.434   -162.439     453.534    -162.439     13.5106    -162.439     
1 1 1 23  3  1  o 0 85.9    2.5   ?     ?   380.374   179.703      7.64873    -0.296628    398.202    -0.296628    
1 1 1 23  3  2  o 0 538.9   10.8  ?     ?   632.307   -19.8246     434.483    -19.8246     221.683    160.175      
1 1 1 23  3  3  o 0 199.4   5.2   ?     ?   303.604   -83.3029     291.959    -83.3028     23.6491    96.6972      
1 1 1 23  3  4  o 0 226.4   5.5   ?     ?   294.196   130.365      337.207    130.365      37.8268    130.365      
1 1 1 23  3  5  o 0 224.8   7.1   ?     ?   499.892   -156.643     159.665    -156.643     349.511    23.3572      
1 1 1 23  3  6  o 0 1934.9  33.9  ?     ?   1084.3    -47.7628     970.424    -47.7628     134.449    132.237      
1 1 1 23  3  7  o 0 453.1   9.5   ?     ?   450.741   83.1117      505.082    83.1117      45.8863    83.1117      
1 1 1 23  3  8  o 0 250.5   8.2   ?     ?   340.849   -161.916     338.89     -161.916     8.06084    18.0845      
1 1 1 23  3  9  o 0 64.1    5.2   ?     ?   334.956   -168.459     39.5083    11.5408      366.778    11.5408      
1 1 1 23  3  10 o 0 3209    57    ?     ?   1318.61   45.1801      1249.13    45.1801      36.5085    -134.82      
1 1 1 23  3  11 o 0 72.6    9.5   ?     ?   335.594   -11.4408     16.1136    168.559      342.431    168.559      
1 1 1 23  3  12 o 0 25.3    9.6   ?     ?   169.924   48.92        77.2436    -131.08      239.78     -131.08      
1 1 1 23  3  13 o 0 843.7   20.1  ?     ?   796.491   67.9025      521.899    67.9025      257.501    -112.098     
1 1 1 23  3  14 o 0 12.9    10    ?     ?   84.7959   145.921      56.088     -34.0788     137.711    -34.0788     
1 1 1 23  3  15 o 0 222.3   12.5  ?     ?   332.767   -177.225     301.128    -177.225     10.9695    2.77533      
1 1 1 23  3  16 o 0 69.8    11.8  ?     ?   200.672   119.089      69.3968    119.089      117.79     -60.9113     
1 1 1 23  3  17 o 0 142.4   13    ?     ?   327.898   120.972      177.65     120.972      129.072    -59.0278     
1 1 1 23  3  18 o 0 5.4     15.9  ?     ?   68.4543   -159.269     33.032     20.7308      104.872    20.7308      
1 1 1 23  3  19 o 0 109.2   15.1  ?     ?   259.524   -173.864     209.947    -173.864     55.8379    6.13592      
1 1 1 23  3  20 o 0 64.6    18.1  ?     ?   109.089   179.573      188.24     179.573      79.1792    179.573      
1 1 1 23  3  21 o 0 70.8    20.5  ?     ?   210.271   -72.5143     160.508    -72.5143     42.9064    107.486      
1 1 1 23  3  22 o 0 0.1     20.6  ?     ?   28.9988   24.1157      1.14517    24.1157      26.787     -155.884     
1 1 1 23  3  23 o 0 -21.4   26.6  ?     ?   43.0726   -90.5744     2.75687    -90.5744     42.2913    89.4256      
1 1 1 23  3  24 o 0 -15.6   25.7  ?     ?   112.594   -177.903     6.56168    2.09675      124.157    2.09675      
1 1 1 23  3  25 o 0 96.1    32.8  ?     ?   220.635   -3.28557     198.134    -3.28557     17.8983    176.714      
1 1 1 23  3  26 o 0 68.6    35.5  ?     ?   162.536   13.5549      165.651    13.5549      9.72832    13.5549      
1 1 1 -23 5  26 o 0 4.5     11.2  ?     ?   81.6619   -1.68095     12.3681    -1.68095     60.0817    178.319      
1 1 1 -23 5  25 o 0 36.2    11.2  ?     ?   71.488    -28.2458     139.595    -28.2458     75.54      -28.2458     
1 1 1 -23 5  24 f 1 78.3    10.4  ?     ?   94.1494   -174.262     264.089    -174.262     175.308    -174.262     
1 1 1 -23 5  23 o 0 18.8    9.6   ?     ?   41.8859   -109.371     31.9857    -109.371     9.14299    70.6289      
1 1 1 -23 5  22 o 0 55.9    7.5   ?     ?   138.594   19.9223      163.437    19.9223      37.6383    19.9223      
1 1 1 -23 5  21 o 0 75      8.8   ?     ?   67.807    82.2798      209.5      82.2798      147.843    82.2798      
1 1 1 -23 5  20 o 0 158.4   9.7   ?     ?   262.336   26.7012      314.497    26.7012      74.4436    26.7012      
1 1 1 -23 5  19 o 0 7.5     6.3   ?     ?   47.1448   -55.7797     20.2824    124.22       64.953     124.22       
1 1 1 -23 5  18 o 0 113.4   6.9   ?     ?   120.541   64.0971      293.221    64.0971      175.992    64.0971      
1 1 1 -23 5  17 o 0 29.3    5.6   ?     ?   207.053   -67.8535     22.5589    112.146      229.305    112.146      
1 1 1 -23 5  16 o 0 215.7   7.7   ?     ?   453.645   -70.2994     189.933    -70.2994     214.596    109.701      
1 1 1 -23 5  15 o 0 28.9    4.1   ?     ?   96.4659   -44.7164     20.2238    135.284      106.171    135.284      
1 1 1 -23 5  14 o 0 655.1   16.8  ?     ?   666.977   104.937      483.747    104.937      114.907    -75.063      
1 1 1 -23 5  13 o 0 440.6   9.9   ?     ?   273.777   -145.198     581.611    -145.198     328.909    -145.198     
1 1 1 -23 5  12 o 0 969.9   18.3  ?     ?   694.296   -66.13       693.78     -66.13       48.7889    -66.13       
1 1 1 -23 5  11 o 0 584.5   12.8  ?     ?   544.209   20.5353      500.78     20.5353      0.43558    -159.465     
1 1 1 -23 5  10 o 0 181.7   4.8   ?     ?   263.173   -36.9532     249.464    -36.9532     5.75322    -36.9532     
1 1 1 -23 5  9  o 0 945.7   17.6  ?     ?   804.868   -99.9156     554.901    -99.9156     204.054    80.0844      
1 1 1 -23 5  8  f 1 581.2   11.4  ?     ?   457.016   -105.124     573.743    -105.124     138.632    -105.124     
1 1 1 -23 5  7  o 0 333.9   6.7   ?     ?   360.609   61.7882      399.743    61.7882      56.8056    61.7882      
1 1 1 -23 5  6  o 0 29      2     ?     ?   245.208   7.08672      104.333    -172.913     350.71     -172.913     
1 1 1 -23 5  5  o 0 4708.5  100.6 ?     ?   1583.5    -177.633     1602.03    -177.633     25.1428    -177.633     
1 1 1 -23 5  4  o 0 1021.2  27    ?     ?   594.573   -166.854     861.508    -166.854     267.877    -166.854     
1 1 1 -23 5  3  o 0 2178.5  83.6  ?     ?   869.811   160.246      1285.28    160.246      414.954    160.246      
1 1 1 -23 5  2  o 0 688.6   18.6  ?     ?   648.721   22.5154      545.942    22.5154      104.319    -157.485     
1 1 1 -23 5  1  o 0 924.3   22    ?     ?   618.823   -112.239     770.414    -112.239     149.247    -112.239     
1 1 1 23  5  0  o 0 2612.1  45.7  ?     ?   1061.49   -45.8351     1307.78    -45.8351     246.014    -45.8351     
1 1 1 23  5  1  o 0 944.3   17.1  ?     ?   793.214   23.427       617.638    23.427       177.17     -156.573     
1 1 1 23  5  2  o 0 769.4   14.3  ?     ?   648.425   -34.0612     617.29     -34.0612     33.4254    145.939      
1 1 1 23  5  3  o 0 1063.6  19.6  ?     ?   707.652   -48.4397     790.421    -48.4397     79.4068    -48.4397     
1 1 1 23  5  4  o 0 2996.5  51.4  ?     ?   1130.66   -47.5034     1417.18    -47.5034     280.202    -47.5034     
1 1 1 23  5  5  o 0 1654.7  31.3  ?     ?   747.961   -18.8491     1131.75    -18.8491     379.331    -18.8491     
1 1 1 23  5  6  o 0 182     7.1   ?     ?   296.904   -23.8815     238.178    -23.8815     48.8951    156.118      
1 1 1 23  5  7  o 0 1536    41.1  ?     ?   574.318   95.8283      1156.78    95.8283      601.865    95.8283      
1 1 1 23  5  8  f 1 212.5   10    ?     ?   294.044   122.53       287.661    122.53       2.45056    122.53       
1 1 1 23  5  9  o 0 115.5   6.7   ?     ?   224.873   20.4746      151.626    20.4746      64.9752    -159.525     
1 1 1 23  5  10 o 0 209.6   8.3   ?     ?   401.887   -16.841      203.496    -16.841      177.636    163.159      
1 1 1 23  5  11 o 0 330.9   11    ?     ?   260.065   52.2241      468.176    52.2241      222.284    52.2241      
1 1 1 23  5  12 o 0 62.8    9.5   ?     ?   285.533   58.1613      8.26298    -121.839     281.224    -121.839     
1 1 1 23  5  13 o 0 39.2    9.2   ?     ?   213.27    96.4624      46.7542    -83.5376     249.795    -83.5376     
1 1 1 23  5  14 o 0 56.2    10    ?     ?   277.526   164.479      5.42218    -15.5213     262.93     -15.5213     
1 1 1 23  5  15 o 0 374.1   15.4  ?     ?   323.91    151.385      501.278    151.385      202.282    151.385      
1 1 1 23  5  16 o 0 69.9    12.6  ?     ?   303.599   111.648      32.6607    111.648      248.443    -68.352      
1 1 1 23  5  17 o 0 145.4   16.1  ?     ?   304.311   30.5072      235.261    30.5072      80.9286    -149.493     
1 1 1 23  5  18 o 0 74.4    16.2  ?     ?   176.428   -73.7028     177.785    -73.7028     1.14267    106.297      
1 1 1 23  5  19 o 0 11.7    16.2  ?     ?   36.7054   -68.3353     1.50788    -68.3353     34.8383    111.665      
1 1 1 23  5  20 o 0 -2.5    17.9  ?     ?   53.1992   -84.0664     9.33548    95.9336      60.3189    95.9336      
1 1 1 23  5  21 o 0 44.1    21.7  ?     ?   182.921   -82.8003     80.6539    -82.8003     93.9219    97.1997      
1 1 1 23  5  22 o 0 169.7   24.1  ?     ?   171.25    -22.8413     428.177    -22.8413     250.691    -22.8413     
1 1 1 23  5  23 o 0 100.2   32    ?     ?   204.489   100.184      220.432    100.184      8.7602     100.184      
1 1 1 23  5  24 f 1 23.3    23.1  ?     ?   20.246    117.481      33.5724    117.481      13.8219    117.481      
1 1 1 23  5  25 o 0 15.6    34.3  ?     ?   88.3769   -77.9659     87.7241    -77.9659     3.86842    -77.9659     
1 1 1 -23 7  25 < 0 8.5     11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 7  24 o 0 2.9     10.7  ?     ?   24.2914   -94.3766     2.32901    -94.3766     19.0793    85.6234      
1 1 1 -23 7  23 o 0 72.4    11.1  ?     ?   168.524   -101.604     204.474    -101.604     52.2262    -101.604     
1 1 1 -23 7  22 o 0 340.8   14.5  ?     ?   380.889   60.5025      472.535    60.5025      104.751    60.5025      
1 1 1 -23 7  21 o 0 8.8     8.6   ?     ?   88.4156   179.164      14.8352    -0.835618    100.494    -0.835618    
1 1 1 -23 7  20 o 0 43      8.5   ?     ?   149.226   -124.855     113.889    -124.855     20.6836    55.1449      
1 1 1 -23 7  19 o 0 145.6   8.1   ?     ?   302.716   -21.2328     253.283    -21.2328     19.017     158.767      
1 1 1 -23 7  18 o 0 57.4    6.3   ?     ?   101.978   65.4865      159.221    65.4865      64.2478    65.4865      
1 1 1 -23 7  17 o 0 231.4   7.9   ?     ?   398.239   135.197      301.638    135.197      78.9856    -44.8033     
1 1 1 -23 7  16 o 0 596.6   13.3  ?     ?   465.075   115.53       675.609    115.53       227.256    115.53       
1 1 1 -23 7  15 o 0 120.5   5.9   ?     ?   234.666   129.747      229.607    129.747      2.52994    -50.2532     
1 1 1 -23 7  14 o 0 170.4   6.3   ?     ?   282.861   160.645      248.068    160.645      1.66882    -19.3546     
1 1 1 -23 7  13 o 0 10.8    4.2   ?     ?   163.802   128.649      104.863    -51.3506     249.27     -51.3506     
1 1 1 -23 7  12 o 0 84.8    4.3   ?     ?   249.691   -1.19545     86.1009    -1.19545     135.52     178.805      
1 1 1 -23 7  11 f 1 129.3   4.7   ?     ?   271.887   3.39873      153.256    3.39873      96.0315    -176.601     
1 1 1 -23 7  10 f 1 1408.1  25.3  ?     ?   812.162   98.5171      855.164    98.5171      106.172    98.5171      
1 1 1 -23 7  9  o 0 3280.9  56.9  ?     ?   1252.73   68.4528      1314.75    68.4528      145.236    68.4528      
1 1 1 -23 7  8  o 0 2477    43.8  ?     ?   1026.15   83.6845      1169.21    83.6845      231.879    83.6845      
1 1 1 -23 7  7  o 0 222.6   5.6   ?     ?   460.606   108.468      169.691    108.468      252.875    -71.5319     
1 1 1 -23 7  6  o 0 353.6   8.8   ?     ?   366.72    145.19       411.792    145.19       74.0608    145.19       
1 1 1 -23 7  5  o 0 1623.8  28.7  ?     ?   715.666   154.962      1043.97    154.962      373.929    154.962      
1 1 1 -23 7  4  o 0 1180.4  21.1  ?     ?   681.057   136.413      820.437    136.413      180.952    136.413      
1 1 1 -23 7  3  o 0 865     17.8  ?     ?   959.369   130.7        354.323    130.7        548.674    -49.3        
1 1 1 -23 7  2  o 0 1087.4  27.3  ?     ?   503.082   79.931       920.468    79.931       446.011    79.931       
1 1 1 -23 7  1  o 0 1541.6  38.4  ?     ?   783.294   114.375      946.474    114.375      206.608    114.375      
1 1 1 23  7  0  o 0 445.2   13.6  ?     ?   36.5668   -56.8053     311.793    -56.8053     277.26     -56.8053     
1 1 1 23  7  1  o 0 2678.8  47.7  ?     ?   994.63    -27.0139     1299.3     -27.0139     358.729    -27.0139     
1 1 1 23  7  2  o 0 1138.1  22.8  ?     ?   644.456   -109.039     832.793    -109.039     222.736    -109.039     
1 1 1 23  7  3  o 0 1010.3  21.8  ?     ?   579.35    -147.934     805.893    -147.934     257.103    -147.934     
1 1 1 23  7  4  o 0 2259.8  41.6  ?     ?   714.453   -80.3236     1374.32    -80.3236     697.381    -80.3236     
1 1 1 23  7  5  o 0 464.7   10.5  ?     ?   632.148   -121.613     311.247    -121.613     287.591    58.3871      
1 1 1 23  7  6  o 0 1115.5  23.6  ?     ?   668.87    144.507      802.71     144.507      177.762    144.507      
1 1 1 23  7  7  o 0 503.7   14.3  ?     ?   544.808   118.361      431.056    118.361      77.3698    -61.6386     
1 1 1 23  7  8  o 0 322.7   9.5   ?     ?   480.761   -154.837     288.758    -154.837     159.126    25.1631      
1 1 1 23  7  9  o 0 257.2   9.6   ?     ?   306.143   -122.83      350.481    -122.83      61.7348    -122.83      
1 1 1 23  7  10 f 1 727.5   21.9  ?     ?   703.016   -96.896      505.023    -96.896      159.588    83.104       
1 1 1 23  7  11 f 1 268.8   11.1  ?     ?   241.493   -104.647     401.223    -104.647     173.685    -104.647     
1 1 1 23  7  12 o 0 307.1   11.7  ?     ?   322.942   76.6984      416.958    76.6984      121.688    76.6984      
1 1 1 23  7  13 o 0 248.3   12.3  ?     ?   87.8749   149.989      403.287    149.989      322.594    149.989      
1 1 1 23  7  14 o 0 226.8   13.2  ?     ?   316.168   -104.083     320.266    -104.083     31.3607    -104.083     
1 1 1 23  7  15 o 0 104.6   13.7  ?     ?   184.512   118.756      232.07     118.756      42.7295    118.756      
1 1 1 23  7  16 o 0 196.5   15.2  ?     ?   351.566   -24.5207     299.548    -24.5207     52.8324    155.479      
1 1 1 23  7  17 o 0 58.3    18.1  ?     ?   313.185   -58.988      28.1982    -58.988      278.507    121.012      
1 1 1 23  7  18 o 0 19.7    18.3  ?     ?   117.733   66.1473      26.4891    66.1473      85.1711    -113.853     
1 1 1 23  7  19 o 0 98      17.4  ?     ?   339.285   151.309      123.132    151.309      197.521    -28.6908     
1 1 1 23  7  20 o 0 35.1    19.4  ?     ?   134.171   -37.3181     80.8316    -37.3181     46.0982    142.682      
1 1 1 23  7  21 o 0 121     24.1  ?     ?   207.524   8.53943      286.207    8.53943      74.8212    8.53943      
1 1 1 23  7  22 o 0 54.7    24.8  ?     ?   150.054   66.7574      135.267    66.7574      17.4135    -113.243     
1 1 1 23  7  23 o 0 -8.1    28.1  ?     ?   173.32    153.577      17.0649    -26.4229     182.438    -26.4229     
1 1 1 23  7  24 o 0 33.6    34.1  ?     ?   67.1277   157.756      136.089    157.756      73.3222    157.756      
1 1 1 -23 9  24 < 0 -34.7   14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 9  23 o 0 18.2    13.2  ?     ?   103.716   -103.898     55.4584    -103.898     33.9074    76.1018      
1 1 1 -23 9  22 o 0 17.1    11.6  ?     ?   144.084   -48.6501     20.5262    -48.6501     104.778    131.35       
1 1 1 -23 9  21 o 0 79.1    10.8  ?     ?   195.917   -141.95      194.649    -141.95      16.3766    -141.95      
1 1 1 -23 9  20 o 0 30.4    9.3   ?     ?   88.3212   -172.957     97.3454    -172.957     13.2878    -172.957     
1 1 1 -23 9  19 o 0 4.7     7.8   ?     ?   145.52    -107.161     64.223     72.8385      203.097    72.8385      
1 1 1 -23 9  18 o 0 32.3    7.9   ?     ?   130.987   -168.357     80.7895    -168.357     35.4965    11.6428      
1 1 1 -23 9  17 o 0 3       6.9   ?     ?   61.0551   62.7945      29.5678    -117.205     83.8031    -117.205     
1 1 1 -23 9  16 o 0 348.4   9.4   ?     ?   451.673   149.254      425.924    149.254      22.6476    149.254      
1 1 1 -23 9  15 o 0 336.6   10    ?     ?   397.303   174.923      450.558    174.923      83.6959    174.923      
1 1 1 -23 9  14 o 0 15.8    4.6   ?     ?   206.232   -30.2055     69.2407    149.795      264.452    149.795      
1 1 1 -23 9  13 o 0 91.3    5     ?     ?   267.711   -48.3851     134.126    -48.3851     125.72     131.615      
1 1 1 -23 9  12 o 0 23.7    4.2   ?     ?   144.505   -51.6108     16.5106    128.389      157.756    128.389      
1 1 1 -23 9  11 o 0 371.8   8.8   ?     ?   607.012   43.181       252.643    43.181       276.28     -136.819     
1 1 1 -23 9  10 o 0 1466.3  27.2  ?     ?   850.738   16.3679      846.162    16.3679      100.372    16.3679      
1 1 1 -23 9  9  o 0 1411.4  25.5  ?     ?   789.88    16.0782      873.912    16.0782      183.658    16.0782      
1 1 1 -23 9  8  o 0 772.8   15.3  ?     ?   791.697   46.708       462.153    46.708       233.205    -133.292     
1 1 1 -23 9  7  o 0 471.1   9.8   ?     ?   549.876   103.506      406.811    103.506      78.3677    -76.4936     
1 1 1 -23 9  6  o 0 750.5   14.8  ?     ?   727.358   55.9847      486.511    55.9847      171.607    -124.015     
1 1 1 -23 9  5  o 0 641     12.8  ?     ?   675.889   -16.0108     443.355    -16.0108     170.398    163.989      
1 1 1 -23 9  4  o 0 626.2   14.4  ?     ?   522.737   154.256      561.847    154.256      85.6828    154.256      
1 1 1 -23 9  3  o 0 516.8   11.4  ?     ?   804.347   54.5558      221.964    54.5558      512.657    -125.444     
1 1 1 -23 9  2  o 0 1180.5  31.2  ?     ?   714.484   -4.4265      804.813    -4.4265      150.842    -4.4265      
1 1 1 -23 9  1  < 1 8765.5  174.6 ?     ?   ?         ?            1354.27    37.1775      ?          ?            
1 1 1 23  9  0  o 0 2658.4  51    ?     ?   967.646   51.0762      1334.36    51.0762      443.444    51.0762      
1 1 1 23  9  1  f 1 2082.4  38.6  ?     ?   869       117.142      1161.77    117.142      356.796    117.142      
1 1 1 23  9  2  o 0 1255    23.9  ?     ?   830.882   -69.4917     754.916    -69.4917     11.2559    110.508      
1 1 1 23  9  3  o 0 4.3     4.8   ?     ?   151.467   -48.2401     122.699    131.76       262.395    131.76       
1 1 1 23  9  4  o 0 411     10.4  ?     ?   327.685   78.4874      514.289    78.4874      212.141    78.4874      
1 1 1 23  9  5  o 0 41.6    5.5   ?     ?   142.065   -35.5645     13.2319    144.435      144.136    144.435      
1 1 1 23  9  6  o 0 70.9    6.1   ?     ?   183.89    -155.698     54.7541    -155.698     114.493    24.3022      
1 1 1 23  9  7  o 0 66.4    6.6   ?     ?   275.675   15.5071      25.6563    15.5071      222.374    -164.493     
1 1 1 23  9  8  o 0 54.1    6.8   ?     ?   169.03    134.873      31.9732    134.873      119.782    -45.1274     
1 1 1 23  9  9  o 0 46.1    8.1   ?     ?   33.1168   -64.6748     7.66874    -64.6748     21.9849    115.325      
1 1 1 23  9  10 o 0 121.7   9.6   ?     ?   388.802   -128.657     85.572     -128.657     264.514    51.3426      
1 1 1 23  9  11 o 0 60.7    9.3   ?     ?   108.928   -99.6854     76.1587    -99.6854     21.5638    80.3146      
1 1 1 23  9  12 o 0 92.3    11.3  ?     ?   121.073   -99.1054     213.132    -99.1054     91.002     -99.1054     
1 1 1 23  9  13 o 0 13      10.7  ?     ?   18.0183   79.9481      3.98355    -100.052     21.7585    -100.052     
1 1 1 23  9  14 o 0 21.3    12.2  ?     ?   133.415   -54.8674     7.38808    125.133      138.322    125.133      
1 1 1 23  9  15 o 0 -23.1   12.7  ?     ?   71.4523   -69.0133     49.8237    110.987      118.387    110.987      
1 1 1 23  9  16 o 0 28      14.2  ?     ?   61.5443   -50.5585     47.5927    -50.5585     9.64032    129.441      
1 1 1 23  9  17 o 0 230.7   18.2  ?     ?   117.855   -122.422     534.138    -122.422     424.85     -122.422     
1 1 1 23  9  18 o 0 133.7   18.7  ?     ?   256.567   -96.5926     267.412    -96.5926     29.1006    -96.5926     
1 1 1 23  9  19 o 0 35.8    22.1  ?     ?   45.556    17.2982      78.6992    17.2982      33.1091    17.2982      
1 1 1 23  9  20 o 0 289.9   29.8  ?     ?   353.548   5.75112      433.694    5.75112      80.0505    5.75112      
1 1 1 23  9  21 o 0 -6      27.2  ?     ?   38.7603   116.13       24.0067    116.13       12.3713    -63.8704     
1 1 1 23  9  22 o 0 36.1    29.6  ?     ?   84.095    -140.787     120.501    -140.787     43.2858    -140.787     
1 1 1 23  9  23 < 0 91.5    30.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 11 21 < 0 47.9    12.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 11 20 o 0 51.9    11.1  ?     ?   194.982   -119.838     123.14     -119.838     42.6607    60.1622      
1 1 1 -23 11 19 o 0 37.8    10.5  ?     ?   110.923   -132.043     125.535    -132.043     28.9642    -132.043     
1 1 1 -23 11 18 o 0 9.9     9.9   ?     ?   143.653   60.4081      24.5256    -119.592     153.536    -119.592     
1 1 1 -23 11 17 o 0 157.3   10    ?     ?   350.215   129.722      220.806    129.722      107.788    -50.2783     
1 1 1 -23 11 16 o 0 47.2    7.2   ?     ?   236.59    101.183      64.2268    101.183      158.113    -78.8169     
1 1 1 -23 11 15 o 0 11.6    6.9   ?     ?   117.703   -67.4545     18.6788    112.545      121.458    112.545      
1 1 1 -23 11 14 o 0 74.7    6.5   ?     ?   181.987   -19.729      182.355    -19.729      23.5338    -19.729      
1 1 1 -23 11 13 o 0 279     10    ?     ?   332.165   -15.2814     429.327    -15.2814     138.309    -15.2814     
1 1 1 -23 11 12 o 0 21.6    5.8   ?     ?   146.573   -24.5151     9.82775    -24.5151     122.819    155.485      
1 1 1 -23 11 11 o 0 66.2    4.9   ?     ?   217.872   5.26868      129.593    5.26868      68.908     -174.731     
1 1 1 -23 11 10 o 0 115.8   5.6   ?     ?   302.045   -32.4806     173.839    -32.4806     107.777    147.519      
1 1 1 -23 11 9  o 0 388.6   9.6   ?     ?   384.04    -70.8524     513.882    -70.8524     153.75     -70.8524     
1 1 1 -23 11 8  o 0 85.1    4.5   ?     ?   144.953   169.678      185.295    169.678      46.2205    169.678      
1 1 1 -23 11 7  o 0 30.5    3.5   ?     ?   159.95    40.2265      6.991      40.2265      147.208    -139.773     
1 1 1 -23 11 6  o 0 31.1    3.4   ?     ?   129.02    -111.337     18.9986    -111.337     105.917    68.6626      
1 1 1 -23 11 5  o 0 290.6   7.6   ?     ?   334.52    -101.877     371.577    -101.877     83.6352    -101.877     
1 1 1 -23 11 4  o 0 68.9    4     ?     ?   204.527   179.241      84.6176    179.241      92.0184    -0.758809    
1 1 1 -23 11 3  o 0 100.3   4.3   ?     ?   392.033   -122.371     37.7972    -122.371     301.742    57.6291      
1 1 1 -23 11 2  o 0 41      3.6   ?     ?   207.623   -111.922     2.21731    -111.922     178.034    68.0776      
1 1 1 -23 11 1  o 0 261.8   7.3   ?     ?   385.564   113.589      301.032    113.589      34.3472    -66.4108     
1 1 1 23  11 0  o 0 6.6     4.1   ?     ?   194.521   -177.342     134.659    2.65788      305.349    2.65788      
1 1 1 23  11 1  o 0 452.4   11.7  ?     ?   514.205   127.891      415.239    127.891      36.2385    -52.1092     
1 1 1 23  11 2  o 0 99.4    7.1   ?     ?   362.898   75.9865      58.3809    75.9865      260.309    -104.014     
1 1 1 23  11 3  o 0 3.8     4.9   ?     ?   35.3047   91.4019      25.7074    -88.5981     56.7044    -88.5981     
1 1 1 23  11 4  o 0 219.8   8.1   ?     ?   305.856   172.948      305.586    172.948      37.2248    172.948      
1 1 1 23  11 5  o 0 144.9   7.6   ?     ?   410.408   131.708      109.137    131.708      250.563    -48.2924     
1 1 1 23  11 6  o 0 369.2   12.5  ?     ?   367.42    72.3855      509.194    72.3855      146.165    72.3855      
1 1 1 23  11 7  o 0 446.5   13.2  ?     ?   455.184   2.30872      518.81     2.30872      69.978     2.30872      
1 1 1 23  11 8  o 0 23.9    7.2   ?     ?   108.721   45.9138      5.25203    -134.086     112.187    -134.086     
1 1 1 23  11 9  o 0 11.7    9.1   ?     ?   113.24    168.905      41.0119    -11.095      150.119    -11.095      
1 1 1 23  11 10 o 0 80.9    9.4   ?     ?   256.218   -161.113     132.679    -161.113     113.33     18.8867      
1 1 1 23  11 11 o 0 72.4    9.9   ?     ?   79.8773   49.3881      195.996    49.3881      120.882    49.3881      
1 1 1 23  11 12 o 0 660.1   19.2  ?     ?   385.891   33.6475      816.787    33.6475      464.516    33.6475      
1 1 1 23  11 13 o 0 672.1   23.3  ?     ?   644.014   122.313      595.154    122.313      10.1511    122.313      
1 1 1 23  11 14 o 0 41.7    13.5  ?     ?   227.77    178.355      45.9297    178.355      160.625    -1.64484     
1 1 1 23  11 15 o 0 271     17.8  ?     ?   328.647   176.872      427.971    176.872      129.095    176.872      
1 1 1 23  11 16 o 0 14.7    18.1  ?     ?   77.9497   167.666      30.0324    167.666      46.4304    -12.3336     
1 1 1 23  11 17 o 0 124.1   21.9  ?     ?   173.364   31.2105      312.982    31.2105      142.817    31.2105      
1 1 1 23  11 18 o 0 82      23.3  ?     ?   116.606   -18.3552     254.493    -18.3552     144.696    -18.3552     
1 1 1 23  11 19 o 0 23.3    22.9  ?     ?   134.883   -126.82      54.8247    -126.82      68.5753    53.1797      
1 1 1 23  11 20 o 0 81.2    24.7  ?     ?   120.415   -70.801      244.736    -70.801      136.652    -70.801      
1 1 1 23  11 21 < 0 -40.9   28.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 13 18 < 0 5.5     12.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 13 17 o 0 194.2   12.2  ?     ?   318.666   -43.3767     317.675    -43.3767     52.0176    -43.3767     
1 1 1 -23 13 16 f 1 14.5    9.7   ?     ?   181.5     -87.4185     23.5518    92.5815      178.732    92.5815      
1 1 1 -23 13 15 o 0 76.6    9     ?     ?   248.171   -136.484     141.085    -136.484     76.4146    43.5164      
1 1 1 -23 13 14 o 0 74.8    8.4   ?     ?   241.848   -15.4242     143.88     -15.4242     69.8501    164.576      
1 1 1 -23 13 13 o 0 65.5    8.2   ?     ?   176.263   52.073       165.604    52.073       3.13455    52.073       
1 1 1 -23 13 12 o 0 189.3   8.2   ?     ?   329.485   128.61       292.485    128.61       11.1855    -51.3899     
1 1 1 -23 13 11 f 1 109.6   6.6   ?     ?   240.804   57.9129      215.985    57.9129      9.06026    57.9129      
1 1 1 -23 13 10 o 0 15.6    5.7   ?     ?   18.658    81.5812      5.62472    81.5812      10.4289    -98.4188     
1 1 1 -23 13 9  o 0 592     14.4  ?     ?   524.609   160.774      591.22     160.774      141.095    160.774      
1 1 1 -23 13 8  o 0 297     9.3   ?     ?   373.052   171.767      411.027    171.767      89.19      171.767      
1 1 1 -23 13 7  f 1 35.4    5.6   ?     ?   178.056   -118.539     62.105     -118.539     92.483     61.4614      
1 1 1 -23 13 6  f 1 25      4.4   ?     ?   139.813   152.294      38.5284    152.294      83.4032    -27.7061     
1 1 1 -23 13 5  f 1 73.1    4.9   ?     ?   202.711   53.3068      155.293    53.3068      26.7343    -126.693     
1 1 1 -23 13 4  f 1 16.1    4.6   ?     ?   161.59    67.0366      26.2483    -112.963     171.864    -112.963     
1 1 1 -23 13 3  o 0 127.1   6.5   ?     ?   330.758   60.5457      179.753    60.5457      117.693    -119.454     
1 1 1 -23 13 2  o 0 53.4    6.4   ?     ?   197.823   -82.4391     104.145    -82.4391     74.2162    97.5609      
1 1 1 -23 13 1  o 0 55.9    5.4   ?     ?   272.999   -62.4553     57.0516    -62.4553     189.617    117.545      
1 1 1 23  13 0  o 0 178.2   7.1   ?     ?   266.34    -20.0769     330.121    -20.0769     86.2489    -20.0769     
1 1 1 23  13 1  o 0 -0.7    5.5   ?     ?   112.933   18.9155      79.3224    -161.084     182.756    -161.084     
1 1 1 23  13 2  o 0 105.9   6.6   ?     ?   159.745   -111.975     266.509    -111.975     120.223    -111.975     
1 1 1 23  13 3  o 0 53      7.5   ?     ?   179.488   24.5636      115.814    24.5636      48.4562    -155.436     
1 1 1 23  13 4  f 1 76.2    7.1   ?     ?   274.6     25.8973      111.94     25.8973      140.415    -154.103     
1 1 1 23  13 5  f 1 15.4    8.1   ?     ?   175.437   23.9515      33.7773    -156.049     190.759    -156.049     
1 1 1 23  13 6  f 1 274.5   11    ?     ?   229.592   -22.0767     509.327    -22.0767     304.28     -22.0767     
1 1 1 23  13 7  f 1 287     12.3  ?     ?   359.474   -59.9882     420.519    -59.9882     100.238    -59.9882     
1 1 1 23  13 8  o 0 27.5    9.6   ?     ?   115.373   -71.6521     53.401     -71.6521     48.9606    108.348      
1 1 1 23  13 9  o 0 9.3     11.6  ?     ?   140.043   49.4895      32.802     -130.511     156.64     -130.511     
1 1 1 23  13 10 o 0 41.7    13    ?     ?   122.004   69.1124      116.347    69.1124      7.92664    69.1124      
1 1 1 23  13 11 f 1 -4.2    13    ?     ?   102.878   145.228      40.4963    -34.7724     136.427    -34.7724     
1 1 1 23  13 12 o 0 20      12.9  ?     ?   130.015   71.0832      22.7135    71.0832      101.583    -108.917     
1 1 1 23  13 13 o 0 147.5   17.7  ?     ?   323.76    -19.3849     226.457    -19.3849     83.7623    160.615      
1 1 1 23  13 14 o 0 41.2    24.7  ?     ?   180.603   -147.022     69.5458    -147.022     96.7282    32.9779      
1 1 1 23  13 15 o 0 21.7    18.7  ?     ?   183.42    161.432      13.7034    161.432      150.629    -18.5676     
1 1 1 23  13 16 f 1 81.8    23    ?     ?   182.836   163.83       201.923    163.83       40.4903    163.83       
1 1 1 23  13 17 o 0 120.5   27.4  ?     ?   159.189   -148.321     302.846    -148.321     163.685    -148.321     
1 1 1 23  13 18 < 0 -7.7    26.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 15 14 < 0 36.6    11    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 15 13 o 0 31.8    10.9  ?     ?   57.2978   131.144      116.613    131.144      70.0411    131.144      
1 1 1 -23 15 12 o 0 237.4   12.1  ?     ?   299.343   -3.89888     387.999    -3.89888     143.394    -3.89888     
1 1 1 -23 15 11 o 0 77.9    8.7   ?     ?   82.0605   -37.268      254.997    -37.268      187.466    -37.268      
1 1 1 -23 15 10 o 0 14.5    8.5   ?     ?   86.4094   -165.638     23.825     -165.638     48.7016    14.3621      
1 1 1 -23 15 9  o 0 14      7.7   ?     ?   88.1951   -57.5115     13.9424    -57.5115     62.1237    122.489      
1 1 1 -23 15 8  o 0 106.4   7.5   ?     ?   220.259   13.1403      231.042    13.1403      39.9997    13.1403      
1 1 1 -23 15 7  o 0 28.7    7.3   ?     ?   162.4     -125.964     51.6057    -125.964     94.9155    54.0358      
1 1 1 -23 15 6  o 0 125.1   8.2   ?     ?   350.664   -136.217     154.293    -136.217     163.57     43.7831      
1 1 1 -23 15 5  o 0 38.6    7.1   ?     ?   130.82    156.221      111.04     156.221      8.04377    -23.7792     
1 1 1 -23 15 4  o 0 75.9    6.8   ?     ?   95.29     -78.9754     232.624    -78.9754     146.207    -78.9754     
1 1 1 -23 15 3  o 0 240.4   9.9   ?     ?   343.997   -57.0012     352.799    -57.0012     39.8101    -57.0012     
1 1 1 -23 15 2  o 0 16.5    6.9   ?     ?   108.225   -28.6186     14.074     -28.6186     84.6722    151.381      
1 1 1 -23 15 1  o 0 65.4    8.1   ?     ?   274.786   138.047      84.6751    138.047      166.633    -41.9533     
1 1 1 23  15 0  f 1 40.6    7.8   ?     ?   157.778   137.498      99.781     137.498      47.8426    -42.5021     
1 1 1 23  15 1  o 0 33.6    8     ?     ?   98.7259   142.989      100.973    142.989      9.07716    142.989      
1 1 1 23  15 2  o 0 16      9.6   ?     ?   91.779    140.456      16.1877    140.456      69.203     -39.5437     
1 1 1 23  15 3  o 0 26      9.6   ?     ?   43.1435   48.2749      48.207     48.2749      8.10242    48.2749      
1 1 1 23  15 4  o 0 96.1    10.9  ?     ?   144.052   -51.062      264.024    -51.062      130.297    -51.062      
1 1 1 23  15 5  o 0 30.4    10.5  ?     ?   83.8976   -141.897     90.389     -141.897     12.06      -141.897     
1 1 1 23  15 6  o 0 246.7   14    ?     ?   402.399   -122.033     312.909    -122.033     61.9444    57.9673      
1 1 1 23  15 7  o 0 94.3    12.6  ?     ?   203.511   91.0583      214.815    91.0583      25.7453    91.0583      
1 1 1 23  15 8  o 0 119.5   17.7  ?     ?   143.916   39.7248      317.119    39.7248      188.324    39.7248      
1 1 1 23  15 9  o 0 49.8    16.2  ?     ?   60.3167   128.868      153.969    128.868      101.306    128.868      
1 1 1 23  15 10 o 0 12.1    17.9  ?     ?   164.109   96.8637      2.46538    -83.1363     145.168    -83.1363     
1 1 1 23  15 11 o 0 -3      20.4  ?     ?   125.991   133.018      1.81264    133.018      105.824    -46.9822     
1 1 1 23  15 12 o 0 6.5     19.7  ?     ?   79.549    138.733      45.042     138.733      22.7303    -41.2674     
1 1 1 23  15 13 < 0 158.4   25.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 23  15 14 < 0 114.8   25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 17 7  < 0 1.7     10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 17 6  < 0 72.4    10    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 17 5  < 0 26.7    9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 17 4  < 0 14.3    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -23 17 3  o 0 19      11.3  ?     ?   123.638   -150.119     43.5731    -150.119     55.7513    29.8814      
1 1 1 -23 17 2  f 1 44      11.4  ?     ?   54.1874   52.6783      161.649    52.6783      117.762    52.6783      
1 1 1 -23 17 1  f 1 64.5    11.7  ?     ?   168.138   -140.789     172.479    -140.789     35.9539    -140.789     
1 1 1 23  17 0  o 0 21      12.6  ?     ?   110.114   -176.226     60.2368    -176.226     30.6805    3.77447      
1 1 1 23  17 1  f 1 12.5    11.9  ?     ?   55.9041   -27.9083     40.3409    -27.9083     6.04022    152.092      
1 1 1 23  17 2  f 1 -1.2    12.3  ?     ?   165.907   28.3135      44.4098    -151.686     181.954    -151.686     
1 1 1 23  17 3  o 0 24.4    14.2  ?     ?   44.1335   7.70245      76.4838    7.70245      40.1256    7.70245      
1 1 1 23  17 4  < 0 37.8    15    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 23  17 5  < 0 85.9    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 23  17 6  < 0 20.1    21.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 23  17 7  < 0 32.3    19.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 0  27 o 0 225.4   23.4  ?     ?   316.272   180          343.523    180          57.0963    180          
1 1 1 -24 0  26 o 0 149     22.2  ?     ?   293.982   180          280.54     180          11.763     180          
1 1 1 -24 0  25 f 1 0.3     39.5  ?     ?   79.1118   180          45.089     180          30.998     1.02064e-14  
1 1 1 -24 0  24 o 0 62.6    15.3  ?     ?   72.0767   180          148.978    180          77.363     180          
1 1 1 -24 0  23 o 0 377.3   19.4  ?     ?   438.447   0            448.77     0            43.2206    0            
1 1 1 -24 0  22 o 0 100.2   14.2  ?     ?   125.121   0            223.602    0            107.713    0            
1 1 1 -24 0  21 o 0 508.2   17.9  ?     ?   455.237   180          532.229    180          97.2707    180          
1 1 1 -24 0  20 o 0 30.2    8.3   ?     ?   21.3551   0            16.932     0            4.00994    180          
1 1 1 -24 0  19 o 0 217.8   11.6  ?     ?   276.664   0            354.333    0            75.779     0            
1 1 1 -24 0  18 o 0 44.1    7.4   ?     ?   91.3596   0            57.7143    0            24.4283    180          
1 1 1 -24 0  17 o 0 303.5   12.3  ?     ?   372.227   180          377.823    180          43.4601    180          
1 1 1 -24 0  16 f 1 576.1   17.4  ?     ?   335.534   0            525.113    0            219.94     0            
1 1 1 -24 0  15 o 0 410.6   15.6  ?     ?   478.125   0            446.29     0            1.43021    0            
1 1 1 -24 0  14 o 0 392.4   11.8  ?     ?   246.453   180          432.687    180          199.138    180          
1 1 1 -24 0  13 o 0 33.5    4.1   ?     ?   250.394   0            77.2498    0            155.14     180          
1 1 1 -24 0  12 o 0 1284.1  47.9  ?     ?   837.641   0            781.88     0            9.94499    180          
1 1 1 -24 0  11 f 1 120.3   6.7   ?     ?   299.179   0            225.907    0            59.7106    180          
1 1 1 -24 0  10 o 0 129.2   6.6   ?     ?   169.803   0            192.221    0            30.2651    0            
1 1 1 -24 0  9  o 0 97.8    4.4   ?     ?   323.655   0            216.395    0            105.92     180          
1 1 1 -24 0  8  o 0 88.2    3.5   ?     ?   412.308   0            212.876    0            199.033    180          
1 1 1 -24 0  7  o 0 2178.2  53.5  ?     ?   1165.19   180          1092.61    180          74.6141    1.02749e-13  
1 1 1 -24 0  6  o 0 453.3   12.4  ?     ?   507.969   0            499.687    0            10.339     180          
1 1 1 -24 0  5  o 0 1.3     1.6   ?     ?   301.733   0            3.74249    0            306.776    180          
1 1 1 -24 0  4  o 0 22.3    1.8   ?     ?   58.7766   0            16.5792    0            43.4894    180          
1 1 1 -24 0  3  o 0 819.2   20.6  ?     ?   1061.83   180          690.753    180          396.142    1.2235e-14   
1 1 1 -24 0  2  o 0 237.8   6.8   ?     ?   279.308   0            365.159    0            78.8109    0            
1 1 1 -24 0  1  o 0 163.5   5.4   ?     ?   45.1958   0            92.109     0            45.6986    0            
1 1 1 24  0  0  o 0 967.6   25.2  ?     ?   922.034   -180         754.354    180          194.094    6.84593e-14  
1 1 1 24  0  1  o 0 9.9     1.8   ?     ?   284.878   180          33.0495    180          260.517    8.90147e-16  
1 1 1 24  0  2  o 0 523.1   15.1  ?     ?   395.54    180          556.589    180          148.256    180          
1 1 1 24  0  3  o 0 1344.2  34.8  ?     ?   635.115   180          893.702    180          236.959    180          
1 1 1 24  0  4  o 0 1021.3  31.4  ?     ?   735.389   180          779.995    180          18.5082    180          
1 1 1 24  0  5  o 0 97.6    5.9   ?     ?   156.519   180          165.48     180          1.8323     180          
1 1 1 24  0  6  o 0 -0.2    4.1   ?     ?   247.592   180          4.24054    180          248.946    1.19523e-16  
1 1 1 24  0  7  o 0 363     11.1  ?     ?   429.847   180          455.256    180          15.7185    180          
1 1 1 24  0  8  o 0 2659.6  66    ?     ?   1123.89   0            1231.57    0            83.0768    0            
1 1 1 24  0  9  o 0 139.1   8.3   ?     ?   89.4763   0            145.621    0            54.299     0            
1 1 1 24  0  10 o 0 2192.8  56.5  ?     ?   1060.95   180          1058.96    180          19.9631    180          
1 1 1 24  0  11 f 1 1241.5  33.2  ?     ?   963.71    180          794.952    180          151.369    3.68499e-14  
1 1 1 24  0  12 o 0 340.3   16.7  ?     ?   320.151   180          412.443    180          104.673    180          
1 1 1 24  0  13 o 0 203.5   19.9  ?     ?   294.147   180          308.99     180          27.2184    180          
1 1 1 24  0  14 o 0 208.8   16.6  ?     ?   179.397   180          284.888    180          111.22     180          
1 1 1 24  0  15 o 0 257.6   19.9  ?     ?   312.416   180          360.615    180          59.5568    180          
1 1 1 24  0  16 f 1 6       17    ?     ?   114.643   0            10.5099    0            97.6707    180          
1 1 1 24  0  17 o 0 -0.3    20.1  ?     ?   15.2295   180          1.6206     180          12.7226    8.93787e-16  
1 1 1 24  0  18 o 0 17.7    24.1  ?     ?   82.6943   0            24.937     0            62.4744    180          
1 1 1 24  0  19 o 0 93.4    26.9  ?     ?   153.147   180          214.663    180          56.6246    180          
1 1 1 24  0  20 o 0 113.5   31.2  ?     ?   544.741   180          252.094    180          296.884    5.95811e-15  
1 1 1 24  0  21 o 0 254.2   35.2  ?     ?   410.383   180          387.85     180          12.5133    2.17483e-13  
1 1 1 24  0  22 o 0 -41.9   33.7  ?     ?   105.328   0            21.6942    0            80.6635    180          
1 1 1 24  0  23 o 0 27.6    40.5  ?     ?   196.04    0            95.4122    0            95.2302    180          
1 1 1 24  0  24 o 0 27      40.4  ?     ?   106.795   180          84.5351    180          28.0977    2.11106e-14  
1 1 1 24  0  25 f 1 -31.5   37.6  ?     ?   50.3691   180          19.0725    180          32.0746    4.17235e-15  
1 1 1 -24 2  27 < 0 75.9    12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 2  26 o 0 2.8     12.3  ?     ?   31.8402   160.254      6.06293    160.254      22.8008    -19.7457     
1 1 1 -24 2  25 f 1 17.4    13.3  ?     ?   84.5258   78.6923      39.3239    78.6923      41.3091    -101.308     
1 1 1 -24 2  24 o 0 489.1   15.3  ?     ?   450.554   -15.52       593.739    -15.52       146.222    -15.52       
1 1 1 -24 2  23 o 0 21.9    7.9   ?     ?   25.1555   -24.0077     19.573     -24.0077     3.52199    155.992      
1 1 1 -24 2  22 o 0 78.2    8.5   ?     ?   199.125   168.106      188.813    168.106      5.68709    168.106      
1 1 1 -24 2  21 f 1 23.3    7.4   ?     ?   191.176   -179.796     2.69652    -179.796     175.128    0.204166     
1 1 1 -24 2  20 o 0 64.5    7.9   ?     ?   182.309   8.36874      155.835    8.36874      18.8425    -171.631     
1 1 1 -24 2  19 o 0 22.1    7.6   ?     ?   91.8448   -0.526958    8.66341    -0.526959    81.6506    179.473      
1 1 1 -24 2  18 o 0 217.8   8.5   ?     ?   188.7     42.3521      449.323    42.3521      258.829    42.3521      
1 1 1 -24 2  17 o 0 660.3   14.6  ?     ?   440.464   32.6509      679.161    32.6509      282.113    32.6509      
1 1 1 -24 2  16 f 1 133.8   6.3   ?     ?   375.743   -50.0368     109.989    -50.0368     230.118    129.963      
1 1 1 -24 2  15 o 0 871.1   17.1  ?     ?   793.768   -65.4349     532.119    -65.4349     203.202    114.565      
1 1 1 -24 2  14 o 0 626.7   12.6  ?     ?   515.289   136.125      582.105    136.125      101.528    136.125      
1 1 1 -24 2  13 f 1 147.8   5.2   ?     ?   299.928   151.498      168.397    151.498      110.427    -28.5024     
1 1 1 -24 2  12 o 0 722     14.7  ?     ?   659.431   8.23015      523.224    8.23015      90.1841    -171.77      
1 1 1 -24 2  11 o 0 1240.9  22.2  ?     ?   785.233   -126.424     771.313    -126.424     27.3654    -126.424     
1 1 1 -24 2  10 o 0 201.3   5     ?     ?   456.251   107.416      142.016    107.416      292.29     -72.5842     
1 1 1 -24 2  9  o 0 20.9    3.1   ?     ?   151.821   92.634       79.8458    -87.366      232.64     -87.366      
1 1 1 -24 2  8  o 0 1581.7  27.9  ?     ?   782.109   39.3719      1047.81    39.3719      267.191    39.3719      
1 1 1 -24 2  7  f 1 2646.2  45.7  ?     ?   1153.48   56.5175      1228.43    56.5175      67.4945    56.5175      
1 1 1 -24 2  6  o 0 1809.2  31.3  ?     ?   952.182   110.49       1017.92    110.49       61.8437    110.49       
1 1 1 -24 2  5  o 0 2427.3  47.7  ?     ?   1219.15   -143.96      1072.68    -143.96      154.357    36.0396      
1 1 1 -24 2  4  o 0 685.2   14.4  ?     ?   526.051   132.941      677.146    132.941      134.429    132.941      
1 1 1 -24 2  3  o 0 356.3   6.8   ?     ?   283.73    82.7813      536.642    82.7813      243.404    82.7813      
1 1 1 -24 2  2  o 0 812.3   14.6  ?     ?   565.2     40.5039      758.558    40.5039      178.546    40.5039      
1 1 1 -24 2  1  f 1 1579.5  28.1  ?     ?   960.611   157.642      909.971    157.642      82.3335    -22.3578     
1 1 1 24  2  0  f 1 140.7   5.1   ?     ?   235.362   70.7276      221.187    70.7276      21.2762    -109.272     
1 1 1 24  2  1  f 1 201.9   5.1   ?     ?   178.264   91.8032      356.702    91.8032      172.684    91.8032      
1 1 1 24  2  3  o 0 563.6   10.8  ?     ?   628.078   55.0277      465.141    55.0277      187.989    -124.972     
1 1 1 24  2  4  o 0 310.9   6.9   ?     ?   350.583   98.7144      426.977    98.7144      61.8619    98.7144      
1 1 1 24  2  5  o 0 1225.6  23.2  ?     ?   801.408   48.7577      823.882    48.7577      7.11816    48.7577      
1 1 1 24  2  6  o 0 52.1    3.5   ?     ?   184.959   27.3589      12.5504    27.3589      176.055    -152.641     
1 1 1 24  2  7  f 1 46.5    3.6   ?     ?   241.166   -105.761     31.9323    74.2395      279.106    74.2395      
1 1 1 24  2  8  o 0 78.6    4.7   ?     ?   113.052   133.215      86.6459    133.215      28.5538    -46.7853     
1 1 1 24  2  9  o 0 734.4   15.4  ?     ?   294.633   35.0291      861.41     35.0291      573.177    35.0291      
1 1 1 24  2  10 o 0 14.9    6.1   ?     ?   102.963   -37.0522     66.2646    142.948      166.798    142.948      
1 1 1 24  2  11 o 0 99.4    7.6   ?     ?   273.721   172.995      92.3985    172.995      174.188    -7.00479     
1 1 1 24  2  12 o 0 401.4   13.1  ?     ?   439.081   -160.08      425.282    -160.08      4.52884    -160.08      
1 1 1 24  2  13 f 1 495.3   16.6  ?     ?   243.365   173.446      664.357    173.446      430.813    173.446      
1 1 1 24  2  14 o 0 45.8    12    ?     ?   62.1784   -88.9506     3.76805    -88.9506     56.2143    91.0494      
1 1 1 24  2  15 o 0 23.9    12    ?     ?   210.362   168.061      104.318    -11.939      306.29     -11.939      
1 1 1 24  2  16 f 1 80.6    12.9  ?     ?   240.754   55.4473      82.4888    55.4473      143.82     -124.553     
1 1 1 24  2  17 o 0 51.7    12.4  ?     ?   221.603   43.8254      30.4341    43.8254      177.428    -136.175     
1 1 1 24  2  18 o 0 180.9   16.5  ?     ?   174.973   112.092      408.098    112.092      223.93     112.092      
1 1 1 24  2  19 o 0 142     17    ?     ?   266.495   167.075      277.872    167.075      4.09197    167.075      
1 1 1 24  2  20 o 0 251.7   19.9  ?     ?   220.195   162.473      522.028    162.473      301.159    162.473      
1 1 1 24  2  21 f 1 206.3   24.2  ?     ?   263.374   11.7132      412.122    11.7132      155.125    11.7132      
1 1 1 24  2  22 o 0 1.8     24.1  ?     ?   60.7805   -42.2036     10.1149    -42.2036     48.6476    137.796      
1 1 1 24  2  23 o 0 216     24.8  ?     ?   242.451   36.2315      456.015    36.2315      201.451    36.2315      
1 1 1 24  2  24 o 0 22.8    35.5  ?     ?   98.1143   72.1162      92.1209    72.1162      10.7735    -107.884     
1 1 1 24  2  25 f 1 23.2    32.1  ?     ?   97.3964   45.8801      92.7533    45.8801      3.51543    -134.12      
1 1 1 24  2  26 o 0 64.2    33.7  ?     ?   152.428   -44.3737     164.024    -44.3737     17.4665    -44.3737     
1 1 1 -24 4  27 < 0 24.4    12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 4  26 f 1 15      12.5  ?     ?   112.602   -47.567      38.8294    -47.567      62.3106    132.433      
1 1 1 -24 4  25 o 0 171.1   14.6  ?     ?   273.625   -51.2574     334.411    -51.2574     84.2321    -51.2574     
1 1 1 -24 4  24 o 0 -5.2    9.8   ?     ?   84.4861   -27.5898     38.5997    152.41       118.413    152.41       
1 1 1 -24 4  23 o 0 79.4    9     ?     ?   161.321   38.6092      225.063    38.6092      66.7666    38.6092      
1 1 1 -24 4  22 o 0 64.7    7.3   ?     ?   172.096   13.3004      171.214    13.3004      13.9636    13.3004      
1 1 1 -24 4  21 o 0 23      7.1   ?     ?   31.7934   114.473      23.8004    114.473      5.29789    -65.5271     
1 1 1 -24 4  20 o 0 341.3   10.4  ?     ?   350.889   70.5167      507.713    70.5167      176.335    70.5167      
1 1 1 -24 4  19 o 0 233.4   7.5   ?     ?   267.395   137.664      423.345    137.664      164.079    137.664      
1 1 1 -24 4  18 f 1 684.3   14.7  ?     ?   532.171   125.491      688.264    125.491      155.607    125.491      
1 1 1 -24 4  17 o 0 298.6   8.4   ?     ?   394.77    68.0645      347.48     68.0645      3.68585    -111.935     
1 1 1 -24 4  16 o 0 857.1   17.1  ?     ?   395.528   152.804      865.998    152.804      511.284    152.804      
1 1 1 -24 4  15 o 0 1612.3  31.1  ?     ?   730.302   121.348      1059.19    121.348      404.929    121.348      
1 1 1 -24 4  14 o 0 936     19.2  ?     ?   824.528   56.9291      549.104    56.9291      210.734    -123.071     
1 1 1 -24 4  13 o 0 1402.2  25.3  ?     ?   892.528   -62.9008     792.922    -62.9008     35.1259    117.099      
1 1 1 -24 4  12 o 0 1440.3  25.4  ?     ?   947.85    -107.179     739.424    -107.179     132.632    72.8208      
1 1 1 -24 4  11 o 0 84.2    4     ?     ?   280.431   73.1778      47.8656    73.1778      211.628    -106.822     
1 1 1 -24 4  10 o 0 309.2   6.7   ?     ?   445.004   60.6671      298.32     60.6671      121.092    -119.333     
1 1 1 -24 4  9  o 0 1526.1  27.2  ?     ?   981.931   -166.417     757.997    -166.417     171.885    13.5835      
1 1 1 -24 4  8  o 0 135.5   3.7   ?     ?   271.112   77.8326      167.496    77.8326      90.3451    -102.167     
1 1 1 -24 4  7  o 0 35.4    1.7   ?     ?   321.473   -70.2663     129.591    109.734      452.704    109.734      
1 1 1 -24 4  6  o 0 254.2   5.3   ?     ?   343.677   -69.6667     335.017    -69.6667     7.43112    110.333      
1 1 1 -24 4  5  o 0 332.9   9     ?     ?   427.342   -88.4508     373.672    -88.4508     53.3733    91.5492      
1 1 1 -24 4  4  o 0 2132.2  46.4  ?     ?   1142.19   15.7115      999.077    15.7115      145.146    -164.289     
1 1 1 -24 4  3  o 0 811.2   31.8  ?     ?   712.386   -73.3447     590.446    -73.3447     124.702    106.655      
1 1 1 -24 4  2  o 0 156.8   4.4   ?     ?   210.445   84.1187      259.393    84.1187      47.762     84.1187      
1 1 1 -24 4  1  o 0 71.4    2.3   ?     ?   194.957   -158.15      66.6532    -158.15      129.687    21.8496      
1 1 1 24  4  0  f 1 277.8   8.1   ?     ?   425.646   -67.4828     300.472    -67.4828     128.773    112.517      
1 1 1 24  4  1  o 0 514.3   11.2  ?     ?   359.669   107.764      642.503    107.764      280.966    107.764      
1 1 1 24  4  2  o 0 797.7   14.9  ?     ?   850.631   34.0274      447.655    34.0274      408.863    -145.973     
1 1 1 24  4  3  o 0 128.4   4.7   ?     ?   458.724   -119.132     21.9387    -119.132     440.633    60.868       
1 1 1 24  4  4  o 0 102.6   3.8   ?     ?   288.489   -34.3097     102.123    -34.3097     189.106    145.69       
1 1 1 24  4  5  o 0 189.8   5.7   ?     ?   325.507   -36.3771     250.802    -36.3771     78.0117    143.623      
1 1 1 24  4  6  o 0 394.3   12.9  ?     ?   447.952   162.673      435.668    162.673      16.9005    -17.3269     
1 1 1 24  4  7  o 0 2182.5  57.6  ?     ?   813.566   128.966      1278.15    128.966      488.343    128.966      
1 1 1 24  4  8  o 0 711.6   16.8  ?     ?   536.522   158.582      634.63     158.582      114.298    158.582      
1 1 1 24  4  9  o 0 1339.5  27.6  ?     ?   876.423   21.2707      764.132    21.2707      84.485     -158.729     
1 1 1 24  4  10 o 0 668.2   16.7  ?     ?   650.831   55.2009      498.449    55.2009      122.161    -124.799     
1 1 1 24  4  11 o 0 1889.3  40.7  ?     ?   912.538   -175.104     1041.93    -175.104     174.19     -175.104     
1 1 1 24  4  12 o 0 11.3    9.6   ?     ?   151.627   -167.052     107.369    12.9479      254.946    12.9479      
1 1 1 24  4  13 o 0 2130.5  41.1  ?     ?   789.02    51.3705      1309.06    51.3705      553.258    51.3705      
1 1 1 24  4  14 o 0 271.3   12.5  ?     ?   393.315   179.252      324.353    179.252      42.9134    -0.747856    
1 1 1 24  4  15 o 0 448.3   16.6  ?     ?   692.5     146.216      278.962    146.216      364.47     -33.7843     
1 1 1 24  4  16 o 0 550.3   18.6  ?     ?   652.485   58.4522      415.783    58.4521      192.442    -121.548     
1 1 1 24  4  17 o 0 240.8   17.1  ?     ?   340.619   18.4524      377.829    18.4524      21.4519    18.4524      
1 1 1 24  4  18 f 1 530.6   20.7  ?     ?   379.818   -22.5408     725.166    -22.5408     335.217    -22.5408     
1 1 1 24  4  19 o 0 277.3   20.2  ?     ?   205.198   -63.655      570.4      -63.655      365.717    -63.655      
1 1 1 24  4  20 o 0 49.7    19.2  ?     ?   191.752   -21.8797     99.6619    -21.8797     85.4895    158.12       
1 1 1 24  4  21 o 0 80.3    20.6  ?     ?   202.139   -88.3974     191.14     -88.3974     3.26887    91.6026      
1 1 1 24  4  22 o 0 43.7    25.9  ?     ?   160.529   75.252       92.6084    75.252       61.8742    -104.748     
1 1 1 24  4  23 o 0 88.9    24.4  ?     ?   175.573   91.23        238.844    91.23        55.6254    91.23        
1 1 1 24  4  24 o 0 41.2    30.3  ?     ?   122.996   -54.1396     127.177    -54.1396     4.2471     -54.1396     
1 1 1 24  4  25 o 0 34.5    23.8  ?     ?   111.915   -23.5874     110.601    -23.5874     3.50496    -23.5874     
1 1 1 24  4  26 f 1 -7.8    30.4  ?     ?   75.1816   20.1851      57.3108    20.1851      14.4703    -159.815     
1 1 1 -24 6  26 < 0 12.5    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 6  25 o 0 79.3    11.3  ?     ?   207.717   170.959      198.522    170.959      15.2042    170.959      
1 1 1 -24 6  24 o 0 48.4    11.2  ?     ?   208.682   -135.16      101.555    -135.16      86.8655    44.8397      
1 1 1 -24 6  23 o 0 21.1    8.9   ?     ?   89.351    121.725      51.3915    121.725      31.9575    -58.275      
1 1 1 -24 6  22 o 0 307.2   11.5  ?     ?   344.603   60.1455      469.721    60.1455      135.854    60.1455      
1 1 1 -24 6  21 o 0 113.3   8.6   ?     ?   188.832   85.9225      275.561    85.9225      105.216    85.9225      
1 1 1 -24 6  20 o 0 78.2    7.5   ?     ?   234.396   -90.976      159.886    -90.976      51.8879    89.024       
1 1 1 -24 6  19 o 0 78.1    7     ?     ?   145.525   -26.5827     220.042    -26.5827     87.7621    -26.5827     
1 1 1 -24 6  18 o 0 44.9    5.9   ?     ?   159.033   59.9946      103.647    59.9946      46.0001    -120.005     
1 1 1 -24 6  17 o 0 28.3    5.5   ?     ?   132.975   19.0474      31.0618    19.0474      97.3344    -160.953     
1 1 1 -24 6  16 o 0 95.3    5.6   ?     ?   260.312   29.4357      152.609    29.4357      105.387    -150.564     
1 1 1 -24 6  15 o 0 532.8   12    ?     ?   579.175   125.165      441.224    125.165      71.2667    -54.8351     
1 1 1 -24 6  14 o 0 433.9   10    ?     ?   410.821   127.739      480.702    127.739      117.597    127.739      
1 1 1 -24 6  13 o 0 61.5    4.1   ?     ?   169.541   -110.896     51.9833    -110.896     98.9338    69.104       
1 1 1 -24 6  12 o 0 1186.9  21.9  ?     ?   495.853   -17.7075     995.559    -17.7075     541.784    -17.7075     
1 1 1 -24 6  11 o 0 114.2   5.1   ?     ?   25.9182   -2.99133     40.5196    -2.99133     16.6544    -2.99133     
1 1 1 -24 6  10 o 0 189.3   5.4   ?     ?   116.651   -159.378     265.971    -159.378     156.642    -159.378     
1 1 1 -24 6  9  o 0 635.1   13.4  ?     ?   526.264   -14.7911     557.909    -14.7911     75.1383    -14.7911     
1 1 1 -24 6  8  o 0 514.2   12.2  ?     ?   486.87    -148.076     484.322    -148.076     35.5858    -148.076     
1 1 1 -24 6  7  o 0 324.9   8.4   ?     ?   337.977   139.282      400.37     139.282      83.4216    139.282      
1 1 1 -24 6  6  o 0 211.2   4.7   ?     ?   567.038   117.247      60.7743    117.247      472.975    -62.7527     
1 1 1 -24 6  5  o 0 2053.8  38.1  ?     ?   1162.95   120.306      860.918    120.306      237.335    -59.6944     
1 1 1 -24 6  4  o 0 1199    24.8  ?     ?   631.086   -43.8695     884.072    -43.8695     286.418    -43.8695     
1 1 1 -24 6  3  o 0 66.1    2.7   ?     ?   50.3428   92.6665      27.3811    92.6665      20.4077    -87.3335     
1 1 1 -24 6  2  o 0 747.4   22.6  ?     ?   511.069   -5.70091     673.566    -5.70091     187.483    -5.70091     
1 1 1 -24 6  1  o 0 154.7   5.8   ?     ?   51.8766   -150.504     133.388    -150.504     81.3616    -150.504     
1 1 1 24  6  0  o 0 405.5   9.1   ?     ?   335.79    -98.0022     527.38     -98.0022     191.135    -98.0022     
1 1 1 24  6  1  o 0 1012.4  18.6  ?     ?   821.974   32.4914      591.771    32.4914      191.225    -147.509     
1 1 1 24  6  2  o 0 997.2   18.2  ?     ?   710.91    -124.189     683.834    -124.189     5.77767    -124.189     
1 1 1 24  6  3  o 0 1808.6  33.9  ?     ?   978.379   -69.1694     920.07     -69.1694     13.963     110.831      
1 1 1 24  6  4  o 0 1397    25.2  ?     ?   857.849   -40.5308     805.453    -40.5308     13.9548    139.469      
1 1 1 24  6  5  o 0 403.1   9.2   ?     ?   144.93    -151.008     583.599    -151.008     445.149    -151.008     
1 1 1 24  6  6  o 0 472     10.3  ?     ?   675.698   118.462      281.834    118.462      363.396    -61.5385     
1 1 1 24  6  7  o 0 2769    70.1  ?     ?   1165.13   73.8478      1187.97    73.8478      76.3911    73.8478      
1 1 1 24  6  8  o 0 1185.6  22.2  ?     ?   664.395   15.2006      857.344    15.2006      232.644    15.2006      
1 1 1 24  6  9  o 0 2804    54.9  ?     ?   926.406   46.2915      1431.75    46.2915      562.438    46.2915      
1 1 1 24  6  10 o 0 61.9    6.5   ?     ?   253.949   -64.2547     2.87425    -64.2547     241.23     115.745      
1 1 1 24  6  11 o 0 11.6    8.5   ?     ?   193.517   118.96       134.499    -61.0401     317.719    -61.0401     
1 1 1 24  6  12 o 0 419     15.8  ?     ?   365.57    41.7436      506.537    41.7436      161.683    41.7436      
1 1 1 24  6  13 o 0 101.4   8.8   ?     ?   381.859   -117.256     41.4938    -117.256     309.747    62.7441      
1 1 1 24  6  14 o 0 24.1    10.8  ?     ?   180.632   -156.776     55.3481    23.2239      222.164    23.2239      
1 1 1 24  6  15 o 0 271.8   14.9  ?     ?   247.438   -175.446     433.233    -175.446     205.909    -175.446     
1 1 1 24  6  16 o 0 122.6   14.2  ?     ?   370.765   -93.4965     124.985    -93.4965     257.426    86.5035      
1 1 1 24  6  17 o 0 255.3   15    ?     ?   346.922   -92.994      401.765    -92.994      52.3611    -92.994      
1 1 1 24  6  18 o 0 3.3     14.1  ?     ?   63.2438   65.2857      18.9873    -114.714     81.2044    -114.714     
1 1 1 24  6  19 o 0 186.9   17.8  ?     ?   173.386   163.81       445.322    163.81       280.174    163.81       
1 1 1 24  6  20 o 0 64.4    17.6  ?     ?   251.039   -40.991      107.461    -40.991      130.75     139.009      
1 1 1 24  6  21 o 0 23      21.4  ?     ?   190.895   -3.91394     6.26146    -3.91394     183.792    176.086      
1 1 1 24  6  22 o 0 2.6     27.5  ?     ?   172.895   6.56876      10.9248    -173.431     188.995    -173.431     
1 1 1 24  6  23 o 0 60.7    29.2  ?     ?   128.684   138.475      174.842    138.475      47.8887    138.475      
1 1 1 24  6  24 o 0 41.7    30.2  ?     ?   92.4059   177.346      136.512    177.346      49.2161    177.346      
1 1 1 24  6  25 o 0 37.4    30.7  ?     ?   144.185   -170.221     99.0043    -170.221     36.2163    9.77924      
1 1 1 -24 8  24 < 0 35      10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 8  23 f 1 12.7    11.1  ?     ?   55.4446   21.7474      29.4545    21.7474      19.1891    -158.253     
1 1 1 -24 8  22 o 0 13.7    11.3  ?     ?   167.62    49.412       15.9501    -130.588     165.889    -130.588     
1 1 1 -24 8  21 o 0 187.3   10.9  ?     ?   278.677   175.946      341.881    175.946      75.5111    175.946      
1 1 1 -24 8  20 o 0 24      7.3   ?     ?   82.1352   113.659      62.6429    113.659      16.1065    -66.3408     
1 1 1 -24 8  19 o 0 40.6    6.6   ?     ?   212.889   9.57872      63.1277    9.57872      126.814    -170.421     
1 1 1 -24 8  18 o 0 18.6    6     ?     ?   70.8481   -106.555     22.4947    -106.555     40.7766    73.4453      
1 1 1 -24 8  17 o 0 169.8   7.2   ?     ?   259.305   116.022      332.022    116.022      99.1796    116.022      
1 1 1 -24 8  16 o 0 454     11.4  ?     ?   507.103   173.227      491.854    173.227      20.7602    173.227      
1 1 1 -24 8  15 o 0 14.6    4.5   ?     ?   68.9752   -83.4667     12.7876    96.5333      78.4978    96.5333      
1 1 1 -24 8  14 o 0 3.3     4.2   ?     ?   105.613   -2.95002     83.9054    177.05       187.114    177.05       
1 1 1 -24 8  13 o 0 57.6    4.5   ?     ?   186.016   11.8112      61.233     11.8112      100.959    -168.189     
1 1 1 -24 8  12 o 0 1.5     3.7   ?     ?   112.047   0.0516735    88.0361    -179.948     186.411    -179.948     
1 1 1 -24 8  11 o 0 1282.2  24.1  ?     ?   748.642   86.3718      836.167    86.3718      180.373    86.3718      
1 1 1 -24 8  10 o 0 1208.6  21.7  ?     ?   492.382   -4.11141     1009.64    -4.11141     575.751    -4.11141     
1 1 1 -24 8  9  o 0 780.5   15.3  ?     ?   558.25    173.032      653.674    173.032      148.514    173.032      
1 1 1 -24 8  8  o 0 1717.6  32.8  ?     ?   1104.11   141.136      761.356    141.136      242.747    -38.8642     
1 1 1 -24 8  7  o 0 173.1   4.6   ?     ?   445.362   163.357      111.84     163.357      295.008    -16.6425     
1 1 1 -24 8  6  o 0 107.4   3.6   ?     ?   421.865   -4.70703     8.24318    -4.70703     378.689    175.293      
1 1 1 -24 8  5  o 0 492.3   10.1  ?     ?   415.142   86.229       513.016    86.229       136.439    86.229       
1 1 1 -24 8  4  o 0 2166.7  38.7  ?     ?   746.241   154.405      1274.41    154.405      595.418    154.405      
1 1 1 -24 8  3  f 1 2588    49.6  ?     ?   1094.95   113.302      1148.11    113.302      144.116    113.302      
1 1 1 -24 8  2  o 0 273.9   9.9   ?     ?   392.226   -11.2902     292.668    -11.2902     65.8994    168.71       
1 1 1 -24 8  1  o 0 433.8   12.7  ?     ?   715.82    90.9836      206.882    90.9837      448.616    -89.0163     
1 1 1 24  8  0  o 0 1317.4  25.7  ?     ?   1033.17   12.1575      590.221    12.1575      358.184    -167.842     
1 1 1 24  8  1  o 0 4369.7  75.9  ?     ?   1339.07   -99.5198     1595.43    -99.5198     364.794    -99.5198     
1 1 1 24  8  2  o 0 262.8   6.9   ?     ?   411.545   -172.955     264.949    -172.955     113.576    7.04494      
1 1 1 24  8  3  f 1 368     9.7   ?     ?   470.907   74.7584      343.965    74.7584      91.575     -105.242     
1 1 1 24  8  4  o 0 701.8   14.2  ?     ?   551.377   100.934      594.061    100.934      86.692     100.934      
1 1 1 24  8  5  o 0 76      4.3   ?     ?   89.2002   65.2798      55.5387    65.2798      28.721     -114.72      
1 1 1 24  8  6  o 0 671.6   13.9  ?     ?   538.965   -34.9883     600.823    -34.9883     98.2479    -34.9883     
1 1 1 24  8  7  o 0 5.4     6     ?     ?   216.084   -69.0505     171.262    110.95       372.478    110.95       
1 1 1 24  8  8  o 0 899.6   20.6  ?     ?   628.649   179.936      700.846    179.936      116.555    179.936      
1 1 1 24  8  9  o 0 58.4    6.8   ?     ?   85.7105   -102.213     39.6069    -102.213     38.2089    77.7873      
1 1 1 24  8  10 o 0 190     9.6   ?     ?   262.086   -145.124     286.703    -145.124     49.4523    -145.124     
1 1 1 24  8  11 o 0 94.3    8.9   ?     ?   346.727   47.9841      61.3008    47.9841      254.231    -132.016     
1 1 1 24  8  12 o 0 604.4   18.3  ?     ?   677.261   131.706      431.681    131.706      182.208    -48.2944     
1 1 1 24  8  13 o 0 144.5   11.6  ?     ?   309.599   124.449      225.485    124.449      89.9603    -55.5505     
1 1 1 24  8  14 o 0 33      12    ?     ?   293.079   -147.22      76.3636    32.7802      373.495    32.7802      
1 1 1 24  8  15 o 0 36.3    13.8  ?     ?   67.6648   132.059      52.5848    132.059      14.4504    -47.9406     
1 1 1 24  8  16 o 0 5.3     15.2  ?     ?   168.89    -81.4494     60.5313    98.5506      224.079    98.5506      
1 1 1 24  8  17 o 0 221.6   20.7  ?     ?   258.612   -88.2663     430.579    -88.2663     187.945    -88.2663     
1 1 1 24  8  18 o 0 34.6    18.8  ?     ?   98.4466   -73.5354     80.1958    -73.5354     11.8809    106.465      
1 1 1 24  8  19 o 0 26.8    20.6  ?     ?   97.0874   -54.5248     62.136     -54.5248     28.7962    125.475      
1 1 1 24  8  20 o 0 135     26.2  ?     ?   235.688   -24.9606     287.47     -24.9606     49.6974    -24.9606     
1 1 1 24  8  21 o 0 84.8    26.2  ?     ?   132.262   131.696      240.08     131.696      111.233    131.696      
1 1 1 24  8  22 o 0 -0.1    30.7  ?     ?   143.888   111.57       22.3806    111.57       113.692    -68.4301     
1 1 1 -24 10 22 < 0 14.6    10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 10 21 o 0 25.7    10.5  ?     ?   234.532   -134.061     7.11051    45.9389      208.205    45.9389      
1 1 1 -24 10 20 f 1 67.9    10.5  ?     ?   288.12    -130.1       93.4121    -130.1       160.911    49.8996      
1 1 1 -24 10 19 o 0 19.4    9.1   ?     ?   123.972   -112.99      26.2773    -112.99      89.983     67.0101      
1 1 1 -24 10 18 o 0 53.3    7.7   ?     ?   195.218   141.674      117.009    141.674      66.5112    -38.3264     
1 1 1 -24 10 17 o 0 102.4   8.2   ?     ?   264.409   165.689      187.519    165.689      43.636     -14.3115     
1 1 1 -24 10 16 o 0 91.3    8.1   ?     ?   287.124   157.705      145.926    157.705      105.158    -22.2953     
1 1 1 -24 10 15 o 0 64      5.5   ?     ?   78.0891   -85.1665     178.506    -85.1665     109.892    -85.1665     
1 1 1 -24 10 14 o 0 158.9   7.1   ?     ?   187.804   -76.3727     360.58     -76.3727     194.224    -76.3727     
1 1 1 -24 10 13 f 1 202.9   7.4   ?     ?   243.332   7.09211      387.749    7.09211      163.87     7.09211      
1 1 1 -24 10 12 o 0 79.6    5.1   ?     ?   115.349   -77.6869     201.414    -77.6869     93.2666    -77.6869     
1 1 1 -24 10 11 f 1 70      4.2   ?     ?   94.4546   -160.517     171.99     -160.517     82.3824    -160.517     
1 1 1 -24 10 10 o 0 33.9    3.8   ?     ?   173.077   -14.1487     15.5036    -14.1487     151.784    165.851      
1 1 1 -24 10 9  o 0 57.5    3.7   ?     ?   170.936   48.7307      100.98     48.7307      65.1806    -131.269     
1 1 1 -24 10 8  o 0 316.2   7.5   ?     ?   326.232   73.1464      410.213    73.1464      127.888    73.1464      
1 1 1 -24 10 7  o 0 286.6   7.3   ?     ?   451.251   50.4982      280.88     50.4981      111.484    -129.502     
1 1 1 -24 10 6  o 0 11.2    3     ?     ?   228.792   -22.5071     132.203    157.493      331.982    157.493      
1 1 1 -24 10 5  o 0 167.2   5.2   ?     ?   362.486   7.69465      174.838    7.69465      140.112    -172.305     
1 1 1 -24 10 4  o 0 60.1    3.2   ?     ?   70.6145   34.847       36.0039    34.847       25.5511    -145.153     
1 1 1 -24 10 3  o 0 25.2    3.1   ?     ?   100.193   -24.1159     28.9928    155.884      116.576    155.884      
1 1 1 -24 10 2  o 0 345     9.2   ?     ?   355.304   72.8873      421.844    72.8873      110.53     72.8873      
1 1 1 -24 10 1  o 0 220.5   7.3   ?     ?   250.365   124.068      330.431    124.068      110.651    124.068      
1 1 1 24  10 0  o 0 2384.6  47.8  ?     ?   988.587   133.763      1193.98    133.763      320.059    133.763      
1 1 1 24  10 1  o 0 542.1   14.3  ?     ?   405.031   127.456      590.699    127.456      232.364    127.456      
1 1 1 24  10 2  o 0 329.7   8.9   ?     ?   482.356   -5.75162     310.691    -5.75162     116.228    174.248      
1 1 1 24  10 3  o 0 362.1   9.4   ?     ?   397.955   -72.0008     413.973    -72.0008     61.7549    -72.0008     
1 1 1 24  10 4  o 0 68.9    6.3   ?     ?   111.029   8.79854      66.7692    8.79854      31.4579    -171.201     
1 1 1 24  10 5  o 0 133.5   6.7   ?     ?   260.942   -88.2186     183.383    -88.2186     47.2714    91.7814      
1 1 1 24  10 6  o 0 8.8     6     ?     ?   125.709   70.2366      79.1731    -109.763     191.115    -109.763     
1 1 1 24  10 7  o 0 140.7   7.8   ?     ?   339.719   129.401      157.777    129.401      144.194    -50.5987     
1 1 1 24  10 8  o 0 41.7    6.7   ?     ?   266.453   161.311      27.0879    -18.6885     263.393    -18.6885     
1 1 1 24  10 9  o 0 460.6   13.1  ?     ?   362.982   35.4368      626.016    35.4368      263.551    35.4368      
1 1 1 24  10 10 o 0 394.8   14.2  ?     ?   259.615   119.593      636.162    119.593      377.764    119.593      
1 1 1 24  10 11 f 1 93.1    11.1  ?     ?   200.908   -6.61944     206.485    -6.61944     9.74172    -6.61944     
1 1 1 24  10 12 o 0 438     17.1  ?     ?   509.419   3.57822      472.481    3.57822      21.7167    -176.422     
1 1 1 24  10 13 f 1 36.2    11.3  ?     ?   84.7751   -87.7382     82.1183    -87.7382     1.21963    -87.7382     
1 1 1 24  10 14 o 0 202.5   16.3  ?     ?   348.619   -155.602     319.028    -155.602     2.02226    24.3981      
1 1 1 24  10 15 o 0 27.9    19    ?     ?   197.037   152.327      12.3616    152.327      168.739    -27.6728     
1 1 1 24  10 16 o 0 11.5    17.4  ?     ?   71.5929   121.235      16.0198    121.235      49.9494    -58.7647     
1 1 1 24  10 17 o 0 70.2    19.8  ?     ?   235.305   -0.403255    131.858    -0.403255    101.947    179.597      
1 1 1 24  10 18 o 0 54.3    19.1  ?     ?   153.996   5.72316      142.901    5.72316      10.1683    -174.277     
1 1 1 24  10 19 o 0 55.4    30.6  ?     ?   66.8577   85.4279      160.617    85.4279      96.8824    85.4279      
1 1 1 24  10 20 f 1 22.8    27.2  ?     ?   39.9507   179.267      60.9568    179.267      23.7734    179.267      
1 1 1 24  10 21 o 0 540.6   35.5  ?     ?   423.018   -156.233     671.179    -156.233     286.967    -156.233     
1 1 1 -24 12 20 < 0 109.2   14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 12 19 o 0 66.8    11.3  ?     ?   129.095   15.129       212.872    15.129       104.896    15.129       
1 1 1 -24 12 18 o 0 24      10.1  ?     ?   73.0998   131.97       77.1271    131.97       15.5026    131.97       
1 1 1 -24 12 17 o 0 27.5    9.1   ?     ?   34.7018   -101.522     59.9472    -101.522     30.0188    -101.522     
1 1 1 -24 12 16 o 0 -12.7   8.5   ?     ?   10.2746   -74.3763     6.05469    105.624      15.1884    105.624      
1 1 1 -24 12 15 o 0 -4.2    7.2   ?     ?   39.9801   -154.755     22.5395    25.2454      59.6412    25.2454      
1 1 1 -24 12 14 f 1 55.5    7.2   ?     ?   23.8196   -82.6817     92.4928    -82.6817     70.2569    -82.6817     
1 1 1 -24 12 13 o 0 36      6.1   ?     ?   23.2087   -28.1143     43.6816    -28.1143     23.6697    -28.1143     
1 1 1 -24 12 12 o 0 0.4     5.5   ?     ?   65.1551   60.9191      38.9419    -119.081     95.0437    -119.081     
1 1 1 -24 12 11 o 0 94.1    6.8   ?     ?   166.483   -26.2863     237.469    -26.2863     93.1341    -26.2863     
1 1 1 -24 12 10 o 0 20      4.6   ?     ?   97.8071   26.7253      26.0085    26.7253      59.0075    -153.275     
1 1 1 -24 12 9  o 0 35.6    4.7   ?     ?   141.259   -119.881     72.8875    -119.881     53.7758    60.119       
1 1 1 -24 12 8  o 0 220.9   6.7   ?     ?   209.161   -58.6137     435.861    -58.6137     247.297    -58.6137     
1 1 1 -24 12 7  o 0 194.3   6.7   ?     ?   255.367   -38.7232     361.858    -38.7232     130.504    -38.7232     
1 1 1 -24 12 6  o 0 112.4   4.6   ?     ?   299.777   -44.9302     167.32     -44.9302     110.108    135.07       
1 1 1 -24 12 5  o 0 130.4   5.4   ?     ?   285.942   -52.5041     216.189    -52.5041     49.4831    127.496      
1 1 1 -24 12 4  o 0 135.9   5.7   ?     ?   380.458   -41.3378     148.419    -41.3378     206.3      138.662      
1 1 1 -24 12 3  o 0 190     7     ?     ?   416.842   -63.0913     213.933    -63.0914     175.878    116.909      
1 1 1 -24 12 2  o 0 587.9   13.8  ?     ?   524.636   -145.396     581.561    -145.396     80.9574    -145.396     
1 1 1 -24 12 1  o 0 212.4   6.6   ?     ?   334.937   -119.952     308.465    -119.952     11.7958    60.0482      
1 1 1 24  12 0  o 0 245.8   9.7   ?     ?   395.658   -133.848     310.106    -133.848     72.6635    46.1522      
1 1 1 24  12 1  o 0 96.5    7     ?     ?   157.826   145.675      212.131    145.675      59.3768    145.675      
1 1 1 24  12 2  o 0 239.6   8.4   ?     ?   273.907   -4.23099     404.325    -4.23099     139.207    -4.23099     
1 1 1 24  12 3  o 0 673.5   15.7  ?     ?   554.54    6.16236      654.911    6.16236      127.735    6.16236      
1 1 1 24  12 4  o 0 166.2   8     ?     ?   331.688   -18.0673     250.444    -18.0673     64.6233    161.933      
1 1 1 24  12 5  o 0 68.2    7.3   ?     ?   221.589   39.5944      123.285    39.5944      86.9375    -140.406     
1 1 1 24  12 6  o 0 234.8   9.8   ?     ?   293.121   -29.1625     394.226    -29.1625     116.615    -29.1625     
1 1 1 24  12 7  o 0 153     9.5   ?     ?   141.127   99.1708      376.143    99.1708      245.001    99.1708      
1 1 1 24  12 8  o 0 266.2   11.3  ?     ?   347.774   96.2204      401.523    96.2204      79.2053    96.2204      
1 1 1 24  12 9  o 0 47.9    10.4  ?     ?   123.342   -111.482     134.742    -111.482     23.6205    -111.482     
1 1 1 24  12 10 o 0 69.4    10.4  ?     ?   222.277   -17.0407     143.599    -17.0407     55.9372    162.959      
1 1 1 24  12 11 o 0 261.8   18.1  ?     ?   336.252   26.6397      407.134    26.6397      105.377    26.6397      
1 1 1 24  12 12 o 0 121.3   12.4  ?     ?   167.086   -170.301     302.114    -170.301     152.849    -170.301     
1 1 1 24  12 13 o 0 61.6    14.5  ?     ?   131.875   -148.682     176.563    -148.682     58.3172    -148.682     
1 1 1 24  12 14 f 1 29.3    13.7  ?     ?   145.676   -112.636     53.9279    -112.636     87.8118    67.3643      
1 1 1 24  12 15 o 0 32.9    18.1  ?     ?   149.382   42.4227      67.6123    42.4227      77.2064    -137.577     
1 1 1 24  12 16 o 0 78.7    21.5  ?     ?   155.956   105.681      220.205    105.681      75.0412    105.681      
1 1 1 24  12 17 o 0 65.8    24.3  ?     ?   139.729   -167.594     178.781    -167.594     52.3084    -167.594     
1 1 1 24  12 18 o 0 -20.3   27.3  ?     ?   16.518    -0.241263    8.92919    -0.241263    5.71875    179.759      
1 1 1 24  12 19 < 0 57.2    31.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 14 16 < 0 -3.2    8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 14 15 o 0 16.1    9.8   ?     ?   63.8422   99.9297      51.9551    99.9297      0.485994   -80.0703     
1 1 1 -24 14 14 o 0 83.1    10.3  ?     ?   166.925   44.3984      222.832    44.3984      84.8636    44.3984      
1 1 1 -24 14 13 o 0 82.8    9.4   ?     ?   223.616   97.684       178.824    97.684       9.94352    -82.316      
1 1 1 -24 14 12 o 0 95.3    8.3   ?     ?   191.696   113.046      228.251    113.046      61.7386    113.046      
1 1 1 -24 14 11 o 0 40.3    7.7   ?     ?   121.672   -89.1763     124.588    -89.1763     18.1546    -89.1763     
1 1 1 -24 14 10 o 0 6.1     6.4   ?     ?   76.1857   -134.097     21.1728    45.9026      90.5914    45.9026      
1 1 1 -24 14 9  o 0 100.9   6.9   ?     ?   209.232   -97.0047     224.687    -97.0047     34.3085    -97.0047     
1 1 1 -24 14 8  o 0 74.8    5.5   ?     ?   168.013   -104.015     195.069    -104.015     41.3394    -104.015     
1 1 1 -24 14 7  o 0 85.7    6.3   ?     ?   159.122   -161.762     218.929    -161.762     84.12      -161.762     
1 1 1 -24 14 6  o 0 6.9     4.9   ?     ?   110.072   171.408      41.7867    -8.59179     135.473    -8.59179     
1 1 1 -24 14 5  o 0 12.8    5.7   ?     ?   53.0969   55.1354      2.18756    55.1354      43.1933    -124.865     
1 1 1 -24 14 4  o 0 17.9    5.6   ?     ?   73.9087   144.718      18.9695    144.718      43.8809    -35.2817     
1 1 1 -24 14 3  o 0 66.5    6.9   ?     ?   220.501   1.04736      131.208    1.04736      56.9045    -178.953     
1 1 1 -24 14 2  o 0 83.8    6.7   ?     ?   154.016   -14.6287     217.391    -14.6287     85.6361    -14.6287     
1 1 1 -24 14 1  o 0 4.8     6     ?     ?   75.1252   -2.26894     33.7879    177.731      98.2018    177.731      
1 1 1 24  14 0  o 0 34.8    7     ?     ?   61.3608   33.8031      77.4618    33.8031      23.9865    33.8031      
1 1 1 24  14 1  o 0 231     9.2   ?     ?   405.308   32.7746      298.734    32.7746      54.5386    -147.225     
1 1 1 24  14 2  o 0 2.8     6.5   ?     ?   28.9088   -13.0316     14.1477    166.968      39.3381    166.968      
1 1 1 24  14 3  o 0 51.2    8.6   ?     ?   165.288   -77.5548     124.613    -77.5548     19.3134    102.445      
1 1 1 24  14 4  o 0 8.5     8.9   ?     ?   93.5459   30.3762      23.2952    -149.624     104.658    -149.624     
1 1 1 24  14 5  o 0 192.5   11.5  ?     ?   213.946   125.834      391.259    125.834      203.843    125.834      
1 1 1 24  14 6  o 0 14.4    8.2   ?     ?   85.4895   141.358      5.10129    141.358      69.6346    -38.6418     
1 1 1 24  14 7  o 0 45.1    11.3  ?     ?   58.2803   -63.047      121.059    -63.047      67.7772    -63.047      
1 1 1 24  14 8  o 0 168.9   13    ?     ?   269.308   -55.0138     315.393    -55.0138     61.2132    -55.0138     
1 1 1 24  14 9  o 0 22.3    13    ?     ?   35.6308   94.9422      30.6985    94.9422      2.81568    -85.0578     
1 1 1 24  14 10 o 0 23.3    15.7  ?     ?   104.008   -156.329     54.1777    -156.329     44.0036    23.6706      
1 1 1 24  14 11 o 0 79.6    17.1  ?     ?   227.015   -99.1361     163.786    -99.1361     42.3937    80.8639      
1 1 1 24  14 12 o 0 87.8    15.9  ?     ?   214.616   -21.6278     199.624    -21.6278     9.69013    -21.6278     
1 1 1 24  14 13 o 0 209.7   19.7  ?     ?   275.281   -0.215707    379.161    -0.215707    136.826    -0.215707    
1 1 1 24  14 14 o 0 152.3   19.2  ?     ?   184.82    179.802      356.825    179.802      197.169    179.802      
1 1 1 24  14 15 o 0 55.2    15.6  ?     ?   242.955   -170.03      92.3539    -170.03      116.687    9.96985      
1 1 1 24  14 16 < 0 77.6    27    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 16 11 < 0 1.1     9.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 16 10 < 0 25.7    9.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -24 16 9  o 0 39.8    9.1   ?     ?   129.986   -25.5944     128.02     -25.5944     23.2929    -25.5944     
1 1 1 -24 16 8  o 0 0.8     7.9   ?     ?   89.6778   68.768       16.1271    -111.232     88.797     -111.232     
1 1 1 -24 16 7  o 0 2.4     8.2   ?     ?   72.8931   -142.973     12.1956    37.0269      71.4449    37.0269      
1 1 1 -24 16 6  o 0 11      8.4   ?     ?   136.309   -166.479     5.97798    13.5208      117.309    13.5208      
1 1 1 -24 16 5  o 0 65.6    9.3   ?     ?   155.028   79.7708      181.322    79.7708      52.4702    79.7708      
1 1 1 -24 16 4  o 0 54.6    8.5   ?     ?   93.658    140.192      182.324    140.192      104.178    140.192      
1 1 1 -24 16 3  o 0 19.6    8.4   ?     ?   65.5365   -64.7585     47.955     -64.7585     6.91436    115.241      
1 1 1 -24 16 2  o 0 331.9   13.5  ?     ?   404.631   127.147      423.708    127.147      83.9361    127.147      
1 1 1 -24 16 1  o 0 381.9   13.1  ?     ?   480.234   158.038      419.574    158.038      15.3115    158.038      
1 1 1 24  16 0  o 0 98.9    10.5  ?     ?   253.382   -158.823     195.169    -158.823     22.5875    21.177       
1 1 1 24  16 1  o 0 301.2   13.6  ?     ?   350.176   -80.2574     440.626    -80.2574     139.728    -80.2574     
1 1 1 24  16 2  o 0 95.4    11.9  ?     ?   180.887   -76.1447     241.643    -76.1447     86.2995    -76.1447     
1 1 1 24  16 3  o 0 15.7    11.8  ?     ?   84.1207   94.553       32.9626    94.553       39.2067    -85.447      
1 1 1 24  16 4  o 0 130     15    ?     ?   205.875   -150.973     291.757    -150.973     115.387    -150.973     
1 1 1 24  16 5  o 0 82.3    14.1  ?     ?   219.944   -66.7639     177.988    -66.7639     10.0783    113.236      
1 1 1 24  16 6  o 0 100.6   15.4  ?     ?   261.84    -117.905     190.636    -117.905     29.8189    62.0945      
1 1 1 24  16 7  o 0 17.3    12.1  ?     ?   166.875   -99.3422     6.80139    -99.3422     133.305    80.6578      
1 1 1 24  16 8  o 0 10.4    12.9  ?     ?   109.698   -133.391     23.3824    -133.391     68.626     46.6087      
1 1 1 24  16 9  o 0 36.5    19.2  ?     ?   129.814   -163.816     99.6255    -163.816     8.85122    16.1838      
1 1 1 24  16 10 < 0 38.9    21.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 1  27 < 0 -4.8    13.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 1  26 o 0 29.1    13    ?     ?   68.7535   -39.3977     101.454    -39.3977     39.0591    -39.3977     
1 1 1 -25 1  25 o 0 30.7    11    ?     ?   106.934   -44.4658     94.5545    -44.4658     7.02999    135.534      
1 1 1 -25 1  24 o 0 128.7   10.1  ?     ?   252.367   31.8633      267.79     31.8633      16.9216    31.8633      
1 1 1 -25 1  23 o 0 49.5    9.7   ?     ?   270.935   65.0011      47.5158    65.0011      201.389    -114.999     
1 1 1 -25 1  22 o 0 84.6    9.1   ?     ?   285.648   117.954      137.48     117.954      125.348    -62.0458     
1 1 1 -25 1  21 o 0 115.6   7.4   ?     ?   239.897   -112.596     250.273    -112.596     28.1962    -112.596     
1 1 1 -25 1  20 f 1 43.3    6.8   ?     ?   124.834   -25.6118     112.76     -25.6118     7.48439    154.388      
1 1 1 -25 1  19 o 0 228.8   7.4   ?     ?   255.928   -28.6913     431.641    -28.6913     179.978    -28.6913     
1 1 1 -25 1  18 o 0 104.4   7.9   ?     ?   207.922   -99.8887     215.359    -99.8887     5.49758    -99.8887     
1 1 1 -25 1  17 o 0 445     10.9  ?     ?   407.138   -109.748     507.185    -109.748     140.311    -109.748     
1 1 1 -25 1  16 o 0 1486.6  27.5  ?     ?   691.448   -129.825     1028.23    -129.825     405.911    -129.825     
1 1 1 -25 1  15 o 0 432.4   11.1  ?     ?   339.846   79.417       530.545    79.417       215.962    79.417       
1 1 1 -25 1  14 o 0 860.4   17.3  ?     ?   465.928   -176.813     812.633    -176.813     378.513    -176.813     
1 1 1 -25 1  13 o 0 675.9   17    ?     ?   597.877   41.5175      535.131    41.5175      17.1798    -138.483     
1 1 1 -25 1  12 o 0 1027.2  26.8  ?     ?   838.244   48.7099      588.57     48.7099      190.069    -131.29      
1 1 1 -25 1  11 o 0 232.7   8     ?     ?   475.9     -137.058     171.293    -137.058     278.844    42.9424      
1 1 1 -25 1  10 o 0 93.3    3.2   ?     ?   69.9546   7.45196      75.6834    7.45196      9.2187     7.45196      
1 1 1 -25 1  9  o 0 106.1   3.4   ?     ?   304.887   111.48       90.7905    111.48       215.403    -68.5202     
1 1 1 -25 1  8  f 1 961.5   20.1  ?     ?   674.366   -57.7708     736.909    -57.7708     61.9477    -57.7708     
1 1 1 -25 1  7  o 0 964.9   18.5  ?     ?   806.286   47.955       618.569    47.955       186.721    -132.045     
1 1 1 -25 1  6  o 0 273.9   8.7   ?     ?   268.708   -170.585     420.301    -170.585     151.23     -170.585     
1 1 1 -25 1  5  o 0 274.5   5.5   ?     ?   442.179   91.5425      283.319    91.5425      160.447    -88.4575     
1 1 1 -25 1  3  o 0 765.2   14.7  ?     ?   433.621   2.17413      833.905    2.17413      387.085    2.17413      
1 1 1 -25 1  2  f 1 172.3   3.7   ?     ?   333.312   161.252      218.03     161.252      124.774    -18.7476     
1 1 1 -25 1  1  o 0 437.9   8.6   ?     ?   573.068   160.67       383.744    160.67       203.565    -19.3296     
1 1 1 25  1  0  o 0 1251.6  25    ?     ?   802.676   116.711      858.083    116.711      35.8919    116.711      
1 1 1 25  1  2  f 1 1574.7  29.1  ?     ?   699.964   149.089      1167.92    149.089      444.49     149.089      
1 1 1 25  1  3  o 0 1818.1  33    ?     ?   941.195   98.1113      1069.22    98.1113      91.3252    98.1113      
1 1 1 25  1  4  o 0 444     9.2   ?     ?   655.919   -78.1335     301.183    -78.1335     365.986    101.866      
1 1 1 25  1  5  o 0 1304.6  24    ?     ?   783.022   68.1841      894.084    68.1841      96.7897    68.1841      
1 1 1 25  1  6  o 0 392.3   8.6   ?     ?   455.133   -18.0885     430.515    -18.0885     33.1744    161.912      
1 1 1 25  1  7  o 0 71.4    5.7   ?     ?   357.795   -13.8555     30.6612    166.145      395.185    166.145      
1 1 1 25  1  8  f 1 256.5   8.9   ?     ?   326.545   -61.6978     358.081    -61.6978     23.8806    -61.6978     
1 1 1 25  1  9  o 0 353.2   9.6   ?     ?   363.184   -92.4685     432.435    -92.4685     77.3774    -92.4685     
1 1 1 25  1  10 o 0 2213.6  40.1  ?     ?   1030.06   -135.1       1094.88    -135.1       89.6847    -135.1       
1 1 1 25  1  11 o 0 699.8   16.3  ?     ?   615.809   157.702      555.148    157.702      44.3625    -22.2983     
1 1 1 25  1  12 o 0 726.9   18.4  ?     ?   714.135   -132.941     493.087    -132.941     191.057    47.0587      
1 1 1 25  1  13 o 0 419.1   13.8  ?     ?   412.15    -150.514     465.319    -150.514     71.8679    -150.514     
1 1 1 25  1  14 o 0 141.1   17.2  ?     ?   200.391   -8.94222     214.652    -8.94222     21.3282    -8.94222     
1 1 1 25  1  15 o 0 79.1    13.2  ?     ?   304.674   -169.681     43.1358    -169.681     243.356    10.3187      
1 1 1 25  1  16 o 0 150     14.6  ?     ?   345.554   1.63793      168.762    1.63793      154.527    -178.362     
1 1 1 25  1  17 o 0 125.7   12.9  ?     ?   355.837   58.6719      123.523    58.6719      210.443    -121.328     
1 1 1 25  1  18 o 0 281     19.8  ?     ?   272.356   80.2192      504.114    80.2192      217.228    80.2192      
1 1 1 25  1  19 o 0 207.3   17.3  ?     ?   151.727   146.379      488.432    146.379      332.411    146.379      
1 1 1 25  1  20 f 1 263.1   20.1  ?     ?   349.964   -131.47      423.547    -131.47      70.309     -131.47      
1 1 1 25  1  21 o 0 -13.3   18.6  ?     ?   84.0843   132.532      29.9888    -47.4681     111.725    -47.4681     
1 1 1 25  1  22 o 0 -39.5   23.3  ?     ?   38.5633   92.0999      15.2925    -87.9001     52.6316    -87.9001     
1 1 1 25  1  23 o 0 58.4    27.9  ?     ?   117.607   -137.264     174.378    -137.264     50.6853    -137.264     
1 1 1 25  1  24 o 0 111.3   28    ?     ?   252.61    151.844      221.756    151.844      43.6629    -28.1556     
1 1 1 25  1  25 o 0 75.1    31.6  ?     ?   158.02    171.546      194.609    171.546      38.8925    171.546      
1 1 1 25  1  26 o 0 37.2    35.1  ?     ?   81.6401   66.6771      135.074    66.6771      56.3975    66.6771      
1 1 1 -25 3  27 < 0 34.5    12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 3  26 o 0 -10.6   14.4  ?     ?   71.7366   -175.449     1.7432     4.55117      66.1752    4.55117      
1 1 1 -25 3  25 o 0 15.3    11.8  ?     ?   168.875   -4.77629     8.28641    175.224      163.456    175.224      
1 1 1 -25 3  24 o 0 142.9   10.5  ?     ?   274.236   20.5837      273.335    20.5837      3.94936    20.5837      
1 1 1 -25 3  23 o 0 86.4    9.3   ?     ?   150.113   34.6266      252.716    34.6266      104.73     34.6266      
1 1 1 -25 3  22 o 0 19.1    7     ?     ?   155.694   -168.121     0.362896   11.879       142.027    11.879       
1 1 1 -25 3  21 o 0 120.4   9.3   ?     ?   172.465   -90.1143     305.977    -90.1143     148.04     -90.1143     
1 1 1 -25 3  20 o 0 37.8    6.9   ?     ?   112.256   30.3407      92.6495    30.3407      13.8094    -149.659     
1 1 1 -25 3  19 o 0 136.1   6.9   ?     ?   193.275   70.2235      309.883    70.2235      121.73     70.2235      
1 1 1 -25 3  18 o 0 7.7     5.1   ?     ?   218.197   143.125      153.463    -36.8746     371.578    -36.8746     
1 1 1 -25 3  17 o 0 172.7   7.1   ?     ?   395.639   81.3892      170.453    81.3892      182.776    -98.6108     
1 1 1 -25 3  16 o 0 326.3   9.7   ?     ?   315.251   162.978      435.569    162.978      154.33     162.978      
1 1 1 -25 3  15 o 0 43.9    4.7   ?     ?   139.346   -158.839     8.79892    -158.839     116.446    21.1611      
1 1 1 -25 3  14 o 0 134.9   5.7   ?     ?   334.899   88.1679      127.986    88.1679      181.584    -91.8321     
1 1 1 -25 3  13 o 0 278     8     ?     ?   630.367   -133.485     112.859    -133.485     473.633    46.5147      
1 1 1 -25 3  12 o 0 975     18    ?     ?   740.766   -135.684     635.58     -135.684     47.7381    44.3162      
1 1 1 -25 3  11 o 0 102.2   3.5   ?     ?   305.245   122.529      75.3354    122.529      207.794    -57.4707     
1 1 1 -25 3  10 o 0 98.7    3.1   ?     ?   512.408   25.9953      93.213     -154.005     577.19     -154.005     
1 1 1 -25 3  9  o 0 3269.7  55.9  ?     ?   1324.73   -79.8802     1233.3     -79.8802     23.5958    100.12       
1 1 1 -25 3  8  o 0 2722.1  54    ?     ?   1088.06   24.2601      1239.84    24.2601      203.314    24.2601      
1 1 1 -25 3  7  o 0 56.3    3     ?     ?   125.281   102.606      34.0723    102.606      90.5242    -77.3945     
1 1 1 -25 3  6  o 0 1156.2  24    ?     ?   881.772   -157.824     681.948    -157.824     197.741    22.1756      
1 1 1 -25 3  5  o 0 1024.2  21    ?     ?   678.639   -78.4095     786.036    -78.4095     107.168    -78.4095     
1 1 1 -25 3  4  o 0 2240.2  44.1  ?     ?   804.864   102.826      1384.41    102.826      577.394    102.826      
1 1 1 -25 3  3  o 0 433     8.9   ?     ?   242.122   78.461       640.097    78.461       396.839    78.461       
1 1 1 -25 3  2  o 0 247.3   5     ?     ?   539.326   110.617      156.066    110.617      386.736    -69.3826     
1 1 1 -25 3  1  o 0 623     11.8  ?     ?   536.102   -161.502     594.969    -161.502     54.5945    -161.502     
1 1 1 25  3  0  o 0 143.7   4.3   ?     ?   183.91    -33.3218     239.749    -33.3218     54.9671    -33.3218     
1 1 1 25  3  2  o 0 251.9   6.4   ?     ?   368.784   -34.5424     315.085    -34.5424     56.8609    145.458      
1 1 1 25  3  3  o 0 166     4.1   ?     ?   295.018   -45.3653     230.713    -45.3653     67.3173    134.635      
1 1 1 25  3  4  o 0 759.3   15    ?     ?   513.599   107.338      740.814    107.338      221.3      107.338      
1 1 1 25  3  5  o 0 331.9   7.2   ?     ?   358.674   -12.1767     436.275    -12.1767     73.1562    -12.1767     
1 1 1 25  3  6  o 0 436.3   10.7  ?     ?   577.058   -140.323     366.354    -140.323     218.07     39.6767      
1 1 1 25  3  7  o 0 511.7   13    ?     ?   548.24    104.91       475.5      104.91       79.6329    -75.0901     
1 1 1 25  3  8  o 0 115.3   5.5   ?     ?   182.172   -122.685     164.253    -122.685     12.9305    57.3149      
1 1 1 25  3  9  o 0 194.8   6.5   ?     ?   345.734   72.4754      225.001    72.4754      110.801    -107.525     
1 1 1 25  3  10 o 0 984.7   19.8  ?     ?   558.568   105.948      825.31     105.948      283.864    105.948      
1 1 1 25  3  11 o 0 2495.5  47.6  ?     ?   1173.78   -167.004     1091.63    -167.004     28.4585    12.9964      
1 1 1 25  3  12 o 0 372.8   12.6  ?     ?   492.667   -174.426     344.601    -174.426     124.05     5.57444      
1 1 1 25  3  13 o 0 34.6    10    ?     ?   363.959   31.2525      157.245    -148.748     507.248    -148.748     
1 1 1 25  3  14 o 0 983.7   23.8  ?     ?   592.194   136.957      816.721    136.957      249.654    136.957      
1 1 1 25  3  15 o 0 416.7   16.8  ?     ?   432.161   108.162      470.832    108.162      67.5597    108.162      
1 1 1 25  3  16 o 0 1802.9  38    ?     ?   1017.79   43.454       936.577    43.454       16.4547    -136.546     
1 1 1 25  3  17 o 0 51      13.3  ?     ?   231.341   -65.0506     42.2292    -65.0506     173.833    114.949      
1 1 1 25  3  18 o 0 173.8   17.8  ?     ?   239.967   -32.4971     346.669    -32.4971     95.9837    -32.4971     
1 1 1 25  3  19 o 0 238.3   18    ?     ?   246.397   -107.29      468.334    -107.29      217.109    -107.29      
1 1 1 25  3  20 o 0 23.8    17.2  ?     ?   85.5925   -140.376     32.7105    -140.376     52.4935    39.6237      
1 1 1 25  3  21 o 0 84.2    20.9  ?     ?   145.565   -53.3729     240.806    -53.3729     100.041    -53.3729     
1 1 1 25  3  22 o 0 166.4   22    ?     ?   287.035   50.0153      315.19     50.0154      37.4       50.0154      
1 1 1 25  3  23 o 0 252.9   30.9  ?     ?   254.312   89.8834      495.618    89.8834      230.662    89.8834      
1 1 1 25  3  24 o 0 35.3    25    ?     ?   64.8666   -151.338     106.553    -151.338     41.3276    -151.338     
1 1 1 25  3  25 o 0 32.8    30.5  ?     ?   110.7     -121.729     102.702    -121.729     5.30426    58.2706      
1 1 1 -25 5  26 < 0 13.7    10.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 5  25 o 0 30.9    11.4  ?     ?   182.208   177.063      55.6571    177.063      106.245    -2.93685     
1 1 1 -25 5  24 o 0 44.3    9.1   ?     ?   138.412   155.296      141.879    155.296      15.7872    155.296      
1 1 1 -25 5  23 o 0 43      9.7   ?     ?   142.192   51.1771      126.051    51.1771      12.4212    -128.823     
1 1 1 -25 5  22 o 0 496.9   13.7  ?     ?   371.665   35.7787      674.04     35.7787      310.83     35.7787      
1 1 1 -25 5  21 o 0 63.4    7.1   ?     ?   81.2357   85.2021      185.964    85.2021      112.698    85.2021      
1 1 1 -25 5  20 o 0 72.4    7.5   ?     ?   58.1204   -34.7077     186.183    -34.7077     133.43     -34.7077     
1 1 1 -25 5  19 o 0 9.5     6     ?     ?   71.796    -171.474     25.4911    8.52629      92.9707    8.52629      
1 1 1 -25 5  18 o 0 170.3   7.4   ?     ?   263.321   111.177      319.67     111.177      65.639     111.177      
1 1 1 -25 5  17 o 0 29.1    5.3   ?     ?   198.962   -112.548     18.507     67.4518      215.586    67.4518      
1 1 1 -25 5  16 o 0 556.8   12.3  ?     ?   652.45    132.326      400.951    132.326      176.221    -47.6737     
1 1 1 -25 5  15 o 0 1334.6  24.6  ?     ?   936.559   111.667      710.61     111.667      124.441    -68.3333     
1 1 1 -25 5  14 o 0 222.2   9.4   ?     ?   302.397   -7.31847     306.471    -7.31847     37.2016    -7.31847     
1 1 1 -25 5  13 o 0 1270.4  23.1  ?     ?   693.34    -56.1542     879.709    -56.1542     244.799    -56.1542     
1 1 1 -25 5  12 o 0 427.9   9     ?     ?   384.125   51.9993      490.781    51.9993      136.748    51.9993      
1 1 1 -25 5  11 o 0 1064.9  20.8  ?     ?   739.092   85.8096      709.808    85.8096      16.2321    85.8096      
1 1 1 -25 5  10 f 1 104.7   4.7   ?     ?   350.608   167.287      48.8902    167.287      274.903    -12.7135     
1 1 1 -25 5  9  o 0 1361.6  24.8  ?     ?   929.407   150.191      713.352    150.191      144.876    -29.8094     
1 1 1 -25 5  8  o 0 320.6   9.9   ?     ?   531.177   -167.926     238.425    -167.926     260.801    12.0742      
1 1 1 -25 5  7  o 0 107.5   3.4   ?     ?   346.743   9.84515      59.2847    9.84515      267.926    -170.155     
1 1 1 -25 5  6  o 0 854.8   15.5  ?     ?   478.681   -15.5931     781.875    -15.5931     328.535    -15.5931     
1 1 1 -25 5  5  o 0 322.1   7.2   ?     ?   490.233   -34.577      278.34     -34.577      187.4      145.423      
1 1 1 -25 5  4  o 0 5661.3  136.8 ?     ?   1651.03   -17.8462     1832.57    -17.8462     196.437    -17.8462     
1 1 1 -25 5  3  o 0 441     14.3  ?     ?   775.093   70.8433      177.515    70.8433      592.348    -109.157     
1 1 1 -25 5  2  o 0 794.7   24.7  ?     ?   518.252   62.5315      753.885    62.5315      238.144    62.5315      
1 1 1 -25 5  1  o 0 213.7   5.7   ?     ?   349.584   -17.0481     268.235    -17.0481     80.1952    162.952      
1 1 1 25  5  0  o 0 871.2   17.4  ?     ?   701.097   -53.0391     644.432    -53.0391     52.6701    126.961      
1 1 1 25  5  1  o 0 665.3   14    ?     ?   629.135   167.799      540.217    167.799      86.4067    -12.201      
1 1 1 25  5  2  o 0 1279.7  22.8  ?     ?   787.4     -85.8018     855.68     -85.8018     70.2624    -85.8018     
1 1 1 25  5  3  o 0 132.6   3.9   ?     ?   395.422   -84.5927     85.0475    -84.5927     309.845    95.4073      
1 1 1 25  5  4  o 0 34      3     ?     ?   206.063   -9.85655     63.25      170.143      271.69     170.143      
1 1 1 25  5  5  o 0 1221.4  22.5  ?     ?   783.036   156.436      772.2      156.436      19.5922    156.436      
1 1 1 25  5  6  o 0 1169.9  21.6  ?     ?   694.294   109.488      820.822    109.488      153.578    109.488      
1 1 1 25  5  7  o 0 1152.5  31.7  ?     ?   750.042   147.249      757.341    147.249      36.9761    147.249      
1 1 1 25  5  8  o 0 2196.9  57.4  ?     ?   1216.76   19.2565      891.444    19.2565      275.788    -160.743     
1 1 1 25  5  9  o 0 454.2   14.3  ?     ?   467.33    -21.9711     452.597    -21.9711     10.8989    -21.9711     
1 1 1 25  5  10 f 1 660     20.3  ?     ?   325.733   -165.354     755.459    -165.354     446.724    -165.354     
1 1 1 25  5  11 o 0 535.7   17.9  ?     ?   683.916   -132.388     360.046    -132.388     292.464    47.6124      
1 1 1 25  5  12 o 0 146.5   9.3   ?     ?   222.962   -101.507     216.742    -101.507     4.74782    -101.507     
1 1 1 25  5  13 o 0 61      11.5  ?     ?   118.855   -71.56       52.9609    -71.56       57.2541    108.44       
1 1 1 25  5  14 o 0 406.8   14.1  ?     ?   474.045   167.88       420.56     167.88       17.0506    -12.1199     
1 1 1 25  5  15 o 0 81      12    ?     ?   252.246   -129.389     96.6761    -129.389     137.046    50.6106      
1 1 1 25  5  16 o 0 57.9    11.3  ?     ?   81.0814   24.7496      103.582    24.7496      19.2216    24.7496      
1 1 1 25  5  17 o 0 65.3    12.9  ?     ?   245.425   -30.5016     102.445    -30.5016     146.947    149.498      
1 1 1 25  5  18 o 0 20.1    13.8  ?     ?   121.314   27.7126      6.75489    -152.287     129.237    -152.287     
1 1 1 25  5  19 o 0 91.2    19.8  ?     ?   192.493   123.648      221.805    123.648      32.021     123.648      
1 1 1 25  5  20 o 0 95.2    18.2  ?     ?   200.365   5.12304      233.941    5.12304      42.0025    5.12304      
1 1 1 25  5  21 o 0 49.3    22.6  ?     ?   111.03    -90.3202     138.887    -90.3202     32.4254    -90.3202     
1 1 1 25  5  22 o 0 -5.1    24.4  ?     ?   103.241   -11.6437     2.93364    -11.6437     103.652    168.356      
1 1 1 25  5  23 o 0 7.3     26    ?     ?   124.281   -70.5325     27.6234    -70.5325     96.2273    109.467      
1 1 1 25  5  24 o 0 -0.1    27.5  ?     ?   140.863   -25.583      15.4931    -25.583      120.728    154.417      
1 1 1 25  5  25 o 0 20.8    30.9  ?     ?   34.4664   44.1213      81.0459    44.1213      48.3824    44.1213      
1 1 1 -25 7  25 < 0 11.1    12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 7  24 f 1 98.9    10.6  ?     ?   168.321   -17.5756     275.989    -17.5756     127.798    -17.5756     
1 1 1 -25 7  23 o 0 41.2    10.9  ?     ?   206.505   53.7372      77.9764    53.7372      107.034    -126.263     
1 1 1 -25 7  22 o 0 181.3   10.1  ?     ?   340.65    88.9961      287.205    88.9961      28.026     -91.0039     
1 1 1 -25 7  21 o 0 1.9     8.6   ?     ?   119.164   153.33       54.278     -26.6703     168.779    -26.6703     
1 1 1 -25 7  20 o 0 35.4    7.4   ?     ?   87.84     130.602      101.913    130.602      23.3444    130.602      
1 1 1 -25 7  19 o 0 96.6    6.8   ?     ?   225.525   -5.71199     210.349    -5.71199     8.37195    -5.71199     
1 1 1 -25 7  18 o 0 15      6.3   ?     ?   130.304   -67.2679     12.8477    112.732      130.224    112.732      
1 1 1 -25 7  17 o 0 90.9    6.3   ?     ?   217.858   8.56261      197.372    8.56261      5.72523    -171.437     
1 1 1 -25 7  16 o 0 102.1   5.5   ?     ?   202.8     25.7977      224.854    25.7977      30.9108    25.7977      
1 1 1 -25 7  15 o 0 115.7   5.1   ?     ?   204.664   -100.583     237.511    -100.583     36.665     -100.583     
1 1 1 -25 7  14 o 0 36.1    4.3   ?     ?   192.986   -112.594     8.49126    67.4062      177.526    67.4062      
1 1 1 -25 7  13 f 1 364.7   8.9   ?     ?   365.869   -116.325     442.727    -116.325     118.266    -116.325     
1 1 1 -25 7  12 o 0 78.5    3.9   ?     ?   370.389   -86.7054     4.11656    93.2946      330.28     93.2946      
1 1 1 -25 7  11 o 0 246.4   7.8   ?     ?   384.906   -100.514     281.075    -100.514     60.0228    79.4862      
1 1 1 -25 7  10 o 0 708.5   14    ?     ?   542.938   119.958      613.515    119.958      119.253    119.958      
1 1 1 -25 7  9  o 0 475.1   9.9   ?     ?   593.434   -175.41      365.004    -175.41      178.131    4.59018      
1 1 1 -25 7  8  o 0 631.7   12.2  ?     ?   839.698   -168.972     287.355    -168.972     494.282    11.0285      
1 1 1 -25 7  7  o 0 5.2     1.9   ?     ?   213.104   -137.293     171.791    42.7068      365.799    42.7068      
1 1 1 -25 7  6  o 0 249.9   6.1   ?     ?   104.881   24.6333      332.641    24.6333      236.783    24.6333      
1 1 1 -25 7  5  o 0 698.2   13    ?     ?   655.124   102.241      500.451    102.241      100.38     -77.7586     
1 1 1 -25 7  4  o 0 388.4   8.6   ?     ?   397.449   -22.1784     427.029    -22.1784     61.4293    -22.1784     
1 1 1 -25 7  3  o 0 75.9    2.7   ?     ?   189.984   -168.425     67.3386    -168.425     110.176    11.5749      
1 1 1 -25 7  2  o 0 3542.4  91.2  ?     ?   1454.58   34.6315      1195.76    34.6315      166.196    -145.369     
1 1 1 -25 7  1  o 0 660.5   20.4  ?     ?   664.779   -61.6926     458.616    -61.6926     164.876    118.307      
1 1 1 25  7  0  f 1 967.1   18.2  ?     ?   644.528   -68.3207     708.446    -68.3207     100.327    -68.3207     
1 1 1 25  7  1  o 0 1045.4  19.2  ?     ?   569.362   52.316       832.291    52.316       297.114    52.316       
1 1 1 25  7  2  o 0 1222.8  22.7  ?     ?   888.352   111.175      660.857    111.175      175.025    -68.8253     
1 1 1 25  7  3  o 0 1053.2  20.1  ?     ?   537.528   40.3331      866.695    40.3331      360.57     40.3331      
1 1 1 25  7  4  o 0 661.6   13.9  ?     ?   521.794   47.9062      591.809    47.9062      106.759    47.9062      
1 1 1 25  7  5  o 0 312.8   9     ?     ?   377.367   -147.852     358.661    -147.852     7.92105    -147.852     
1 1 1 25  7  6  o 0 1180    24.3  ?     ?   750.97    26.9517      766.735    26.9517      69.1832    26.9517      
1 1 1 25  7  7  o 0 1216.6  25.2  ?     ?   757.032   16.904       783.371    16.904       80.9719    16.904       
1 1 1 25  7  8  o 0 932.6   20.2  ?     ?   399.192   74.3269      927.9      74.3269      552.685    74.3269      
1 1 1 25  7  9  o 0 1047    23.1  ?     ?   688.462   39.5298      759.306    39.5298      113.587    39.5298      
1 1 1 25  7  10 o 0 181.7   10.1  ?     ?   399.481   142.437      165.136    142.437      208.539    -37.5632     
1 1 1 25  7  11 o 0 1355.1  28    ?     ?   941.777   92.3593      744.924    92.3593      114.893    -87.6407     
1 1 1 25  7  12 o 0 561.9   17    ?     ?   432.19    70.9199      603.872    70.9199      210.768    70.9199      
1 1 1 25  7  13 f 1 614.6   18.5  ?     ?   376.948   108.661      698.632    108.661      352.471    108.661      
1 1 1 25  7  14 o 0 22.4    9.7   ?     ?   210.732   122.672      65.9532    -57.3275     282.305    -57.3275     
1 1 1 25  7  15 o 0 378.3   17.1  ?     ?   339.339   69.739       562.456    69.739       215.899    69.739       
1 1 1 25  7  16 o 0 15.5    13.5  ?     ?   287.1     -90.8338     132.62     89.1662      419.054    89.1662      
1 1 1 25  7  17 o 0 272.6   17.5  ?     ?   169.34    -78.5823     576.95     -78.5823     411.857    -78.5823     
1 1 1 25  7  18 o 0 7.8     16.7  ?     ?   129.707   -165.281     18.0661    14.719       140.55     14.719       
1 1 1 25  7  19 o 0 332.4   28.4  ?     ?   207.502   127.647      626.769    127.647      431.484    127.647      
1 1 1 25  7  20 o 0 14.9    28.4  ?     ?   155.416   20.844       24.3372    20.844       129.183    -159.156     
1 1 1 25  7  21 o 0 125.7   25.5  ?     ?   209.303   47.5028      293.823    47.5028      79.8628    47.5028      
1 1 1 25  7  22 o 0 211.3   33.9  ?     ?   262.803   91.9895      412.195    91.9895      154.767    91.9895      
1 1 1 25  7  23 o 0 1.7     27.2  ?     ?   65.2598   -179.153     50.284     -179.153     10.9495    0.846728     
1 1 1 -25 9  23 < 1 18.7    11.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 9  22 o 0 11.7    11.9  ?     ?   40.175    134.488      23.5385    134.488      11.1101    -45.5118     
1 1 1 -25 9  21 o 0 125.6   10.9  ?     ?   143.348   154.899      340.991    154.899      214.326    154.899      
1 1 1 -25 9  20 o 0 10.5    8.8   ?     ?   69.9952   73.9609      2.15351    73.9609      63.9168    -106.039     
1 1 1 -25 9  19 o 0 44.6    8.5   ?     ?   111.389   23.3816      141.226    23.3816      35.7898    23.3816      
1 1 1 -25 9  18 o 0 136.1   8.3   ?     ?   233.849   145.885      281.313    145.885      75.39      145.885      
1 1 1 -25 9  17 o 0 39.8    6     ?     ?   207.85    -167.614     61.4659    -167.614     121.682    12.3861      
1 1 1 -25 9  16 o 0 78      6.3   ?     ?   265.592   157.465      133.273    157.465      101.964    -22.5348     
1 1 1 -25 9  15 o 0 107.6   5.9   ?     ?   173.098   -50.759      262.7      -50.759      104.136    -50.759      
1 1 1 -25 9  14 o 0 48      5.3   ?     ?   179.281   -17.5383     86.9907    -17.5383     81.3683    162.462      
1 1 1 -25 9  13 o 0 251.1   7.3   ?     ?   371.659   28.5622      351.335    28.5622      0.319404   -151.438     
1 1 1 -25 9  12 o 0 26.5    3.6   ?     ?   76.764    73.6167      8.56924    73.6167      65.8771    -106.383     
1 1 1 -25 9  11 o 0 450.6   9.9   ?     ?   371.283   57.502       594.1      57.502       231.649    57.502       
1 1 1 -25 9  10 o 0 538.6   11.1  ?     ?   564.115   -73.3943     451.491    -73.3943     39.2213    106.606      
1 1 1 -25 9  9  o 0 518.7   10.6  ?     ?   548.99    -148.289     448.428    -148.289     31.8165    31.7115      
1 1 1 -25 9  8  o 0 1226    23.1  ?     ?   750.571   -174.634     797.076    -174.634     142.844    -174.634     
1 1 1 -25 9  7  f 1 156.1   4.8   ?     ?   252.237   -92.1713     226.445    -92.1713     4.42355    -92.1713     
1 1 1 -25 9  6  f 1 863.7   19.4  ?     ?   608.667   -4.65906     681.309    -4.65906     143.32     -4.65906     
1 1 1 -25 9  5  o 0 337.4   7.8   ?     ?   148.211   36.7602      485.25     36.7602      351.656    36.7602      
1 1 1 -25 9  4  o 0 150.2   4.3   ?     ?   203.376   169.9        218.37     169.9        34.461     169.9        
1 1 1 -25 9  3  o 0 220     6.1   ?     ?   439.872   21.0808      187.652    21.0808      211.209    -158.919     
1 1 1 -25 9  2  o 0 820     21.9  ?     ?   567.627   161.767      678.427    161.767      162.543    161.767      
1 1 1 -25 9  1  o 0 1583.4  41.6  ?     ?   777.404   177.782      979.512    177.782      271.673    177.782      
1 1 1 25  9  0  o 0 157.2   6.7   ?     ?   227.409   -178.587     226.771    -178.587     18.6259    -178.587     
1 1 1 25  9  1  o 0 998.2   20.1  ?     ?   850.075   -110.668     566.759    -110.668     212.074    69.3324      
1 1 1 25  9  2  o 0 560.9   12.2  ?     ?   473.828   -20.1407     547.611    -20.1407     113.223    -20.1407     
1 1 1 25  9  3  o 0 345.4   9     ?     ?   267.817   -78.0734     475.954    -78.0734     230.372    -78.0734     
1 1 1 25  9  4  o 0 1314.7  25.2  ?     ?   383.268   -157.983     1165.77    -157.983     814.385    -157.983     
1 1 1 25  9  5  o 0 145.6   7.4   ?     ?   81.1362   -78.3007     156.754    -78.3007     82.4139    -78.3007     
1 1 1 25  9  6  f 1 1005.3  22.7  ?     ?   764.316   95.0336      660.959    95.0336      27.5269    -84.9664     
1 1 1 25  9  7  f 1 41.6    5.8   ?     ?   84.0067   156.144      7.24069    156.144      68.3137    -23.8558     
1 1 1 25  9  8  o 0 98.6    7.4   ?     ?   383.177   -136.541     33.2318    -136.541     308.929    43.4593      
1 1 1 25  9  9  o 0 253.8   10.6  ?     ?   234.848   -14.4557     408.003    -14.4557     196.995    -14.4557     
1 1 1 25  9  10 o 0 257.8   11.5  ?     ?   378.417   27.0441      309.8      27.0441      29.1693    -152.956     
1 1 1 25  9  11 o 0 44      8.9   ?     ?   167.41    20.3602      57.6118    20.3602      111.107    -159.64      
1 1 1 25  9  12 o 0 81.1    10.9  ?     ?   143.044   -1.17827     181.859    -1.17827     38.2806    -1.17827     
1 1 1 25  9  13 o 0 50.7    10.7  ?     ?   143.321   -68.894      115.181    -68.894      25.522     111.106      
1 1 1 25  9  14 o 0 71.1    12.5  ?     ?   144.252   131.139      195.345    131.139      56.7931    131.139      
1 1 1 25  9  15 o 0 251.6   16.8  ?     ?   288.107   174.506      452.139    174.506      183.794    174.506      
1 1 1 25  9  16 o 0 137.8   18.9  ?     ?   210.786   -117.819     313.63     -117.819     118.478    -117.819     
1 1 1 25  9  17 o 0 64.2    19.6  ?     ?   123.53    -25.765      184.453    -25.765      70.394     -25.765      
1 1 1 25  9  18 o 0 206.4   22.2  ?     ?   224.141   -18.3478     441.837    -18.3478     224.475    -18.3478     
1 1 1 25  9  19 o 0 217.6   25.7  ?     ?   279.234   -15.6639     399.811    -15.6639     119.402    -15.6639     
1 1 1 25  9  20 o 0 243.5   29.2  ?     ?   220.901   169.809      495.012    169.809      282.321    169.809      
1 1 1 25  9  21 o 0 482.3   32.2  ?     ?   472.231   -172.238     573.654    -172.238     132.106    -172.238     
1 1 1 25  9  22 o 0 21      32    ?     ?   92.8124   112.536      98.001     112.536      12.8984    112.536      
1 1 1 -25 11 21 < 0 105.3   12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 11 20 o 0 153     12.4  ?     ?   260.76    -53.2785     299.561    -53.2785     79.1546    -53.2785     
1 1 1 -25 11 19 o 0 14.2    10.3  ?     ?   129.478   -19.326      8.22278    -19.326      103.582    160.674      
1 1 1 -25 11 18 o 0 53.1    9.8   ?     ?   191.632   98.1984      122.426    98.1984      48.2793    -81.8016     
1 1 1 -25 11 17 o 0 60.9    8.6   ?     ?   171.267   -77.4826     157.592    -77.4826     1.80962    102.517      
1 1 1 -25 11 16 f 1 49.8    7.1   ?     ?   164.88    -50.0251     126.926    -50.0251     27.576     129.975      
1 1 1 -25 11 15 f 1 33.8    6.3   ?     ?   160.542   -161.437     70.2429    -161.437     69.5468    18.5628      
1 1 1 -25 11 14 o 0 181.7   7.3   ?     ?   300.927   165.322      306.326    165.322      45.7734    165.322      
1 1 1 -25 11 13 o 0 25.5    5.5   ?     ?   71.1459   93.309       49.7964    93.309       12.2825    -86.691      
1 1 1 -25 11 12 o 0 167.8   6.2   ?     ?   230.03    -109.392     342.445    -109.392     141.027    -109.392     
1 1 1 -25 11 11 o 0 158.9   6     ?     ?   334.163   -108.593     237.694    -108.593     64.4179    71.4074      
1 1 1 -25 11 10 o 0 23.1    4.5   ?     ?   183.49    -137.181     1.28382    42.8191      168.223    42.8191      
1 1 1 -25 11 9  o 0 182.1   6     ?     ?   242.725   -42.3153     344.66     -42.3153     118.767    -42.3153     
1 1 1 -25 11 8  o 0 422     9.9   ?     ?   339.338   47.2924      588.982    47.2924      271.484    47.2924      
1 1 1 -25 11 7  o 0 186.9   5.4   ?     ?   230.359   40.2145      349.437    40.2145      129.006    40.2145      
1 1 1 -25 11 6  o 0 64.7    3.8   ?     ?   113.004   94.6288      129.382    94.6288      20.7747    94.6288      
1 1 1 -25 11 5  o 0 154.5   5.5   ?     ?   452.084   -117.771     109.288    -117.771     326.902    62.2295      
1 1 1 -25 11 4  o 0 407.1   10    ?     ?   394.584   -121.832     461.965    -121.832     122.553    -121.832     
1 1 1 -25 11 3  o 0 401.6   10    ?     ?   368.563   -104.987     469.731    -104.987     152.774    -104.987     
1 1 1 -25 11 2  o 0 338     9.8   ?     ?   227.7     -135.167     497.68     -135.167     301.374    -135.167     
1 1 1 -25 11 1  o 0 425.7   10.2  ?     ?   372.448   -170.881     493.546    -170.881     171.797    -170.881     
1 1 1 25  11 0  o 0 484.9   11.6  ?     ?   225.779   -126.89      657.569    -126.89      460.57     -126.89      
1 1 1 25  11 1  o 0 244.9   7.8   ?     ?   368.278   -115.264     292.978    -115.264     28.5634    64.7358      
1 1 1 25  11 2  o 0 753.6   15.9  ?     ?   624.673   -46.238      580.434    -46.238      34.8999    -46.238      
1 1 1 25  11 3  o 0 287.5   9     ?     ?   474.53    -113.228     264.292    -113.228     150.053    66.7723      
1 1 1 25  11 4  o 0 63.9    6.1   ?     ?   355.549   -52.6367     11.4593    127.363      361.787    127.363      
1 1 1 25  11 5  o 0 166.5   7.6   ?     ?   245.982   -30.8689     311.352    -30.8689     69.2326    -30.8689     
1 1 1 25  11 6  o 0 68.5    8.2   ?     ?   94.9561   167.521      135.764    167.521      42.4372    167.521      
1 1 1 25  11 7  o 0 492.9   13.8  ?     ?   428.061   160.188      591.034    160.188      171.137    160.188      
1 1 1 25  11 8  o 0 45.3    8.4   ?     ?   209.574   104.666      59.9088    104.666      141.59     -75.3342     
1 1 1 25  11 9  o 0 180.4   9.7   ?     ?   312.14    -127.638     294.47     -127.638     4.77499    52.3619      
1 1 1 25  11 10 o 0 -1.2    11.6  ?     ?   55.5302   -13.663      26.2083    166.337      78.3784    166.337      
1 1 1 25  11 11 o 0 227     12.1  ?     ?   337.263   -17.6957     356.291    -17.6957     40.6591    -17.6957     
1 1 1 25  11 12 o 0 23.3    13.2  ?     ?   81.188    -18.0107     35.125     -18.0107     38.6426    161.989      
1 1 1 25  11 13 o 0 80.8    13    ?     ?   277.641   -120.501     130.222    -120.501     121.772    59.4987      
1 1 1 25  11 14 o 0 73.5    13.7  ?     ?   138.984   -4.29742     211.803    -4.29742     85.2262    -4.29742     
1 1 1 25  11 15 f 1 396.3   19.2  ?     ?   399.51    6.84831      545.199    6.84831      163.994    6.84831      
1 1 1 25  11 16 f 1 252.9   19    ?     ?   278.475   65.8095      451.85     65.8095      178.438    65.8095      
1 1 1 25  11 17 o 0 4.8     20.3  ?     ?   160.209   23.4275      21.6974    -156.572     178.309    -156.572     
1 1 1 25  11 18 o 0 93.2    23.2  ?     ?   184.611   85.2879      234.355    85.2879      64.8226    85.2879      
1 1 1 25  11 19 o 0 73.3    24.8  ?     ?   142.853   166.592      201.577    166.592      73.0841    166.592      
1 1 1 25  11 20 o 0 -9      28.1  ?     ?   96.4368   -155.286     39.9886    -155.286     46.2519    24.7136      
1 1 1 -25 13 18 < 1 8.4     12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 13 17 f 1 24.9    9.3   ?     ?   114.409   -39.8557     78.039     -39.8557     17.0582    140.144      
1 1 1 -25 13 16 o 0 25.8    8.8   ?     ?   121.086   24.4086      73.6341    24.4086      27.2098    -155.591     
1 1 1 -25 13 15 o 0 11.8    9     ?     ?   55.5515   160.43       15.2096    160.43       32.0837    -19.5697     
1 1 1 -25 13 14 o 0 189.3   15.8  ?     ?   211.941   42.5737      388.146    42.5737      202.316    42.5737      
1 1 1 -25 13 13 o 0 68.6    8.8   ?     ?   161.725   80.0952      182.926    80.0952      35.0177    80.0952      
1 1 1 -25 13 12 o 0 80.9    6.4   ?     ?   145.98    -179.483     224.781    -179.483     91.2772    -179.483     
1 1 1 -25 13 11 o 0 5.5     5.5   ?     ?   78.5026   -65.3737     31.2778    114.626      103.574    114.626      
1 1 1 -25 13 10 o 0 5.5     5.8   ?     ?   86.812    -6.51219     34.4803    173.488      108.609    173.488      
1 1 1 -25 13 9  o 0 46.4    5.7   ?     ?   63.7226   -79.7045     125.995    -79.7045     71.255     -79.7045     
1 1 1 -25 13 8  f 1 157.6   6.5   ?     ?   367.78    -16.2916     208.278    -16.2916     108.273    163.708      
1 1 1 -25 13 7  o 0 150     7.8   ?     ?   246.754   -18.4296     292.066    -18.4296     79.7004    -18.4296     
1 1 1 -25 13 6  f 1 91.2    6.4   ?     ?   275.698   66.8348      152.39     66.8348      86.2989    -113.165     
1 1 1 -25 13 5  o 0 22.8    6.2   ?     ?   97.0642   3.19449      37.926     3.19449      46.0219    -176.806     
1 1 1 -25 13 4  o 0 11.1    4.7   ?     ?   174.502   86.3653      57.1074    -93.6347     208.576    -93.6347     
1 1 1 -25 13 3  o 0 93.3    7.4   ?     ?   120.421   -75.2283     246.83     -75.2283     139.297    -75.2283     
1 1 1 -25 13 2  o 0 187.8   7.6   ?     ?   360.935   -91.9187     261.727    -91.9187     61.4494    88.0813      
1 1 1 -25 13 1  o 0 298.9   10.8  ?     ?   291.725   -81.8632     478.067    -81.8632     216.277    -81.8632     
1 1 1 25  13 0  o 0 59.9    6     ?     ?   154.328   -71.7704     150.776    -71.7704     10.2284    -71.7704     
1 1 1 25  13 1  o 0 3.5     5.3   ?     ?   114.598   8.47936      69.9972    -171.521     174.395    -171.521     
1 1 1 25  13 2  o 0 17      6.6   ?     ?   42.8754   -95.8706     4.17616    -95.8706     34.8798    84.1294      
1 1 1 25  13 3  o 0 55      6.3   ?     ?   161.305   -23.3632     141.674    -23.3632     1.52988    156.637      
1 1 1 25  13 4  o 0 49.8    7.7   ?     ?   48.6916   54.6642      107.155    54.6642      63.9676    54.6642      
1 1 1 25  13 5  o 0 108.1   8.2   ?     ?   198.86    57.3504      252.798    57.3504      76.6639    57.3504      
1 1 1 25  13 6  f 1 148.9   9.8   ?     ?   159.127   -41.9014     358.311    -41.9014     216.905    -41.9014     
1 1 1 25  13 7  o 0 72.6    9.2   ?     ?   225.746   -148.101     147.794    -148.101     52.0799    31.8986      
1 1 1 25  13 8  f 1 36.6    10.3  ?     ?   200.012   -179.043     51.939     -179.043     125.57     0.957225     
1 1 1 25  13 9  o 0 47.4    10.9  ?     ?   134.936   30.2802      132.773    30.2802      12.9739    30.2802      
1 1 1 25  13 10 o 0 33      12.5  ?     ?   179.136   -11.8156     47.2376    -11.8156     111.217    168.184      
1 1 1 25  13 11 o 0 23.3    14.5  ?     ?   147.299   -93.226      27.8169    -93.226      113.031    86.774       
1 1 1 25  13 12 o 0 97.4    14.1  ?     ?   233.369   -18.1932     203.731    -18.1932     20.0519    161.807      
1 1 1 25  13 13 o 0 1.5     16.6  ?     ?   55.6583   -49.3053     4.12556    -49.3053     48.9745    130.695      
1 1 1 25  13 14 o 0 12.8    12.6  ?     ?   148.717   160.892      10.0456    -19.1084     146.387    -19.1084     
1 1 1 25  13 15 o 0 -5.6    19.9  ?     ?   84.3775   44.2659      5.77205    44.2659      69.5144    -135.734     
1 1 1 25  13 16 o 0 133.2   22.1  ?     ?   244.723   -19.1309     273.801    -19.1309     59.6894    -19.1309     
1 1 1 25  13 17 f 1 88.5    27.5  ?     ?   194.65    -25.0949     191.04     -25.0949     20.6679    -25.0949     
1 1 1 -25 15 14 < 0 -0.6    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 15 13 < 0 -8.1    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 15 12 o 0 10.1    7.9   ?     ?   60.3984   117.607      23.9444    117.607      25.1391    -62.3931     
1 1 1 -25 15 11 o 0 202.9   10.8  ?     ?   317.537   177.739      324.955    177.739      65.6355    177.739      
1 1 1 -25 15 10 o 0 55.2    7.7   ?     ?   129.951   -147.657     175.111    -147.657     68.2744    -147.657     
1 1 1 -25 15 9  o 0 10.8    5.8   ?     ?   166.938   -65.8793     34.2956    114.121      174.217    114.121      
1 1 1 -25 15 8  o 0 60.6    6.9   ?     ?   139.184   149.642      176.423    149.642      56.5962    149.642      
1 1 1 -25 15 7  o 0 64.6    8.1   ?     ?   235.731   175.577      119.81     175.577      84.2028    -4.42336     
1 1 1 -25 15 6  o 0 23      6.5   ?     ?   22.4468   27.1585      28.8842    27.1585      8.68462    27.1585      
1 1 1 -25 15 5  f 1 25.2    7.2   ?     ?   120.329   -59.2624     61.4301    -59.2624     47.877     120.738      
1 1 1 -25 15 4  o 0 32.5    7.4   ?     ?   164.883   -82.0942     65.7409    -82.0942     83.8433    97.9058      
1 1 1 -25 15 3  o 0 8.5     6.9   ?     ?   92.2276   -46.3116     16.0403    133.688      99.9918    133.688      
1 1 1 -25 15 2  o 0 382.2   12.8  ?     ?   395.763   106.905      482.309    106.905      121.016    106.905      
1 1 1 -25 15 1  o 0 177     9.3   ?     ?   288.339   169.741      302.833    169.741      40.9316    169.741      
1 1 1 25  15 0  o 0 14.1    8.3   ?     ?   92.2333   -88.4418     6.55999    -88.4418     78.8542    91.5582      
1 1 1 25  15 1  o 0 46.8    8.5   ?     ?   145.969   -14.6749     128.417    -14.6749     6.76382    165.325      
1 1 1 25  15 2  o 0 -9.7    9     ?     ?   42.0406   -45.3832     23.6643    134.617      62.8746    134.617      
1 1 1 25  15 3  o 0 47.1    9.3   ?     ?   172.298   -158.994     113.846    -158.994     46.7195    21.0055      
1 1 1 25  15 4  o 0 154     11.6  ?     ?   200.074   106.744      341.392    106.744      155.176    106.744      
1 1 1 25  15 5  f 1 28.4    10.2  ?     ?   88.2332   105.289      80.8377    105.289      1.56547    -74.7111     
1 1 1 25  15 6  o 0 5.1     9.8   ?     ?   197.385   154.467      78.9306    -25.5332     255.773    -25.5332     
1 1 1 25  15 7  o 0 206     15.3  ?     ?   367.108   51.9023      293.364    51.9023      34.682     -128.098     
1 1 1 25  15 8  o 0 12.8    14.1  ?     ?   40.6277   37.7045      22.1905    37.7045      13.2484    -142.295     
1 1 1 25  15 9  o 0 116.7   17.7  ?     ?   180.005   -117.407     285.746    -117.407     129.283    -117.407     
1 1 1 25  15 10 o 0 155.4   19.2  ?     ?   173.008   -97.1033     366.624    -97.1033     218.795    -97.1033     
1 1 1 25  15 11 o 0 167.8   18.5  ?     ?   247.821   -78.1615     331.599    -78.1615     120.787    -78.1615     
1 1 1 25  15 12 o 0 19.1    18.4  ?     ?   134.947   -46.4497     45.219     -46.4497     69.2688    133.55       
1 1 1 25  15 13 < 0 -0.7    18.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 17 6  < 0 0.1     10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 17 5  < 1 105.2   10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 17 4  < 0 135.4   11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 17 3  < 0 48.7    9.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 17 2  < 0 10.9    10.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -25 17 1  < 0 108.6   12.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 0  < 1 -4.7    12.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 1  < 0 197.1   14    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 2  < 0 102.4   14.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 3  < 0 34.3    13    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 4  < 0 68.5    13.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 5  < 1 96.9    16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 25  17 6  < 0 41.3    17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 0  27 < 0 6.2     17.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 0  26 o 0 36.5    16.6  ?     ?   107.085   0            109.267    0            12.1764    0            
1 1 1 -26 0  25 o 0 -14.8   14.9  ?     ?   50.1801   180          7.37678    180          40.2416    1.28625e-15  
1 1 1 -26 0  24 o 0 389.1   20.4  ?     ?   426.421   0            468.626    0            45.2536    0            
1 1 1 -26 0  23 o 0 227.2   15.6  ?     ?   327.303   0            361.68     0            46.8654    0            
1 1 1 -26 0  22 o 0 235.1   13.6  ?     ?   282.396   180          355.077    180          95.6321    180          
1 1 1 -26 0  21 o 0 76.2    9.3   ?     ?   186.832   180          200.699    180          28.0328    180          
1 1 1 -26 0  20 o 0 45.5    9.7   ?     ?   138.431   0            134.919    0            2.50054    0            
1 1 1 -26 0  19 o 0 89.6    8.6   ?     ?   174.669   180          216.468    180          45.0487    180          
1 1 1 -26 0  18 o 0 159.2   10    ?     ?   173.654   180          293.476    180          118.577    180          
1 1 1 -26 0  17 o 0 174.2   9     ?     ?   400.854   180          283.969    180          76.4107    2.60765e-14  
1 1 1 -26 0  16 f 1 5.4     5.3   ?     ?   49.2204   180          2.272      180          42.1453    3.78263e-16  
1 1 1 -26 0  15 o 0 605.4   16.8  ?     ?   644.64    180          537.935    180          57.2032    6.59847e-14  
1 1 1 -26 0  14 f 1 217.1   10    ?     ?   680.064   180          324.008    180          311.086    7.30818e-15  
1 1 1 -26 0  13 o 0 28.4    5.9   ?     ?   436.286   180          92.0168    180          309.805    2.08407e-15  
1 1 1 -26 0  12 o 0 4751.8  112.5 ?     ?   1471.22   0            1492.75    0            130.506    0            
1 1 1 -26 0  11 o 0 31.2    3.3   ?     ?   212.741   0            67.0416    0            133.506    180          
1 1 1 -26 0  10 o 0 1698.2  59.5  ?     ?   780.095   180          900.586    180          162.026    180          
1 1 1 -26 0  8  o 0 1370.7  48.3  ?     ?   648.419   0            858.046    0            214.844    0            
1 1 1 -26 0  7  o 0 379.8   14.9  ?     ?   431.01    180          452.95     180          24.1649    180          
1 1 1 -26 0  6  o 0 1196.3  29.5  ?     ?   1066.86   0            806.316    0            257.709    180          
1 1 1 -26 0  5  o 0 1344.9  33.5  ?     ?   927.317   180          856.75     180          70.1382    8.57102e-14  
1 1 1 -26 0  4  o 0 285     7.8   ?     ?   381.915   0            394.522    0            12.0341    0            
1 1 1 -26 0  3  o 0 101.1   4.7   ?     ?   134.769   0            151.272    0            12.9511    0            
1 1 1 -26 0  2  o 0 493.8   13    ?     ?   512.443   180          534.059    180          7.1888     180          
1 1 1 -26 0  1  o 0 22.7    3.2   ?     ?   212.38    180          55.5354    180          161.316    2.4156e-15   
1 1 1 26  0  0  o 0 1330.6  34.9  ?     ?   918.071   180          879.548    180          59.5077    -4.04479e-13 
1 1 1 26  0  1  o 0 633.6   20.6  ?     ?   397.558   0            607.965    0            197.053    0            
1 1 1 26  0  2  o 0 26      2.5   ?     ?   220.32    0            66.8815    0            161.225    180          
1 1 1 26  0  3  o 0 61.3    3.6   ?     ?   337.717   0            169.344    0            180.847    180          
1 1 1 26  0  4  o 0 1187.1  32    ?     ?   835.496   0            817.269    0            30.717     180          
1 1 1 26  0  5  o 0 385.8   11.5  ?     ?   570.529   180          466.396    180          113.186    2.89131e-14  
1 1 1 26  0  6  o 0 3022.2  107   ?     ?   1262.92   0            1304.54    0            20.9974    0            
1 1 1 26  0  7  o 0 9.4     6.2   ?     ?   33.2355   180          2.779      180          30.9974    6.29067e-16  
1 1 1 26  0  8  o 0 495.3   22.9  ?     ?   247.686   180          525.4      180          273.836    180          
1 1 1 26  0  9  o 0 19.7    7.9   ?     ?   80.0762   0            15.3144    0            62.7752    180          
1 1 1 26  0  10 o 0 141.6   10.3  ?     ?   109.41    0            158.75     0            52.2415    0            
1 1 1 26  0  11 o 0 135.2   11.6  ?     ?   238.731   180          233.408    180          1.54345    180          
1 1 1 26  0  12 o 0 406.3   23.3  ?     ?   93.5966   0            331.796    0            242.332    0            
1 1 1 26  0  13 o 0 98.2    16.5  ?     ?   39.3667   180          42.736     180          4.22367    180          
1 1 1 26  0  14 f 1 33.9    14    ?     ?   124.544   0            38.1449    0            82.3835    180          
1 1 1 26  0  15 o 0 36.3    21.1  ?     ?   107.058   180          34.1797    180          66.3022    3.61721e-15  
1 1 1 26  0  16 f 1 72.2    16.9  ?     ?   13.5103   0            11.9816    0            0.701487   180          
1 1 1 26  0  17 o 0 -0.8    20    ?     ?   155.209   180          15.62      180          129.824    8.44227e-16  
1 1 1 26  0  18 o 0 203.9   27.6  ?     ?   168.151   0            346.976    0            170.098    0            
1 1 1 26  0  19 o 0 123.9   25.8  ?     ?   231.241   180          269.611    180          32.1117    180          
1 1 1 26  0  20 o 0 -18     23.5  ?     ?   104.834   180          17.4391    180          87.7259    1.39486e-15  
1 1 1 26  0  21 o 0 140.7   30    ?     ?   366.176   0            282.888    0            72.7582    180          
1 1 1 26  0  22 o 0 14.3    36    ?     ?   74.6938   180          43.3223    180          29.5851    1.02748e-14  
1 1 1 26  0  23 o 0 53.8    38.2  ?     ?   176.261   180          136.646    180          48.6446    1.97105e-14  
1 1 1 26  0  24 o 0 54      41.4  ?     ?   221.388   180          135.981    180          96.5648    9.8808e-15   
1 1 1 -26 2  27 < 0 346.3   15.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 2  26 o 0 19.5    10.2  ?     ?   121.713   12.2183      46.1845    12.2183      63.2178    -167.782     
1 1 1 -26 2  25 o 0 -14.9   11.3  ?     ?   109.421   26.3069      54.8754    -153.693     155.704    -153.693     
1 1 1 -26 2  24 f 1 252.9   12.4  ?     ?   224.775   0.155312     504.558    0.155312     282.021    0.155312     
1 1 1 -26 2  23 o 0 6.8     8.3   ?     ?   22.5347   -169.863     4.0721     10.1367      26.3444    10.1367      
1 1 1 -26 2  22 o 0 16.8    7.2   ?     ?   86.4263   35.25        10.5117    35.25        68.3155    -144.75      
1 1 1 -26 2  21 o 0 129.4   7.1   ?     ?   216.682   -96.1511     295.106    -96.1511     96.2309    -96.1511     
1 1 1 -26 2  20 o 0 154.6   7.4   ?     ?   167.317   -20.4996     373.626    -20.4996     214.62     -20.4996     
1 1 1 -26 2  19 o 0 170.1   6.8   ?     ?   194.713   62.4871      375.316    62.4871      185.402    62.4871      
1 1 1 -26 2  18 f 1 566.6   13.6  ?     ?   422.042   -39.8557     683.883    -39.8557     259.097    -39.8557     
1 1 1 -26 2  17 o 0 412.1   11.4  ?     ?   313.027   -45.006      541.604    -45.006      261.7      -45.006      
1 1 1 -26 2  16 o 0 303     9.5   ?     ?   202.118   -118.938     469.522    -118.938     288.966    -118.938     
1 1 1 -26 2  15 o 0 920.4   24.8  ?     ?   633.744   102.18       719.511    102.18       149.247    102.18       
1 1 1 -26 2  14 o 0 1168    21.6  ?     ?   908.327   123.824      633.285    123.824      207.126    -56.1758     
1 1 1 -26 2  13 f 1 595.9   11.9  ?     ?   376.54    98.7236      660.24     98.7236      303.588    98.7236      
1 1 1 -26 2  12 o 0 9.3     3.1   ?     ?   240.713   64.9743      178.036    -115.026     400.189    -115.026     
1 1 1 -26 2  11 f 1 487.4   9.6   ?     ?   406.888   147.315      524.813    147.315      145.368    147.315      
1 1 1 -26 2  10 o 0 64.7    2.8   ?     ?   84.6063   115.963      38.507     115.963      41.4061    -64.0371     
1 1 1 -26 2  9  o 0 434.2   8.5   ?     ?   240.238   -52.5479     593.568    -52.5479     365.682    -52.5479     
1 1 1 -26 2  8  o 0 433.2   8.4   ?     ?   287.444   -106.869     595.809    -106.869     307.646    -106.869     
1 1 1 -26 2  7  o 0 401.3   8.9   ?     ?   212.091   -171.342     612.196    -171.342     401.407    -171.342     
1 1 1 -26 2  6  f 1 4612.6  77.7  ?     ?   1378.78   -179.139     1767.01    -179.139     385.63     -179.139     
1 1 1 -26 2  5  o 0 108.6   3.7   ?     ?   209.803   -77.9164     156.266    -77.9164     53.3892    102.084      
1 1 1 -26 2  4  o 0 4941.8  83.4  ?     ?   1759.79   24.0968      1515.02    24.0968      247.43     -155.903     
1 1 1 -26 2  3  f 1 418.3   8.5   ?     ?   460.195   -3.32938     447.733    -3.32938     16.4346    176.671      
1 1 1 -26 2  2  o 0 1383.9  28.4  ?     ?   963.29    -126.528     757.295    -126.528     211.041    53.4718      
1 1 1 -26 2  1  o 0 844.6   18.2  ?     ?   565.056   -97.572      777.809    -97.572      195.815    -97.572      
1 1 1 26  2  0  o 0 1008.3  19.8  ?     ?   757.327   75.6456      718.3      75.6456      60.2871    -104.354     
1 1 1 26  2  1  o 0 278     7.2   ?     ?   211.079   153.563      460.081    153.563      247.533    153.563      
1 1 1 26  2  2  o 0 692.2   13.4  ?     ?   506.16    141.049      686.888    141.049      176.255    141.049      
1 1 1 26  2  3  f 1 101.1   3.1   ?     ?   111.034   10.8025      134.076    10.8025      21.296     10.8025      
1 1 1 26  2  4  o 0 657.3   13.1  ?     ?   581.161   -138.867     587.063    -138.867     1.02398    41.1332      
1 1 1 26  2  5  o 0 542.2   12.8  ?     ?   564.555   51.3736      491.803    51.3736      80.0363    -128.626     
1 1 1 26  2  6  f 1 1028    19.1  ?     ?   731.168   -113.862     744.666    -113.862     0.109692   66.1383      
1 1 1 26  2  7  o 0 1138.4  25.5  ?     ?   748.885   -56.1617     810.413    -56.1617     51.5311    -56.1617     
1 1 1 26  2  8  o 0 70.7    5.6   ?     ?   142.946   155.444      62.3537    155.444      76.8055    -24.5559     
1 1 1 26  2  9  o 0 0.6     4.9   ?     ?   181.623   160.274      161.723    -19.7258     338.319    -19.7258     
1 1 1 26  2  10 o 0 578.8   14.2  ?     ?   505.768   98.3263      544.981    98.3263      54.1067    98.3263      
1 1 1 26  2  11 f 1 77.3    8     ?     ?   320.785   -89.616      5.38147    -89.616      302.739    90.384       
1 1 1 26  2  12 o 0 738.4   19.5  ?     ?   728.531   -120.501     486.697    -120.501     207.42     59.4987      
1 1 1 26  2  13 f 1 364.4   13.9  ?     ?   889.171   25.9733      15.6891    -154.027     876.677    -154.027     
1 1 1 26  2  14 o 0 64.6    10.6  ?     ?   353.414   31.2439      47.7258    -148.756     386.802    -148.756     
1 1 1 26  2  15 o 0 672.6   20.2  ?     ?   594.465   -2.22612     583.149    -2.22612     27.2423    -2.22612     
1 1 1 26  2  16 o 0 507.6   17.6  ?     ?   505.81    10.1673      507.424    10.1673      32.705     10.1673      
1 1 1 26  2  17 o 0 37.8    13    ?     ?   196.544   36.3645      11.1279    -143.635     194.566    -143.635     
1 1 1 26  2  18 f 1 76.5    15    ?     ?   115.63    160.855      174.311    160.855      52.5704    160.855      
1 1 1 26  2  19 o 0 11.9    14.4  ?     ?   113.121   -70.793      29.7738    109.207      145.442    109.207      
1 1 1 26  2  20 o 0 296.8   21.7  ?     ?   335.069   -79.5695     485.788    -79.5695     151.22     -79.5695     
1 1 1 26  2  21 o 0 200     24.2  ?     ?   183.059   -72.7444     464.377    -72.7444     286.779    -72.7444     
1 1 1 26  2  22 o 0 232.2   26.3  ?     ?   345.992   41.1001      375.338    41.1001      39.3384    41.1001      
1 1 1 26  2  23 o 0 -19.9   25.6  ?     ?   86.3126   106.459      6.97347    -73.5406     97.2255    -73.5406     
1 1 1 26  2  24 f 1 44.6    34.5  ?     ?   282.767   -159.67      16.7812    20.3297      303.669    20.3297      
1 1 1 26  2  25 o 0 96.9    34.6  ?     ?   299.681   -150.708     119.782    -150.708     173.786    29.2918      
1 1 1 26  2  26 o 0 56.7    29.6  ?     ?   228.772   -154.599     80.4283    -154.599     139.214    25.4005      
1 1 1 -26 4  26 o 0 49.1    9.4   ?     ?   153.967   135.671      155.777    135.671      19.3699    135.671      
1 1 1 -26 4  25 f 1 6       10.7  ?     ?   90.7855   119.274      1.98862    119.274      79.6553    -60.7256     
1 1 1 -26 4  24 o 0 114.5   9.5   ?     ?   181.41    115.419      298.391    115.419      128.465    115.419      
1 1 1 -26 4  23 o 0 56.6    10.4  ?     ?   131.557   95.275       180.046    95.275       51.0808    95.275       
1 1 1 -26 4  22 o 0 119.2   7.9   ?     ?   160.648   15.3577      308.67     15.3577      163.108    15.3577      
1 1 1 -26 4  21 o 0 10.5    6.6   ?     ?   32.6531   -56.4844     5.28323    123.516      34.9197    123.516      
1 1 1 -26 4  20 o 0 89.8    6.4   ?     ?   189.668   30.7921      224.597    30.7921      51.3796    30.7921      
1 1 1 -26 4  19 o 0 118.8   7.2   ?     ?   245.169   -134.834     243.045    -134.834     11.2266    -134.834     
1 1 1 -26 4  18 o 0 185.8   6.8   ?     ?   304.429   -150.941     314.663    -150.941     19.2524    -150.941     
1 1 1 -26 4  17 o 0 25.4    5     ?     ?   56.921    -171.662     5.61487    -171.662     51.0883    8.33847      
1 1 1 -26 4  16 o 0 222.7   6.6   ?     ?   270.061   142.911      338.838    142.911      98.6181    142.911      
1 1 1 -26 4  15 o 0 361.9   8.6   ?     ?   375.821   116.839      432.057    116.839      98.1042    116.839      
1 1 1 -26 4  14 o 0 608.4   14.3  ?     ?   266.75    -33.9456     755.461    -33.9456     516.71     -33.9456     
1 1 1 -26 4  13 o 0 760.4   15.6  ?     ?   532.524   172.454      670.711    172.454      180.647    172.454      
1 1 1 -26 4  12 o 0 499.9   10.3  ?     ?   457.762   129.636      508.208    129.636      84.2986    129.636      
1 1 1 -26 4  11 o 0 1030.4  19.3  ?     ?   600.406   122.362      791.927    122.362      240.802    122.362      
1 1 1 -26 4  10 o 0 253.7   5.8   ?     ?   346.561   80.7964      302.533    80.7964      17.2714    -99.2036     
1 1 1 -26 4  9  o 0 636.4   13.2  ?     ?   464.605   -111.164     613.249    -111.164     176.764    -111.164     
1 1 1 -26 4  8  o 0 377.8   8     ?     ?   287.192   129.388      500.604    129.388      229.623    129.388      
1 1 1 -26 4  7  o 0 199.2   7.1   ?     ?   508.58    -170.626     93.5643    -170.626     388.167    9.37391      
1 1 1 -26 4  6  o 0 815.8   16.7  ?     ?   749.98    98.0286      513.369    98.0286      199.447    -81.9714     
1 1 1 -26 4  5  o 0 161.4   4.3   ?     ?   177.856   -109.824     271.774    -109.824     95.3967    -109.824     
1 1 1 -26 4  4  o 0 4128.6  98.9  ?     ?   1328.27   115.558      1647.5     115.558      326.867    115.558      
1 1 1 -26 4  3  o 0 1041.2  28.7  ?     ?   751.671   166.62       725.418    166.62       23.6006    -13.3804     
1 1 1 -26 4  2  o 0 655.5   14    ?     ?   841.05    52.6704      329.823    52.6704      509.848    -127.33      
1 1 1 -26 4  1  o 0 2250.9  42    ?     ?   1098.71   -117.109     1099.55    -117.109     0.893845   -117.109     
1 1 1 26  4  0  o 0 555.3   10.8  ?     ?   562.624   -140.772     499.14     -140.772     61.9769    39.2281      
1 1 1 26  4  1  o 0 205.4   5.3   ?     ?   327.681   -148.516     272.589    -148.516     54.8147    31.4843      
1 1 1 26  4  2  o 0 611.9   11.8  ?     ?   621.005   -73.9579     501.042    -73.9579     120.462    106.042      
1 1 1 26  4  3  o 0 272.7   5.9   ?     ?   499.811   -54.8143     228.646    -54.8143     272.26     125.186      
1 1 1 26  4  4  o 0 761.6   14.3  ?     ?   464.139   76.9538      781.744    76.9538      316.104    76.9538      
1 1 1 26  4  5  o 0 611.8   12.5  ?     ?   461.459   -43.0771     650.161    -43.0771     186.92     -43.0771     
1 1 1 26  4  6  o 0 450.1   13.8  ?     ?   522.708   172.833      400.112    172.833      104.374    -7.16676     
1 1 1 26  4  7  o 0 958     28.8  ?     ?   697.179   -58.3773     676.033    -58.3773     3.41491    -58.3773     
1 1 1 26  4  8  o 0 251.5   9.1   ?     ?   171.074   177.228      399.369    177.228      234.477    177.228      
1 1 1 26  4  9  o 0 235.5   11.1  ?     ?   300.411   -108.194     318.094    -108.194     28.9742    -108.194     
1 1 1 26  4  10 o 0 5133.7  102.9 ?     ?   1594.49   160.591      1650.65    160.591      139.227    160.591      
1 1 1 26  4  11 o 0 2095.9  39.8  ?     ?   1060.19   -143.961     1002.12    -143.961     0.160432   36.0394      
1 1 1 26  4  12 o 0 137.1   9.5   ?     ?   75.5382   -158.549     143.128    -158.549     70.8987    -158.549     
1 1 1 26  4  13 o 0 78.3    11.5  ?     ?   360.829   75.2129      15.0043    -104.787     358.73     -104.787     
1 1 1 26  4  14 o 0 348.9   13.1  ?     ?   394.262   -128.651     421.323    -128.651     55.1514    -128.651     
1 1 1 26  4  15 o 0 438.6   17.2  ?     ?   493.97    111.507      443.304    111.507      17.2651    -68.4934     
1 1 1 26  4  16 o 0 299.7   14.8  ?     ?   344.733   -50.3205     403.291    -50.3205     83.572     -50.3205     
1 1 1 26  4  17 o 0 170.7   17    ?     ?   418.638   -133.632     179.649    -133.632     256.203    46.3676      
1 1 1 26  4  18 o 0 100.8   17.8  ?     ?   245.684   159.235      198.164    159.235      51.5876    -20.7647     
1 1 1 26  4  19 o 0 189.5   19.3  ?     ?   237.293   153.778      398.886    153.778      163.282    153.778      
1 1 1 26  4  20 o 0 158.4   23.4  ?     ?   203.581   174.251      370.564    174.251      174.869    174.251      
1 1 1 26  4  21 o 0 68.4    19.4  ?     ?   180.87    149.572      173.255    149.572      0.052081   149.572      
1 1 1 26  4  22 o 0 12.5    24.3  ?     ?   80.6239   -160.711     43.2116    -160.711     40.6603    19.2893      
1 1 1 26  4  23 o 0 -22.3   20.5  ?     ?   116.859   -102.4       38.1012    77.6001      159.558    77.6001      
1 1 1 26  4  24 o 0 137     31.2  ?     ?   249.638   -133.151     283.833    -133.151     40.4801    -133.151     
1 1 1 26  4  25 f 1 57.1    27.5  ?     ?   112.959   -143.947     177.091    -143.947     68.8468    -143.947     
1 1 1 26  4  26 < 0 12.8    28.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 6  25 o 0 1       10.2  ?     ?   17.0409   -100.937     3.17609    -100.937     11.7336    79.0633      
1 1 1 -26 6  24 o 0 132.3   10    ?     ?   249.714   0.755333     283.021    0.755333     62.3954    0.755333     
1 1 1 -26 6  23 o 0 95.9    8.5   ?     ?   276.67    67.9173      174.319    67.9173      81.5714    -112.083     
1 1 1 -26 6  22 o 0 55.7    9.1   ?     ?   261.687   63.4577      71.0906    63.4577      182.188    -116.542     
1 1 1 -26 6  21 f 1 3       8.4   ?     ?   98.0359   -158.582     42.1883    21.4184      134.6      21.4184      
1 1 1 -26 6  20 o 0 5       7.2   ?     ?   61.3976   122.054      25.201     -57.9458     80.209     -57.9458     
1 1 1 -26 6  19 o 0 23.5    5.8   ?     ?   153.545   3.98767      26.35      3.98767      112.058    -176.012     
1 1 1 -26 6  18 o 0 38.9    5.3   ?     ?   95.788    -61.7804     95.6481    -61.7804     6.26004    -61.7804     
1 1 1 -26 6  17 o 0 18.8    5.1   ?     ?   54.0703   -87.8682     2.44452    -87.8682     49.3331    92.1318      
1 1 1 -26 6  16 f 1 138.9   5.7   ?     ?   260.37    -137.138     246.188    -137.138     11.061     42.8618      
1 1 1 -26 6  15 o 0 38.8    4     ?     ?   42.1799   29.8702      28.9433    29.8702      12.8535    -150.13      
1 1 1 -26 6  14 o 0 451.1   11.6  ?     ?   555.816   -32.9964     382.339    -32.9964     109.178    147.004      
1 1 1 -26 6  13 o 0 14.4    3.5   ?     ?   113.656   -166.468     61.6504    13.5316      161.999    13.5316      
1 1 1 -26 6  12 o 0 459.5   9.4   ?     ?   621.891   150.354      338.339    150.354      214.407    -29.646      
1 1 1 -26 6  11 o 0 790.8   15.1  ?     ?   418.702   37.8773      781.864    37.8773      399.44     37.8773      
1 1 1 -26 6  10 o 0 510.4   11.3  ?     ?   618.114   69.9707      379.788    69.9707      188.001    -110.029     
1 1 1 -26 6  9  o 0 237.9   5.7   ?     ?   388.377   97.5594      252.757    97.5594      110.211    -82.4406     
1 1 1 -26 6  8  o 0 422.2   8.6   ?     ?   543.859   134.479      342.034    134.479      155.244    -45.5213     
1 1 1 -26 6  7  o 0 795     14.9  ?     ?   628.91    31.8397      599.933    31.8397      22.4254    31.8397      
1 1 1 -26 6  6  o 0 1177.5  23.8  ?     ?   895.072   -11.7905     621.565    -11.7905     214.371    168.21       
1 1 1 -26 6  5  o 0 922.4   19.1  ?     ?   657.09    -22.148      667.484    -22.148      51.7484    -22.148      
1 1 1 -26 6  4  o 0 919.5   25    ?     ?   734.968   28.332       597.383    28.332       93.3306    -151.668     
1 1 1 -26 6  3  o 0 106.3   6.4   ?     ?   219.534   40.3953      130.592    40.3953      76.235     -139.605     
1 1 1 -26 6  2  o 0 2486.3  60.9  ?     ?   1212.7    99.5654      1011.73    99.5654      133.142    -80.4346     
1 1 1 -26 6  1  o 0 174.1   5.8   ?     ?   446.484   1.70103      105.598    1.70103      316.615    -178.299     
1 1 1 26  6  0  o 0 205.9   4.8   ?     ?   367.839   -49.4519     219.492    -49.4519     128.199    130.548      
1 1 1 26  6  1  o 0 3114.5  54    ?     ?   1286.41   -7.90078     1206.32    -7.90078     11.5087    172.099      
1 1 1 26  6  2  o 0 199.5   5.2   ?     ?   426.051   -56.7287     163.675    -56.7287     240.166    123.271      
1 1 1 26  6  3  o 0 212.2   6.3   ?     ?   299.491   26.6261      279.82     26.6261      4.32174    -153.374     
1 1 1 26  6  4  o 0 2212.4  38.3  ?     ?   1112.7    159.918      987.577    159.918      68.6764    -20.0824     
1 1 1 26  6  5  o 0 916.7   17.8  ?     ?   744.474   171.934      593.013    171.934      113.777    -8.06607     
1 1 1 26  6  6  o 0 538.6   12.7  ?     ?   592.078   74.3029      425.365    74.3029      129.23     -105.697     
1 1 1 26  6  7  o 0 395.3   12.7  ?     ?   456.13    56.0709      394.694    56.0709      32.1989    -123.929     
1 1 1 26  6  8  o 0 240     7.8   ?     ?   199.457   -163.463     367.219    -163.463     180.801    -163.463     
1 1 1 26  6  9  o 0 173.4   7.8   ?     ?   348.925   -3.00553     187.29     -3.00553     146.988    176.994      
1 1 1 26  6  10 o 0 424     13.8  ?     ?   192.701   -123.032     613.144    -123.032     431.187    -123.032     
1 1 1 26  6  11 o 0 73.7    8.9   ?     ?   191.671   78.1185      61.4332    78.1185      119.013    -101.881     
1 1 1 26  6  12 o 0 282.8   10.7  ?     ?   438.341   72.7258      298.708    72.7258      103.945    -107.274     
1 1 1 26  6  13 o 0 130     12.2  ?     ?   310.482   172.346      151.768    172.346      132.284    -7.65442     
1 1 1 26  6  14 o 0 -15.3   10.4  ?     ?   41.7575   40.6691      33.4547    -139.331     71.8165    -139.331     
1 1 1 26  6  15 o 0 200.6   14.5  ?     ?   365.994   53.8421      282.823    53.8421      94.8967    -126.158     
1 1 1 26  6  16 f 1 27.4    13.7  ?     ?   55.1844   -52.4105     22.7376    -52.4105     33.1963    127.59       
1 1 1 26  6  17 o 0 25.2    15.1  ?     ?   176.812   62.7942      10.0358    -117.206     187.26     -117.206     
1 1 1 26  6  18 o 0 127.3   18.8  ?     ?   283.02    87.1344      233.288    87.1344      43.8452    -92.8656     
1 1 1 26  6  19 o 0 306.5   21    ?     ?   345.435   99.1407      486.746    99.1407      157.967    99.1407      
1 1 1 26  6  20 o 0 -6.4    19.2  ?     ?   52.7899   -107.716     5.33186    72.2845      55.6435    72.2845      
1 1 1 26  6  21 f 1 25.1    19.6  ?     ?   94.141    92.2894      65.0137    92.2894      32.1208    -87.7106     
1 1 1 26  6  22 o 0 47.3    28.5  ?     ?   181.817   71.8131      87.8562    71.8131      98.6419    -108.187     
1 1 1 26  6  23 o 0 -1.2    27.9  ?     ?   48.983    -150.728     36.1911    -150.728     10.9406    29.2715      
1 1 1 26  6  24 o 0 32.4    29.2  ?     ?   27.0111   54.6926      70.9996    54.6926      45.5785    54.6926      
1 1 1 -26 8  24 < 0 7.1     11.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 8  23 o 0 14.3    11    ?     ?   150.063   58.6669      10.6208    58.6669      119.531    -121.333     
1 1 1 -26 8  22 o 0 98.2    10.5  ?     ?   167.011   144.273      267.029    144.273      118.905    144.273      
1 1 1 -26 8  21 o 0 24.1    9     ?     ?   78.3144   168.215      66.0077    168.215      5.71566    -11.7852     
1 1 1 -26 8  20 o 0 81.6    8.6   ?     ?   52.0548   76.7399      234.57     76.7399      185.08     76.7399      
1 1 1 -26 8  19 o 0 40.3    6.6   ?     ?   123.126   -38.0028     114.672    -38.0028     5.73644    -38.0028     
1 1 1 -26 8  18 o 0 16.1    6.2   ?     ?   278.453   -130.874     99.4482    49.126       346.054    49.126       
1 1 1 -26 8  17 f 1 11.2    5.4   ?     ?   28.2063   144.771      4.04314    -35.2287     29.2905    -35.2287     
1 1 1 -26 8  16 o 0 90.7    5.3   ?     ?   363.387   93.912       76.5662    93.912       258.238    -86.088      
1 1 1 -26 8  15 f 1 22.3    4.4   ?     ?   102.196   178.821      11.2555    178.821      85.8019    -1.17903     
1 1 1 -26 8  14 o 0 190.8   6.2   ?     ?   234.414   12.0114      373.895    12.0114      150.65     12.0114      
1 1 1 -26 8  13 o 0 254.2   6.6   ?     ?   314.426   -51.5776     396.628    -51.5776     89.5908    -51.5776     
1 1 1 -26 8  12 o 0 871.1   16.8  ?     ?   726.172   -42.8201     579.877    -42.8201     52.5389    137.18       
1 1 1 -26 8  11 o 0 96.7    4.4   ?     ?   392.153   -126.955     30.4804    -126.955     313.263    53.0454      
1 1 1 -26 8  10 o 0 1136.1  20.7  ?     ?   758.917   -126.366     737.161    -126.366     73.7313    -126.366     
1 1 1 -26 8  9  o 0 1603.2  30.5  ?     ?   983.42    -149.989     818.721    -149.989     45.7263    30.0108      
1 1 1 -26 8  8  o 0 26      2.4   ?     ?   179.864   -135.334     71.0423    44.6664      233.327    44.6664      
1 1 1 -26 8  7  o 0 414.5   9.2   ?     ?   554.596   -56.546      332.235    -56.546      170.445    123.454      
1 1 1 -26 8  6  o 0 225.3   6.1   ?     ?   251.82    -35.1175     324.628    -35.1175     95.447     -35.1175     
1 1 1 -26 8  5  o 0 518.8   10.4  ?     ?   306.428   -57.4147     632.729    -57.4147     352.84     -57.4147     
1 1 1 -26 8  4  o 0 13.3    2.1   ?     ?   164.198   8.88172      106.811    -171.118     259.083    -171.118     
1 1 1 -26 8  3  o 0 284.3   7.7   ?     ?   79.6616   51.692       333.697    51.692       259.622    51.692       
1 1 1 -26 8  2  o 0 529.9   14.5  ?     ?   487.99    -13.5463     490.448    -13.5463     47.611     -13.5463     
1 1 1 -26 8  1  o 0 382.4   16.9  ?     ?   404.843   -26.5766     409.507    -26.5766     41.4579    -26.5766     
1 1 1 26  8  0  o 0 155.4   4.8   ?     ?   447.579   10.9765      73.7746    10.9765      334.555    -169.023     
1 1 1 26  8  1  o 0 792     16.9  ?     ?   657.071   140.159      570.137    140.159      30.0251    -39.8411     
1 1 1 26  8  2  o 0 3571.3  61.8  ?     ?   1112.06   139.034      1520.02    139.034      503.423    139.034      
1 1 1 26  8  3  o 0 318.4   8.1   ?     ?   395.074   -97.5375     355.635    -97.5375     15.4426    82.4625      
1 1 1 26  8  4  o 0 1262.7  24.5  ?     ?   796.889   -110.668     794.982    -110.668     55.4021    -110.668     
1 1 1 26  8  5  o 0 320.3   8     ?     ?   244.138   -70.2192     463.663    -70.2192     237.165    -70.2192     
1 1 1 26  8  6  o 0 504.3   13.3  ?     ?   479.16    51.1609      495.285    51.1609      51.1163    51.1609      
1 1 1 26  8  7  o 0 774.2   18    ?     ?   523.447   177.292      693.183    177.292      208.594    177.292      
1 1 1 26  8  8  o 0 303.7   10.1  ?     ?   342.225   141.377      394.761    141.377      85.0988    141.377      
1 1 1 26  8  9  o 0 470.6   14.4  ?     ?   547.772   45.623       417.162    45.623       77.3491    -134.377     
1 1 1 26  8  10 o 0 531     13.8  ?     ?   730.261   101.981      319.492    101.981      337.912    -78.0191     
1 1 1 26  8  11 o 0 102.6   9.1   ?     ?   335.238   57.9532      87.9853    57.9532      215.438    -122.047     
1 1 1 26  8  12 o 0 42.2    10.5  ?     ?   251.313   -32.2162     17.8242    147.784      244.416    147.784      
1 1 1 26  8  13 o 0 64.6    11.9  ?     ?   204.112   -36.3414     109.113    -36.3414     97.779     143.659      
1 1 1 26  8  14 o 0 438.1   16.4  ?     ?   329.143   165.348      650.627    165.348      324.408    165.348      
1 1 1 26  8  15 f 1 89.2    13.4  ?     ?   114.126   164.417      256.279    164.417      145.078    164.417      
1 1 1 26  8  16 o 0 17.7    17.5  ?     ?   159.592   -95.9525     9.9267     84.0475      163.736    84.0475      
1 1 1 26  8  17 f 1 134.4   17.9  ?     ?   203.833   -41.8433     314.465    -41.8433     123.131    -41.8433     
1 1 1 26  8  18 o 0 -6.7    18.8  ?     ?   56.9579   -69.4884     11.286     110.512      64.3199    110.512      
1 1 1 26  8  19 o 0 28.6    23.6  ?     ?   75.9403   -58.9619     80.8321    -58.9619     3.95766    -58.9619     
1 1 1 26  8  20 o 0 49.8    24.2  ?     ?   108.518   135.812      149.996    135.812      40.1601    135.812      
1 1 1 26  8  21 o 0 156.5   37.1  ?     ?   163.115   135.61       383.846    135.61       225.588    135.61       
1 1 1 26  8  22 o 0 27.1    29.5  ?     ?   94.5042   114.905      99.8843    114.905      12.0237    114.905      
1 1 1 26  8  23 o 0 -25.5   27.4  ?     ?   62.553    -117.638     28.8868    -117.638     28.8843    62.3616      
1 1 1 -26 10 22 < 0 31.2    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 10 21 o 0 4.2     10.4  ?     ?   76.4178   43.6757      9.65336    43.6757      55.4586    -136.324     
1 1 1 -26 10 20 o 0 19.7    9.5   ?     ?   163.812   11.034       13.5418    11.034       129.101    -168.966     
1 1 1 -26 10 19 o 0 80.6    8.8   ?     ?   172.109   27.7138      216.052    27.7138      61.3919    27.7138      
1 1 1 -26 10 18 o 0 30.3    7.9   ?     ?   70.3692   116.225      95.4153    116.225      29.3215    116.225      
1 1 1 -26 10 17 o 0 91.5    8     ?     ?   228.39    -53.4107     194.456    -53.4107     20.4945    126.589      
1 1 1 -26 10 16 o 0 107.1   6.7   ?     ?   292.765   -71.835      175.986    -71.835      80.1502    108.165      
1 1 1 -26 10 15 o 0 23.8    5.4   ?     ?   73.5285   -175.175     43.8237    -175.175     20.497     4.82505      
1 1 1 -26 10 14 f 1 26      5     ?     ?   83.1961   57.0699      52.4206    57.0699      21.0515    -122.93      
1 1 1 -26 10 13 o 0 49.2    5.1   ?     ?   237.767   -9.15514     63.4977    -9.15514     152.386    170.845      
1 1 1 -26 10 12 o 0 146     6.1   ?     ?   211.692   -160.539     314.186    -160.539     120.59     -160.539     
1 1 1 -26 10 11 o 0 97.3    4.6   ?     ?   283.549   126.655      148.733    126.655      116.759    -53.3447     
1 1 1 -26 10 10 o 0 144.9   5.1   ?     ?   194.027   173.628      297.942    173.628      111.887    173.628      
1 1 1 -26 10 9  o 0 2.2     3.1   ?     ?   87.5425   -128.078     73.095     51.9222      157.525    51.9222      
1 1 1 -26 10 8  f 1 58.3    3.3   ?     ?   98.4066   -169.831     107.974    -169.831     12.0737    -169.831     
1 1 1 -26 10 7  o 0 364.6   8.2   ?     ?   325.807   -47.7504     463.7      -47.7504     182.59     -47.7504     
1 1 1 -26 10 6  o 0 83.8    3.7   ?     ?   132.87    -163.209     133.657    -163.209     18.5206    -163.209     
1 1 1 -26 10 5  f 1 41.8    3.8   ?     ?   230.489   164.224      6.5273     -15.7757     208.052    -15.7757     
1 1 1 -26 10 4  o 0 361.3   8.7   ?     ?   380.162   141.429      416.846    141.429      87.9234    141.429      
1 1 1 -26 10 3  o 0 393.3   9.5   ?     ?   453.694   162.222      397.26     162.222      3.57739    162.222      
1 1 1 -26 10 2  o 0 269.1   8.7   ?     ?   286.422   -179.758     372.991    -179.758     123.848    -179.758     
1 1 1 -26 10 1  o 0 619.9   17.9  ?     ?   561.051   -144.858     527.018    -144.858     38.0196    -144.858     
1 1 1 26  10 0  f 1 426.9   12.4  ?     ?   609.699   -63.4253     308.805    -63.4253     229.712    116.575      
1 1 1 26  10 1  o 0 670.3   14.8  ?     ?   524.734   -50.4542     603.871    -50.4542     142.385    -50.4542     
1 1 1 26  10 2  o 0 -0.6    4.3   ?     ?   145.499   -118.494     118.557    61.5064      246.577    61.5064      
1 1 1 26  10 3  o 0 46.4    4.7   ?     ?   166.067   -83.1551     10.4778    -83.1551     135.647    96.8449      
1 1 1 26  10 4  o 0 164.2   7     ?     ?   229.15    136.314      272.269    136.314      68.9455    136.314      
1 1 1 26  10 5  f 1 265.8   12.2  ?     ?   290.009   174.17       381.743    174.17       123.303    174.17       
1 1 1 26  10 6  o 0 176.6   7.4   ?     ?   496.574   127.068      94.0811    127.068      345.622    -52.9322     
1 1 1 26  10 7  o 0 220.2   9     ?     ?   442.786   -118.032     203.332    -118.032     188.07     61.9678      
1 1 1 26  10 8  f 1 8.8     7.3   ?     ?   69.1029   -80.4868     41.1144    99.5132      110.287    99.5132      
1 1 1 26  10 9  o 0 14.6    7     ?     ?   111.541   -12.5653     46.5886    167.435      157.374    167.435      
1 1 1 26  10 10 o 0 177.7   10.9  ?     ?   287.748   -90.3842     314.698    -90.3842     34.7785    -90.3842     
1 1 1 26  10 11 o 0 369.1   12.9  ?     ?   413.787   -63.1699     479.999    -63.1699     78.939     -63.1699     
1 1 1 26  10 12 o 0 119.6   11.9  ?     ?   126.754   -0.666694    320.752    -0.666694    200.449    -0.666694    
1 1 1 26  10 13 o 0 5.4     9.6   ?     ?   208.961   134.036      100.143    -45.9638     292.637    -45.9638     
1 1 1 26  10 14 f 1 4.3     15    ?     ?   70.6964   99.8384      11.1116    -80.1616     76.2379    -80.1616     
1 1 1 26  10 15 o 0 355.7   19.2  ?     ?   430.081   -9.93352     458.286    -9.93352     64.8386    -9.93352     
1 1 1 26  10 16 o 0 176.4   19.5  ?     ?   234.681   -136.09      360.982    -136.09      145.719    -136.09      
1 1 1 26  10 17 o 0 165.5   19.4  ?     ?   265.337   -28.626      323.288    -28.626      60.8078    -28.626      
1 1 1 26  10 18 o 0 42.4    22.5  ?     ?   93.6688   -53.476      127.321    -53.476      34.6145    -53.476      
1 1 1 26  10 19 o 0 117.1   27.6  ?     ?   215.373   -155.784     250.111    -155.784     45.6538    -155.784     
1 1 1 26  10 20 o 0 49.3    31.7  ?     ?   229.686   164.854      55.4002    164.854      153.664    -15.1464     
1 1 1 26  10 21 o 0 18.1    32.3  ?     ?   97.1051   -163.377     89.3782    -163.377     1.52455    -163.377     
1 1 1 -26 12 19 < 0 39.3    9.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 12 18 o 0 15.5    9.1   ?     ?   42.3183   -81.1057     32.2169    -81.1057     3.16075    98.8943      
1 1 1 -26 12 17 o 0 18.5    8.6   ?     ?   117.074   -56.6227     34.2446    -56.6227     65.8891    123.377      
1 1 1 -26 12 16 o 0 -0.6    8.2   ?     ?   91.6829   -142.002     37.5504    37.9982      118.383    37.9982      
1 1 1 -26 12 15 o 0 248.8   9.6   ?     ?   329.193   -132.655     378.525    -132.655     75.5252    -132.655     
1 1 1 -26 12 14 o 0 54      6.7   ?     ?   182.735   -120.635     126.683    -120.635     41.6562    59.365       
1 1 1 -26 12 13 o 0 131.3   7.1   ?     ?   258.53    59.072       252.544    59.072       12.5014    59.072       
1 1 1 -26 12 12 o 0 4.4     6.3   ?     ?   51.9264   -162.55      20.9261    17.4498      65.6696    17.4498      
1 1 1 -26 12 11 o 0 13.9    5.2   ?     ?   40.6595   -56.7416     2.19009    -56.7416     32.7815    123.258      
1 1 1 -26 12 10 o 0 121.8   5.6   ?     ?   355.897   35.7536      155.846    35.7536      151.082    -144.246     
1 1 1 -26 12 9  o 0 85.6    4.9   ?     ?   293.643   -30.0725     127.782    -30.0725     126.97     149.928      
1 1 1 -26 12 8  f 1 120.5   5.5   ?     ?   293.377   55.5768      194.893    55.5768      68.9074    -124.423     
1 1 1 -26 12 7  o 0 415.8   9.9   ?     ?   430.125   121.783      501.799    121.783      115.089    121.783      
1 1 1 -26 12 6  o 0 53.8    4.1   ?     ?   246.325   -179.116     71.4896    -179.116     150.974    0.884278     
1 1 1 -26 12 5  o 0 414.4   10.3  ?     ?   399.554   -123.715     520.803    -123.715     152.339    -123.715     
1 1 1 -26 12 4  f 1 286.8   8.4   ?     ?   213.781   -96.586      518.298    -96.586      319.43     -96.586      
1 1 1 -26 12 3  o 0 31.2    3.9   ?     ?   140.086   20.3065      40.2546    20.3065      89.7952    -159.694     
1 1 1 -26 12 2  o 0 5.5     4     ?     ?   72.5524   -101.027     46.1529    78.9734      113.685    78.9734      
1 1 1 -26 12 1  o 0 82.3    5     ?     ?   287.751   -33.1792     108.587    -33.1792     159.838    146.821      
1 1 1 26  12 0  o 0 124.5   6.2   ?     ?   190.592   -69.7812     279.091    -69.7812     98.965     -69.7812     
1 1 1 26  12 1  o 0 147.8   7     ?     ?   183.199   40.3048      330.18     40.3048      156.953    40.3048      
1 1 1 26  12 2  o 0 96.7    6.8   ?     ?   301.697   -85.039      133.534    -85.039      151.771    94.961       
1 1 1 26  12 3  o 0 86.9    6.3   ?     ?   275.88    -94.8713     131.033    -94.8713     129.776    85.1287      
1 1 1 26  12 4  f 1 69.6    6     ?     ?   279.036   -158.102     81.9223    -158.102     183.031    21.8978      
1 1 1 26  12 5  o 0 64.9    7.2   ?     ?   203.443   -170.78      138.105    -170.78      50.6496    9.21975      
1 1 1 26  12 6  o 0 254.4   10.6  ?     ?   413.994   -156.479     327.156    -156.479     56.3227    23.5208      
1 1 1 26  12 7  o 0 244.7   10.2  ?     ?   355.432   136.759      363.29     136.759      34.7425    136.759      
1 1 1 26  12 8  f 1 275.4   10.9  ?     ?   285.657   -67.1579     472.508    -67.1579     214.367    -67.1579     
1 1 1 26  12 9  o 0 109.7   11.1  ?     ?   258.683   -114.781     213.806    -114.781     18.0626    65.2187      
1 1 1 26  12 10 o 0 142.6   11.9  ?     ?   230.328   66.9599      301.382    66.9599      94.8747    66.9599      
1 1 1 26  12 11 o 0 45.4    11.4  ?     ?   65.0965   -129.615     114.964    -129.615     56.8312    -129.615     
1 1 1 26  12 12 o 0 74.5    12.6  ?     ?   210.006   -95.4852     164.926    -95.4852     23.4201    84.5148      
1 1 1 26  12 13 o 0 8.9     14.9  ?     ?   56.6065   -116.013     9.10293    -116.013     45.7371    63.9869      
1 1 1 26  12 14 o 0 314.5   22.4  ?     ?   370.729   67.321       446.061    67.321       86.1512    67.321       
1 1 1 26  12 15 o 0 13.4    20.4  ?     ?   85.2323   63.258       38.2985    63.258       41.1932    -116.742     
1 1 1 26  12 16 o 0 25.3    23.4  ?     ?   94.1727   82.2411      76.7713    82.2411      8.68545    -97.7589     
1 1 1 26  12 17 o 0 -23.5   27.7  ?     ?   60.6227   -42.0626     19.6456    -42.0626     34.2824    137.937      
1 1 1 26  12 18 o 0 65.8    28.3  ?     ?   119.46    -40.6888     183.99     -40.6888     78.2506    -40.6888     
1 1 1 -26 14 16 < 0 38.4    10.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 14 15 < 0 15.2    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 14 14 o 0 21.5    9.1   ?     ?   63.1597   -106.85      78.0961    -106.85      26.1985    -106.85      
1 1 1 -26 14 13 f 1 19.5    9     ?     ?   195.746   -103.531     4.85283    76.4686      167.463    76.4686      
1 1 1 -26 14 12 o 0 65.4    7.6   ?     ?   191.103   -116.334     160.224    -116.334     1.01963    63.6662      
1 1 1 -26 14 11 o 0 45.4    8.9   ?     ?   48.8221   125.675      132.13     125.675      89.7593    125.675      
1 1 1 -26 14 10 o 0 49.9    7     ?     ?   86.8212   124.659      164.422    124.659      85.9301    124.659      
1 1 1 -26 14 9  o 0 27.8    5.7   ?     ?   48.3674   -133.319     71.814     -133.319     27.8175    -133.319     
1 1 1 -26 14 8  o 0 3.5     5.2   ?     ?   64.4523   -32.9205     31.3688    147.08       89.8903    147.08       
1 1 1 -26 14 7  o 0 38.6    5.8   ?     ?   136.217   57.1999      105.239    57.1999      19.0868    -122.8       
1 1 1 -26 14 6  o 0 34.6    5.8   ?     ?   31.4135   58.4654      55.3821    58.4654      27.5611    58.4654      
1 1 1 -26 14 5  o 0 53.7    6.1   ?     ?   212.754   -163.604     101.324    -163.604     79.1636    16.3963      
1 1 1 -26 14 4  o 0 149.5   7.8   ?     ?   360.595   155.696      197.494    155.696      109.567    -24.3038     
1 1 1 -26 14 3  o 0 35.5    5.9   ?     ?   26.0168   -120.142     47.1207    -120.142     24.8931    -120.142     
1 1 1 -26 14 2  o 0 33.5    6     ?     ?   21.7287   163.848      36.876     163.848      18.2593    163.848      
1 1 1 -26 14 1  o 0 17.2    6.3   ?     ?   127.505   119.542      2.44939    119.542      106.104    -60.4576     
1 1 1 26  14 0  o 0 15.8    6.6   ?     ?   101.67    39.0437      2.6909     39.0437      85.4277    -140.956     
1 1 1 26  14 1  o 0 10.1    6.2   ?     ?   76.915    12.493       16.9389    -167.507     83.6156    -167.507     
1 1 1 26  14 2  o 0 178.2   10.9  ?     ?   315.156   -156.892     288.505    -156.892     12.9651    -156.892     
1 1 1 26  14 3  o 0 36      8.6   ?     ?   151.942   -73.4501     83.468     -73.4501     49.29      106.55       
1 1 1 26  14 4  o 0 167.8   10.4  ?     ?   258.021   136.986      316.152    136.986      90.9504    136.986      
1 1 1 26  14 5  o 0 36.6    9.2   ?     ?   200.45    56.0799      54.1164    56.0799      120.572    -123.92      
1 1 1 26  14 6  o 0 60.5    11.2  ?     ?   59.9777   -101.936     183.326    -101.936     126.697    -101.936     
1 1 1 26  14 7  o 0 47.7    11.5  ?     ?   250.057   -24.3738     51.2706    -24.3738     184.256    155.626      
1 1 1 26  14 8  o 0 112.8   13.2  ?     ?   191.894   -39.7633     268.798    -39.7633     88.5727    -39.7633     
1 1 1 26  14 9  o 0 46.3    14    ?     ?   160.608   141.423      116.732    141.423      34.7355    -38.5773     
1 1 1 26  14 10 o 0 8.2     13.3  ?     ?   90.7094   -60.7131     3.67462    -60.7131     78.6783    119.287      
1 1 1 26  14 11 o 0 -32.8   17.5  ?     ?   67.9556   113.607      27.5771    -66.3929     89.0098    -66.3929     
1 1 1 26  14 12 o 0 237.4   17.5  ?     ?   337.204   94.6757      372.347    94.6757      75.2759    94.6757      
1 1 1 26  14 13 f 1 58.8    19.4  ?     ?   108.044   92.158       184.263    92.158       90.326     92.158       
1 1 1 26  14 14 o 0 32.4    20.4  ?     ?   107.011   175.325      101.931    175.325      9.68346    175.325      
1 1 1 26  14 15 < 0 13.9    12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 16 10 < 1 43.9    8.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 16 9  < 0 9.1     9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -26 16 8  o 0 20      7.1   ?     ?   101.257   117.085      63.9663    117.085      17.4589    -62.9155     
1 1 1 -26 16 7  o 0 3.9     7.1   ?     ?   14.6757   -136.951     1.18267    -136.951     10.6823    43.0494      
1 1 1 -26 16 6  o 0 119     9.2   ?     ?   165.614   -69.0181     295.963    -69.0181     161.712    -69.0181     
1 1 1 -26 16 5  o 0 84      8.9   ?     ?   97.7475   -78.7187     262.134    -78.7187     182.546    -78.7187     
1 1 1 -26 16 4  o 0 -0.4    8.3   ?     ?   73.3707   -54.8926     18.6853    125.107      78.6628    125.107      
1 1 1 -26 16 3  o 0 11.7    8.8   ?     ?   127.326   84.5255      3.97354    -95.4745     109.801    -95.4745     
1 1 1 -26 16 2  f 1 62      9.8   ?     ?   137.08    146.453      182.434    146.454      67.5655    146.454      
1 1 1 -26 16 1  o 0 106.1   10.4  ?     ?   249.341   -123.497     208.306    -123.497     0.102036   56.503       
1 1 1 26  16 0  o 0 173.5   11.8  ?     ?   270.416   -42.1639     321.182    -42.1639     90.0055    -42.1639     
1 1 1 26  16 1  o 0 229.2   11.8  ?     ?   323.992   15.2102      363.925    15.2102      86.9675    15.2102      
1 1 1 26  16 2  f 1 0.6     11    ?     ?   109.286   112.825      26.0244    -67.1753     119.878    -67.1753     
1 1 1 26  16 3  o 0 54.7    12.7  ?     ?   208.429   150.83       118.631    150.83       56.9638    -29.1698     
1 1 1 26  16 4  o 0 18.8    13.3  ?     ?   124.862   -154.563     38.5477    -154.563     66.4999    25.4371      
1 1 1 26  16 5  o 0 43.3    14.7  ?     ?   157.422   -57.0343     109.869    -57.0343     22.3313    122.966      
1 1 1 26  16 6  o 0 31.8    14.8  ?     ?   204.25    138.08       35.4233    138.08       135.715    -41.9205     
1 1 1 26  16 7  o 0 78.7    14.5  ?     ?   229.917   118.412      165.768    118.412      26.7842    -61.5884     
1 1 1 26  16 8  o 0 -1.8    16.9  ?     ?   158.939   101.564      22.5007    -78.4356     155.188    -78.4356     
1 1 1 26  16 9  < 0 65.6    19.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 26  16 10 < 1 92.2    21.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 1  27 < 0 190.5   21.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 1  26 o 0 13.9    11.1  ?     ?   151.149   -118.289     2.80488    -118.289     133.184    61.7112      
1 1 1 -27 1  25 o 0 46.4    9.4   ?     ?   116.851   67.7026      163.842    67.7026      56.0811    67.7026      
1 1 1 -27 1  24 o 0 83.1    9.5   ?     ?   155.549   13.8583      241.321    13.8583      88.0095    13.8583      
1 1 1 -27 1  23 o 0 -1.2    8.7   ?     ?   51.5756   -113.527     24.9058    66.4733      75.9065    66.4733      
1 1 1 -27 1  22 o 0 162.9   8.5   ?     ?   281.414   -142.111     305.447    -142.111     48.6855    -142.111     
1 1 1 -27 1  21 o 0 133.3   7.6   ?     ?   224.685   -122.32      296.969    -122.32      90.7084    -122.32      
1 1 1 -27 1  20 o 0 -3.8    5     ?     ?   60.8245   32.7199      48.2697    -147.28      106.075    -147.28      
1 1 1 -27 1  19 o 0 61.4    5.6   ?     ?   69.9666   170.219      134.585    170.219      66.3511    170.219      
1 1 1 -27 1  18 o 0 350.7   9     ?     ?   430.813   -34.3819     434.772    -34.3819     3.50651    -34.3819     
1 1 1 -27 1  17 o 0 66.5    4.3   ?     ?   205.403   34.3924      80.6862    34.3924      102.893    -145.608     
1 1 1 -27 1  16 o 0 40.4    3.9   ?     ?   156.694   60.0717      4.59073    -119.928     144.475    -119.928     
1 1 1 -27 1  15 o 0 796.6   16.7  ?     ?   643.466   120.36       619.115    120.36       40.5969    120.36       
1 1 1 -27 1  14 o 0 64.8    4.2   ?     ?   376.82    -101.851     61.3923    78.1495      409.672    78.1495      
1 1 1 -27 1  13 f 1 695.8   14.5  ?     ?   512.282   117.621      633.923    117.621      149.307    117.621      
1 1 1 -27 1  12 o 0 668.8   14.4  ?     ?   435.139   2.89029      663.947    2.89029      262.942    2.89029      
1 1 1 -27 1  11 o 0 2047.4  44.9  ?     ?   1079.32   -166.049     941.333    -166.049     58.3829    13.9513      
1 1 1 -27 1  10 o 0 552.9   13.4  ?     ?   418.866   -75.0058     578.676    -75.0058     183.783    -75.0058     
1 1 1 -27 1  9  o 0 583.4   11.7  ?     ?   691.58    171.308      371.352    171.308      283.315    -8.69195     
1 1 1 -27 1  8  o 0 784.1   15.3  ?     ?   611.971   176.946      645.653    176.946      33.5329    176.946      
1 1 1 -27 1  7  o 0 2493.8  43    ?     ?   1203.63   108.797      1103.65    108.797      89.6905    -71.2028     
1 1 1 -27 1  6  o 0 1174.3  24    ?     ?   739.261   -157.308     828.867    -157.308     93.8869    -157.308     
1 1 1 -27 1  5  o 0 192.4   5     ?     ?   368.024   -27.6865     218.232    -27.6865     148.552    152.314      
1 1 1 -27 1  4  o 0 654.5   12    ?     ?   650.355   -25.0718     511.863    -25.0718     137.703    154.928      
1 1 1 -27 1  3  o 0 1065.1  21.9  ?     ?   758.854   139.192      738.995    139.192      20.4192    -40.8075     
1 1 1 -27 1  2  o 0 2192.4  37.6  ?     ?   978.434   -168.051     1191.35    -168.051     210.42     -168.051     
1 1 1 -27 1  1  o 0 1141.2  29.2  ?     ?   859.819   -94.2658     697.006    -94.2658     166.497    85.7342      
1 1 1 27  1  0  o 0 367.7   12.5  ?     ?   390.499   -121.559     451        -121.559     58.8389    -121.559     
1 1 1 27  1  1  o 0 2308.4  40.9  ?     ?   1143.23   -44.7915     1090.37    -44.7915     59.8751    135.208      
1 1 1 27  1  2  o 0 251.6   5.7   ?     ?   429.04    26.9668      262.77     26.9668      169.675    -153.033     
1 1 1 27  1  3  o 0 403.2   9     ?     ?   374.891   -93.4454     509.628    -93.4454     131.154    -93.4454     
1 1 1 27  1  4  o 0 2107.7  37.6  ?     ?   935.548   -84.0441     1200.59    -84.0441     254.846    -84.0441     
1 1 1 27  1  5  o 0 769.3   15.1  ?     ?   526.136   107.927      738.011    107.927      205.631    107.927      
1 1 1 27  1  6  o 0 1282.7  27.1  ?     ?   873.681   -78.4002     785.697    -78.4002     98.796     101.6        
1 1 1 27  1  7  o 0 979.8   19.7  ?     ?   1011.83   -172.49      435.795    -172.49      588.543    7.50987      
1 1 1 27  1  8  o 0 3190.1  56.8  ?     ?   1395.95   138.369      1164.33    138.369      193.407    -41.6312     
1 1 1 27  1  9  o 0 409.8   10.2  ?     ?   558.779   27.4044      326.863    27.4044      216.001    -152.596     
1 1 1 27  1  10 o 0 956.3   19.4  ?     ?   647.908   25.3341      724.065    25.3341      95.6876    25.3341      
1 1 1 27  1  11 o 0 724.1   17.3  ?     ?   631.998   21.666       563.54     21.666       40.042     -158.334     
1 1 1 27  1  12 o 0 2191.2  42.6  ?     ?   930.563   -56.9537     1175.79    -56.9537     289.591    -56.9537     
1 1 1 27  1  13 f 1 611.1   18    ?     ?   597.239   -17.3977     511.089    -17.3977     67.0366    162.602      
1 1 1 27  1  14 o 0 2.1     11.1  ?     ?   293.191   31.871       230.824    -148.129     512.074    -148.129     
1 1 1 27  1  15 o 0 54.1    12.3  ?     ?   195.915   -23.6225     25.4823    -23.6225     157.724    156.377      
1 1 1 27  1  16 o 0 37.4    13.9  ?     ?   427.054   -59.7407     172.988    120.259      573.857    120.259      
1 1 1 27  1  17 o 0 47.7    14.2  ?     ?   199.389   -64.2084     26.3064    -64.2084     159.849    115.792      
1 1 1 27  1  18 o 0 115.3   16.5  ?     ?   315.604   -10.1486     160.009    -10.1486     170.742    169.851      
1 1 1 27  1  19 o 0 212.3   18.3  ?     ?   387.894   -106.161     297.972    -106.161     98.928     73.8394      
1 1 1 27  1  20 o 0 79      20.2  ?     ?   125.825   -94.2368     227.922    -94.2368     102.176    -94.2368     
1 1 1 27  1  21 o 0 21.7    25.8  ?     ?   227.075   -19.3807     18.3179    160.619      238.85     160.619      
1 1 1 27  1  22 o 0 139.6   26    ?     ?   252.711   0.779667     288.967    0.779667     43.2504    0.779667     
1 1 1 27  1  23 o 0 122.2   33.1  ?     ?   205.267   -46.7494     285.346    -46.7495     70.4041    -46.7495     
1 1 1 27  1  24 o 0 -80.3   32.6  ?     ?   128.714   -114.839     44.1776    65.1612      174.311    65.1612      
1 1 1 27  1  25 o 0 13.9    27.5  ?     ?   107.039   -107.235     58.8811    -107.235     46.1652    72.7654      
1 1 1 27  1  26 o 0 11.7    27    ?     ?   33.6579   103.955      61.8096    103.955      29.4298    103.955      
1 1 1 -27 3  26 o 0 65.5    11.1  ?     ?   87.8008   143.466      247.073    143.466      168.902    143.466      
1 1 1 -27 3  25 o 0 36.5    10.7  ?     ?   98.6166   176.719      129.644    176.719      39.8177    176.719      
1 1 1 -27 3  24 o 0 3.4     8.9   ?     ?   74.6154   147.268      18.806     -32.7317     89.0225    -32.7317     
1 1 1 -27 3  23 f 1 18.6    8.8   ?     ?   192.754   66.041       26.9819    -113.959     216.344    -113.959     
1 1 1 -27 3  22 o 0 52.2    7.1   ?     ?   224.167   64.3401      94.8433    64.3401      109.155    -115.66      
1 1 1 -27 3  21 o 0 56.5    7.1   ?     ?   78.6568   -19.9313     165.249    -19.9313     93.5602    -19.9313     
1 1 1 -27 3  20 o 0 65.3    6.3   ?     ?   260.136   78.6242      107.272    78.6242      131.258    -101.376     
1 1 1 -27 3  19 o 0 40.6    6.5   ?     ?   33.4456   -57.213      55.2234    -57.213      23.477     -57.213      
1 1 1 -27 3  18 o 0 81.5    5.8   ?     ?   242.025   -74.3855     148.363    -74.3855     87.3589    105.614      
1 1 1 -27 3  17 o 0 118     6.6   ?     ?   229.163   -19.9023     230.386    -19.9023     1.29859    -19.9023     
1 1 1 -27 3  16 o 0 309.7   9     ?     ?   426.378   75.7332      337.053    75.7332      43.4723    -104.267     
1 1 1 -27 3  15 o 0 213.8   6.3   ?     ?   315.852   175.097      285.646    175.097      4.10311    175.097      
1 1 1 -27 3  14 o 0 175.9   6     ?     ?   122.331   -77.5492     249.313    -77.5492     137.165    -77.5492     
1 1 1 -27 3  13 o 0 1584.6  32.4  ?     ?   875.828   119.612      906.434    119.612      98.2449    119.612      
1 1 1 -27 3  12 o 0 418.3   8.7   ?     ?   494.655   41.5137      389.263    41.5137      75.5208    -138.486     
1 1 1 -27 3  11 o 0 489.6   9.7   ?     ?   499.507   131.098      449.371    131.098      10.1866    -48.9024     
1 1 1 -27 3  10 o 0 256.2   8.5   ?     ?   642.415   117.497      64.3039    117.497      529.738    -62.5031     
1 1 1 -27 3  9  o 0 561.9   10.9  ?     ?   650.51    82.8391      386.392    82.8391      225.876    -97.1609     
1 1 1 -27 3  8  o 0 3245.2  55.5  ?     ?   962.294   138.318      1555.72    138.318      646.263    138.318      
1 1 1 -27 3  7  o 0 1507.7  30.7  ?     ?   868.282   -176.234     853.799    -176.234     30.182     -176.234     
1 1 1 -27 3  6  o 0 98.4    2.8   ?     ?   332.457   -111.144     59.287     -111.144     269.83     68.8556      
1 1 1 -27 3  5  o 0 3908.9  75.9  ?     ?   1538.01   48.5108      1359.97    48.5108      166.9      -131.489     
1 1 1 -27 3  4  f 1 2478.4  42.7  ?     ?   912.386   126.973      1380.2     126.973      467.502    126.973      
1 1 1 -27 3  3  f 1 491.2   9.4   ?     ?   474.745   5.9526       511.841    5.9526       35.9041    5.9526       
1 1 1 -27 3  2  o 0 193.2   5.7   ?     ?   163.808   -125.538     331.717    -125.538     168.028    -125.538     
1 1 1 -27 3  1  o 0 635.1   12.2  ?     ?   679.718   -105.692     467.154    -105.692     213.194    74.3081      
1 1 1 27  3  0  o 0 2483.9  43.9  ?     ?   1095.95   107.105      1212.74    107.105      118.122    107.105      
1 1 1 27  3  1  o 0 692.7   13.6  ?     ?   536.872   167.021      653.615    167.021      116.377    167.021      
1 1 1 27  3  2  o 0 938.1   20.1  ?     ?   663.919   -71.4579     737.262    -71.4579     71.7282    -71.4579     
1 1 1 27  3  3  f 1 484.2   11    ?     ?   565.199   74.5237      424.013    74.5237      146.34     -105.476     
1 1 1 27  3  4  f 1 994.6   20.3  ?     ?   776.591   172.17       669.74     172.17       114.875    -7.82969     
1 1 1 27  3  5  o 0 211.3   7.3   ?     ?   425.263   -87.956      202.951    -87.956      224.852    92.044       
1 1 1 27  3  6  o 0 214.9   7.1   ?     ?   418.242   134.854      207.998    134.854      217.965    -45.1461     
1 1 1 27  3  7  o 0 144.4   5.7   ?     ?   256.435   -77.8719     195.94     -77.8719     52.0773    102.128      
1 1 1 27  3  8  o 0 878.1   20.6  ?     ?   760.981   -165.015     559.516    -165.015     175.942    14.9849      
1 1 1 27  3  9  o 0 1652.4  35.7  ?     ?   952.691   111.254      870.442    111.254      49.0912    -68.7456     
1 1 1 27  3  10 o 0 768.7   16.4  ?     ?   664.544   116.076      568.282    116.076      63.5852    -63.9236     
1 1 1 27  3  11 o 0 359     11.6  ?     ?   405.329   -61.7985     400.027    -61.7985     15.5773    -61.7985     
1 1 1 27  3  12 o 0 65.1    8.9   ?     ?   63.9104   22.443       30.6849    22.443       30.6385    -157.557     
1 1 1 27  3  13 o 0 57.2    10.9  ?     ?   247.425   64.4507      5.00521    -115.549     241.567    -115.549     
1 1 1 27  3  14 o 0 296.2   17.6  ?     ?   330.573   -17.1494     404.931    -17.1494     96.7253    -17.1494     
1 1 1 27  3  15 o 0 384.3   16.6  ?     ?   437.486   -61.0711     427.226    -61.0711     21.2242    -61.0711     
1 1 1 27  3  16 o 0 132.1   14.5  ?     ?   181.748   -133.92      245.888    -133.92      76.6127    -133.92      
1 1 1 27  3  17 o 0 546.8   20.6  ?     ?   496.737   -143.327     620.859    -143.327     101.405    -143.327     
1 1 1 27  3  18 o 0 16.9    16.1  ?     ?   73.0824   -75.7394     1.25134    104.261      75.8868    104.261      
1 1 1 27  3  19 o 0 53.5    18.3  ?     ?   195.895   159.871      103.769    159.871      91.6672    -20.1288     
1 1 1 27  3  20 o 0 -5.7    18.4  ?     ?   84.9204   150.034      21.6941    -29.9655     103.734    -29.9655     
1 1 1 27  3  21 o 0 84.3    25.5  ?     ?   350.237   65.3508      71.2965    65.3508      265.836    -114.649     
1 1 1 27  3  22 o 0 156.8   22.3  ?     ?   228.444   -13.6014     361.374    -13.6014     130.62     -13.6014     
1 1 1 27  3  23 f 1 133.1   29.2  ?     ?   296.443   -143.362     227.19     -143.362     84.2307    36.6384      
1 1 1 27  3  24 o 0 18.3    27.3  ?     ?   196.818   -149.717     5.247      30.2829      202.33     30.2829      
1 1 1 27  3  25 o 0 38.5    30.9  ?     ?   201.903   -116.618     55.5232    -116.618     138.116    63.3822      
1 1 1 -27 5  26 < 0 12.4    11    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 5  25 o 0 14      9.8   ?     ?   120.129   -31.8972     26.4648    -31.8972     79.575     148.103      
1 1 1 -27 5  24 o 0 51.3    10.5  ?     ?   173.747   4.31885      138.869    4.31885      18.029     -175.681     
1 1 1 -27 5  23 o 0 143.4   9.5   ?     ?   278.397   34.6311      274.975    34.6311      15.2649    34.6311      
1 1 1 -27 5  22 o 0 38.6    7     ?     ?   228.061   87.3143      42.1618    87.3143      178.787    -92.6857     
1 1 1 -27 5  21 o 0 51.8    7.2   ?     ?   63.4335   109.695      148.633    109.695      91.4168    109.695      
1 1 1 -27 5  20 o 0 11.3    6.5   ?     ?   88.5268   -165.339     16.0578    14.6611      96.0225    14.6611      
1 1 1 -27 5  19 o 0 260.9   8.5   ?     ?   366.581   -106.538     391.088    -106.538     57.9829    -106.538     
1 1 1 -27 5  18 f 1 582.9   12.7  ?     ?   563.275   -132.414     576.126    -132.414     43.6045    -132.414     
1 1 1 -27 5  17 o 0 248.3   7.6   ?     ?   347.881   -162.141     375.208    -162.141     39.4944    -162.141     
1 1 1 -27 5  16 f 1 31.2    4.1   ?     ?   242.92    -49.9813     37.866     130.019      279.698    130.019      
1 1 1 -27 5  15 f 1 130.8   5.2   ?     ?   133.219   -39.2175     235.613    -39.2175     117.223    -39.2175     
1 1 1 -27 5  14 o 0 324.1   9.1   ?     ?   366.643   -118.818     392.29     -118.818     68.539     -118.818     
1 1 1 -27 5  13 o 0 1157.4  21.5  ?     ?   682.72    173.372      828.44     173.372      221.373    173.372      
1 1 1 -27 5  12 o 0 149     4.6   ?     ?   306.125   145.425      171.514    145.425      108.291    -34.5752     
1 1 1 -27 5  11 o 0 119.3   4.6   ?     ?   171.078   77.8384      165.014    77.8384      7.70204    77.8384      
1 1 1 -27 5  10 o 0 484.2   11.5  ?     ?   605.176   -37.5817     360.765    -37.5817     205.578    142.418      
1 1 1 -27 5  9  o 0 389.9   8.3   ?     ?   547.136   -51.1175     305.433    -51.1175     195.669    128.882      
1 1 1 -27 5  8  f 1 954.8   17.5  ?     ?   544       -85.1559     787.862    -85.1559     284.768    -85.1559     
1 1 1 -27 5  7  o 0 41.1    2.5   ?     ?   281.543   -23.6025     74.7108    156.397      338.253    156.397      
1 1 1 -27 5  6  o 0 761.7   15.1  ?     ?   670.737   -165.301     536.759    -165.301     93.4007    14.6988      
1 1 1 -27 5  5  o 0 872.3   23.3  ?     ?   784.953   160.526      519.566    160.526      220.285    -19.4742     
1 1 1 -27 5  4  o 0 2231.4  55.7  ?     ?   943.824   166.407      1147.73    166.407      255.629    166.407      
1 1 1 -27 5  3  o 0 493.9   15.5  ?     ?   500.108   77.185       456.479    77.185       17.3641    -102.815     
1 1 1 -27 5  2  o 0 687.3   22.6  ?     ?   417.495   -10.5609     702.378    -10.5609     306.001    -10.5609     
1 1 1 -27 5  1  o 0 51.7    2.3   ?     ?   329.293   -29.7626     75.3963    150.237      405.106    150.237      
1 1 1 27  5  0  o 0 50      2.1   ?     ?   235.453   80.5012      22.0775    -99.4988     257.532    -99.4988     
1 1 1 27  5  1  o 0 811.9   15.6  ?     ?   391.544   -35.681      869.174    -35.681      476.967    -35.681      
1 1 1 27  5  2  o 0 194.7   6.1   ?     ?   475.091   -151.727     115.806    -151.727     336.862    28.2731      
1 1 1 27  5  3  o 0 1480    26.7  ?     ?   756.048   120.805      946.356    120.805      225.164    120.805      
1 1 1 27  5  4  o 0 3607.2  63.2  ?     ?   1223.74   103.034      1462.76    103.034      294.516    103.034      
1 1 1 27  5  5  o 0 272.8   6.8   ?     ?   254.496   141.405      397.045    141.405      153.999    141.405      
1 1 1 27  5  6  o 0 941     20.7  ?     ?   442.24    52.1105      882.802    52.1105      460.497    52.1105      
1 1 1 27  5  7  o 0 475.6   18.5  ?     ?   305.805   33.7196      598.227    33.7196      306.377    33.7196      
1 1 1 27  5  8  f 1 269.9   11.4  ?     ?   155.334   -33.1884     411.896    -33.1884     264.993    -33.1884     
1 1 1 27  5  9  o 0 630.1   17.3  ?     ?   636.539   -119.086     470.669    -119.086     127.248    60.9138      
1 1 1 27  5  10 o 0 2331    43.6  ?     ?   990.275   -138.46      1198.45    -138.46      245.269    -138.46      
1 1 1 27  5  11 o 0 1468.5  30.2  ?     ?   836.058   -100.773     901.421    -100.773     108.494    -100.773     
1 1 1 27  5  12 o 0 115.6   12.2  ?     ?   213.559   86.5898      155.276    86.5898      46.5983    -93.4102     
1 1 1 27  5  13 o 0 1155.2  32.2  ?     ?   548.339   71.0154      973.283    71.0154      467.69     71.0154      
1 1 1 27  5  14 o 0 7.1     10.9  ?     ?   104.542   129.078      63.7435    -50.9221     160.557    -50.9221     
1 1 1 27  5  15 f 1 271.1   16.8  ?     ?   375.217   115.801      337.005    115.801      10.5638    -64.1988     
1 1 1 27  5  16 f 1 36.9    13.6  ?     ?   175.785   147.415      18.9167    147.415      163.954    -32.5846     
1 1 1 27  5  17 o 0 212.9   18.7  ?     ?   349.738   -136.183     330.939    -136.183     22.644     43.8174      
1 1 1 27  5  18 f 1 9.1     10.1  ?     ?   132.444   150.315      48.1112    -29.6854     179.619    -29.6854     
1 1 1 27  5  19 o 0 87.7    16.7  ?     ?   182.034   -151.965     229.727    -151.965     55.5614    -151.965     
1 1 1 27  5  20 o 0 231.7   22.5  ?     ?   302.596   -152.61      413.049    -152.61      124.526    -152.61      
1 1 1 27  5  21 o 0 17.7    21.7  ?     ?   183.935   -155.059     3.74865    24.9411      179.323    24.9411      
1 1 1 27  5  22 o 0 3.6     26.9  ?     ?   61.1048   179.656      38.0475    179.656      25.2336    -0.344435    
1 1 1 27  5  23 o 0 19.3    27.4  ?     ?   147.894   -151.299     48.9498    -151.299     97.8118    28.7009      
1 1 1 27  5  24 o 0 -34.5   32.8  ?     ?   99.3953   144.408      17.9315    144.408      76.55      -35.5924     
1 1 1 27  5  25 o 0 36.8    29.7  ?     ?   68.3551   -163.358     137.54     -163.358     73.0147    -163.358     
1 1 1 -27 7  25 < 1 8.2     9.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 7  24 o 0 77.7    11.4  ?     ?   66.3837   38.408       278.958    38.408       221.325    38.408       
1 1 1 -27 7  23 o 0 85      9.2   ?     ?   166.37    120.49       242.485    120.49       96.6641    120.49       
1 1 1 -27 7  22 o 0 47.3    10    ?     ?   124.857   -164.499     153.416    -164.499     38.883     -164.499     
1 1 1 -27 7  21 o 0 -1.3    8.2   ?     ?   61.6527   -119.723     28.2957    60.277       87.4635    60.277       
1 1 1 -27 7  20 o 0 6.8     6.2   ?     ?   66.1323   -61.1781     20.5072    118.822      84.165     118.822      
1 1 1 -27 7  19 o 0 89.3    7.3   ?     ?   185.317   -82.0847     219.765    -82.0847     55.2198    -82.0847     
1 1 1 -27 7  18 o 0 98.7    6.3   ?     ?   209.117   147.144      227.173    147.144      40.4094    147.144      
1 1 1 -27 7  17 o 0 248.2   8.1   ?     ?   407.017   63.8877      324.054    63.8877      52.1627    -116.112     
1 1 1 -27 7  16 o 0 463     10.7  ?     ?   535.689   140.791      466.27     140.791      41.6939    -39.2089     
1 1 1 -27 7  15 o 0 128.9   6.2   ?     ?   126.06    -14.4723     321.453    -14.4723     200.928    -14.4723     
1 1 1 -27 7  14 o 0 687.9   15.2  ?     ?   601.078   56.1767      618.79     56.1767      29.3275    56.1767      
1 1 1 -27 7  13 f 1 54.8    4     ?     ?   170.507   -128.508     57.6696    -128.508     92.2778    51.4923      
1 1 1 -27 7  12 o 0 280.6   7     ?     ?   372.543   0.302165     339.12     0.302165     10.9382    0.302165     
1 1 1 -27 7  11 o 0 529     11    ?     ?   565.634   114.66       447.361    114.66       49.7481    -65.3404     
1 1 1 -27 7  10 o 0 103     3.6   ?     ?   358.963   141.249      60.1584    141.249      257.181    -38.751      
1 1 1 -27 7  9  o 0 325.3   8.6   ?     ?   388.372   105.443      365.823    105.443      13.2772    105.443      
1 1 1 -27 7  8  o 0 652.8   13.6  ?     ?   633.293   59.6627      492.059    59.6627      85.6598    -120.337     
1 1 1 -27 7  7  o 0 188.3   4.5   ?     ?   242.273   112.18       274.16     112.18       52.1595    112.18       
1 1 1 -27 7  6  o 0 296.1   7.5   ?     ?   425.246   -129.222     293.005    -129.222     92.5507    50.7781      
1 1 1 -27 7  5  o 0 841.7   18.4  ?     ?   732.565   26.6015      539.711    26.6015      126.83     -153.399     
1 1 1 -27 7  4  o 0 1202.3  25.3  ?     ?   675.882   44.1336      832.475    44.1336      215.612    44.1336      
1 1 1 -27 7  3  o 0 270.9   9.3   ?     ?   282.643   -123.99      365.236    -123.99      106.592    -123.99      
1 1 1 -27 7  2  o 0 546.1   16.8  ?     ?   448.757   60.3269      542.587    60.3269      131.025    60.3269      
1 1 1 -27 7  1  o 0 456.4   11.3  ?     ?   413.74    -69.178      485.177    -69.1779     105.047    -69.1779     
1 1 1 27  7  0  f 1 2144.5  38.6  ?     ?   887.595   16.3275      1149.65    16.3275      328.363    16.3275      
1 1 1 27  7  1  o 0 305.8   7     ?     ?   394.571   45.2314      334.02     45.2314      29.7056    -134.769     
1 1 1 27  7  2  o 0 460.3   14.5  ?     ?   440.741   -134.891     469.638    -134.891     62.9247    -134.891     
1 1 1 27  7  3  o 0 1505.2  29    ?     ?   986.063   -84.0977     744.295    -84.0977     166.275    95.9023      
1 1 1 27  7  4  o 0 58.9    4.5   ?     ?   207.842   -6.33068     13.5597    -6.33068     178.429    173.669      
1 1 1 27  7  5  o 0 908.1   19    ?     ?   602.5     -133.433     710.008    -133.433     153.525    -133.433     
1 1 1 27  7  6  o 0 1361    27.2  ?     ?   751.986   107.619      894.221    107.619      181.333    107.619      
1 1 1 27  7  7  o 0 859.1   18.3  ?     ?   762.693   130.118      556.36     130.118      157.282    -49.8815     
1 1 1 27  7  8  o 0 2.3     6.7   ?     ?   290.817   128.141      238.81     -51.8585     510.502    -51.8585     
1 1 1 27  7  9  o 0 448.6   13.5  ?     ?   443.621   52.7152      470.849    52.7152      57.2523    52.7152      
1 1 1 27  7  10 o 0 32.4    7.5   ?     ?   325.051   143.605      116.97     -36.3949     412.943    -36.3949     
1 1 1 27  7  11 o 0 105.8   9.2   ?     ?   208.488   -34.4446     153.386    -34.4446     35.8652    145.555      
1 1 1 27  7  12 o 0 499.3   15.6  ?     ?   496.237   -39.5107     493.556    -39.5107     40.8049    -39.5107     
1 1 1 27  7  13 f 1 424.7   15.5  ?     ?   374.7     -77.8981     514.041    -77.8981     171.834    -77.8981     
1 1 1 27  7  14 o 0 161.9   12.5  ?     ?   236.201   -155.016     320.818    -155.016     79.6172    -155.016     
1 1 1 27  7  15 o 0 4.9     15    ?     ?   25.203    -126.829     8.45721    53.1714      33.615     53.1714      
1 1 1 27  7  16 o 0 344.9   19.3  ?     ?   367.924   -177.574     511.677    -177.574     152.571    -177.574     
1 1 1 27  7  17 o 0 33.5    17.5  ?     ?   44.4967   105.736      53.4797    105.736      11.3877    105.736      
1 1 1 27  7  18 o 0 169.9   19.7  ?     ?   364.606   107.982      250.481    107.982      93.4614    -72.0182     
1 1 1 27  7  19 o 0 -3.8    17.5  ?     ?   89.6507   -80.1119     16.7128    99.8881      101.429    99.8881      
1 1 1 27  7  20 o 0 68      20.4  ?     ?   151.582   -71.5674     195.773    -71.5674     41.4343    -71.5674     
1 1 1 27  7  21 o 0 175.2   27.3  ?     ?   280.931   172.417      325.006    172.417      39.0783    172.417      
1 1 1 27  7  22 o 0 87.2    28.1  ?     ?   285.652   159.004      122.205    159.004      150.613    -20.9959     
1 1 1 27  7  24 < 0 14.9    27    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 9  23 < 0 -10     24    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 9  22 o 0 19.8    9.3   ?     ?   152.278   132.871      31.9971    132.871      98.4743    -47.129      
1 1 1 -27 9  21 o 0 4.1     8.4   ?     ?   35.6383   -139.809     4.54366    40.1915      35.7599    40.1915      
1 1 1 -27 9  20 o 0 59      9.2   ?     ?   154.288   -6.39376     170.837    -6.39376     31.3225    -6.39376     
1 1 1 -27 9  19 o 0 92      8.1   ?     ?   161.275   -27.7472     249.965    -27.7472     97.4864    -27.7472     
1 1 1 -27 9  18 o 0 56.8    6.4   ?     ?   126.329   -122.876     176.777    -122.876     57.0521    -122.876     
1 1 1 -27 9  17 o 0 60      6.1   ?     ?   120.633   -44.8597     179.405    -44.8597     73.0898    -44.8597     
1 1 1 -27 9  16 o 0 6.8     4.8   ?     ?   76.949    89.5729      31.8845    -90.4271     99.7168    -90.4271     
1 1 1 -27 9  15 o 0 190.5   6.7   ?     ?   349.058   158.867      290.161    158.867      19.0055    -21.1331     
1 1 1 -27 9  14 o 0 16.1    4     ?     ?   155.331   -77.8535     22.8839    102.147      165.115    102.147      
1 1 1 -27 9  13 o 0 31.9    4     ?     ?   190.317   18.4428      20.435     18.4428      158.14     -161.557     
1 1 1 -27 9  12 o 0 345.2   8     ?     ?   325.084   -102.719     516.89     -102.719     209.688    -102.719     
1 1 1 -27 9  11 o 0 219.2   6     ?     ?   349.369   99.9097      310.808    99.9097      27.4448    -80.0903     
1 1 1 -27 9  10 o 0 56.5    3.2   ?     ?   226.922   51.6909      40.9775    51.6909      154.805    -128.309     
1 1 1 -27 9  9  o 0 100.5   3.9   ?     ?   261.599   -44.3762     129.739    -44.3762     97.2464    135.624      
1 1 1 -27 9  8  o 0 332.5   7.5   ?     ?   458.25    -83.9756     330.844    -83.9756     68.8438    96.0244      
1 1 1 -27 9  7  o 0 910.9   17.3  ?     ?   459.427   -17.7107     828.434    -17.7107     429.32     -17.7107     
1 1 1 -27 9  6  o 0 376.8   8.3   ?     ?   239.058   140.607      528.841    140.607      320.284    140.607      
1 1 1 -27 9  5  o 0 154.7   5.1   ?     ?   136.126   96.4526      242.71     96.4526      123.503    96.4526      
1 1 1 -27 9  4  o 0 7.6     2.3   ?     ?   121.637   69.4309      84.8465    -110.569     191.718    -110.569     
1 1 1 -27 9  3  o 0 171.9   5.1   ?     ?   199.537   -177.866     255.826    -177.866     76.2717    -177.866     
1 1 1 -27 9  2  o 0 12.5    2.6   ?     ?   143.275   58.9424      91.9291    -121.058     221.165    -121.058     
1 1 1 -27 9  1  o 0 357.7   11.1  ?     ?   515.676   -163.849     301.256    -163.849     164.798    16.1509      
1 1 1 27  9  0  o 0 38.5    3.5   ?     ?   260.861   11.1881      69.7494    -168.812     307.018    -168.812     
1 1 1 27  9  1  o 0 803.9   16.9  ?     ?   519.492   -147.967     707.917    -147.967     234.925    -147.967     
1 1 1 27  9  2  o 0 1604.6  34.2  ?     ?   708.422   -178.513     1052.19    -178.513     406.753    -178.513     
1 1 1 27  9  3  o 0 1554.3  29    ?     ?   875.277   -123.841     879.288    -123.841     81.6107    -123.841     
1 1 1 27  9  4  o 0 248.2   8.4   ?     ?   321.644   -83.0991     331.173    -83.0991     44.1903    -83.0991     
1 1 1 27  9  5  o 0 600.2   15.6  ?     ?   533.561   56.1568      544.971    56.1568      69.1768    56.1568      
1 1 1 27  9  6  o 0 14.9    6.3   ?     ?   95.1233   -14.6833     52.1029    165.317      136.842    165.317      
1 1 1 27  9  7  o 0 1717.3  32    ?     ?   1040.06   -107.602     838.86     -107.602     86.2902    72.3979      
1 1 1 27  9  8  o 0 63.4    7.2   ?     ?   261.471   -178.362     42.7501    -178.362     191.409    1.63803      
1 1 1 27  9  9  o 0 315.3   11.9  ?     ?   496.18    134.126      286.608    134.126      156.657    -45.8737     
1 1 1 27  9  10 o 0 139.3   9.9   ?     ?   175.252   148.215      310.653    148.215      134.399    148.215      
1 1 1 27  9  11 o 0 55.6    10.9  ?     ?   141.271   174.082      104.964    174.082      36.6278    -5.91774     
1 1 1 27  9  12 o 0 81.2    11.6  ?     ?   40.7211   -148.955     131.49     -148.955     91.5464    -148.955     
1 1 1 27  9  13 o 0 198.3   13.4  ?     ?   212.09    -157.996     411.611    -157.995     204.491    -157.995     
1 1 1 27  9  14 o 0 69.8    12.8  ?     ?   155.379   -113.881     184.713    -113.881     36.2408    -113.881     
1 1 1 27  9  15 o 0 135.1   14.9  ?     ?   191.827   -50.7041     324.899    -50.7041     147.125    -50.7041     
1 1 1 27  9  16 o 0 61.8    16.6  ?     ?   148.489   -32.2783     169.311    -32.2783     31.9907    -32.2783     
1 1 1 27  9  17 o 0 16.6    18.8  ?     ?   162.778   -9.32781     1.82986    -9.32781     149.064    170.672      
1 1 1 27  9  18 o 0 -8.7    19.2  ?     ?   15.6097   25.3857      0.891541   -154.614     16.4929    -154.614     
1 1 1 27  9  19 o 0 0.7     18.6  ?     ?   53.6731   64.8173      9.47823    64.8173      44.1789    -115.183     
1 1 1 27  9  20 o 0 175.4   27.8  ?     ?   250.806   130.958      344.641    130.958      104.205    130.958      
1 1 1 27  9  21 o 0 33.2    26    ?     ?   94.0143   -25.4862     110.006    -25.4862     23.6115    -25.4862     
1 1 1 27  9  22 o 0 63.9    32    ?     ?   180.081   86.4473      132.175    86.4473      32.2751    -93.5527     
1 1 1 -27 11 21 < 0 56.8    10.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 11 20 f 1 23.9    11.1  ?     ?   50.6798   -86.098      82.8697    -86.098      40.1864    -86.098      
1 1 1 -27 11 19 o 0 48.2    10.3  ?     ?   162.756   171.897      134.457    171.897      3.05462    -8.10277     
1 1 1 -27 11 18 o 0 19.7    8.6   ?     ?   81.5917   51.0558      50.8249    51.0558      19.7314    -128.944     
1 1 1 -27 11 17 o 0 47.2    7.4   ?     ?   221.073   -14.3547     82.2164    -14.3547     114.92     165.645      
1 1 1 -27 11 16 o 0 214.7   8.8   ?     ?   218.804   -151.644     428.269    -151.644     224.493    -151.644     
1 1 1 -27 11 15 o 0 68.5    5.9   ?     ?   164.855   163.813      184.005    163.813      30.2813    163.813      
1 1 1 -27 11 14 o 0 71.2    5.4   ?     ?   269.955   -20.7711     109.229    -20.7711     124.589    159.229      
1 1 1 -27 11 13 o 0 139.4   6.1   ?     ?   246.613   20.8418      274.854    20.8418      61.453     20.8418      
1 1 1 -27 11 12 o 0 48.1    4.8   ?     ?   123.979   -11.3867     132.49     -11.3867     24.8254    -11.3867     
1 1 1 -27 11 11 o 0 156.1   5.5   ?     ?   127.088   15.2037      384.351    15.2037      273.228    15.2037      
1 1 1 -27 11 10 o 0 154.1   5.6   ?     ?   293.972   16.1647      261.657    16.1647      3.6325     -163.835     
1 1 1 -27 11 9  o 0 38.4    3.5   ?     ?   204.757   -83.2137     50.0084    -83.2137     135.862    96.7863      
1 1 1 -27 11 8  o 0 363.4   8.6   ?     ?   456.317   144.138      416.271    144.138      7.27625    -35.8624     
1 1 1 -27 11 7  o 0 540.3   11.7  ?     ?   343.088   -178.263     706.557    -178.263     386.533    -178.263     
1 1 1 -27 11 6  f 1 658.9   13.9  ?     ?   383.657   -125.234     770.149    -125.234     402.417    -125.234     
1 1 1 -27 11 5  f 1 810.2   16.4  ?     ?   491.003   174.432      804.881    174.432      332.382    174.432      
1 1 1 -27 11 4  o 0 27.3    3     ?     ?   110.192   72.8514      8.10547    72.8514      97.7618    -107.149     
1 1 1 -27 11 3  o 0 260.3   7.5   ?     ?   396.383   61.551       329.638    61.551       52.3491    -118.449     
1 1 1 -27 11 2  o 0 198.4   6.4   ?     ?   242.443   103.135      363.291    103.135      129.047    103.135      
1 1 1 -27 11 1  o 0 231.9   7.9   ?     ?   282.381   -6.01363     386.21     -6.01363     112.796    -6.01363     
1 1 1 27  11 0  o 0 21.7    4.6   ?     ?   214.801   -9.37086     62.9694    170.629      273.305    170.629      
1 1 1 27  11 1  o 0 138.8   6.1   ?     ?   261.273   -168.755     245.543    -168.755     10.4752    11.2453      
1 1 1 27  11 2  o 0 196.1   6.9   ?     ?   251.711   158.469      357.653    158.469      110.931    158.469      
1 1 1 27  11 3  o 0 179.2   7.1   ?     ?   147.652   170.463      389.401    170.463      244.69     170.463      
1 1 1 27  11 4  o 0 301.4   9.8   ?     ?   467.383   117.935      327.792    117.935      130.039    -62.0649     
1 1 1 27  11 5  f 1 610.1   15.1  ?     ?   533.802   158.313      606.494    158.313      81.4181    158.313      
1 1 1 27  11 6  f 1 135.9   7.4   ?     ?   115.433   -163.688     338.209    -163.688     226.803    -163.688     
1 1 1 27  11 7  o 0 263.2   10    ?     ?   250.13    -79.7056     476.199    -79.7056     236.478    -79.7056     
1 1 1 27  11 8  o 0 695.1   16.9  ?     ?   526.713   -71.7482     703.309    -71.7482     199.691    -71.7482     
1 1 1 27  11 9  o 0 10.1    9.6   ?     ?   146.721   145.664      50.511     -34.3365     188.068    -34.3365     
1 1 1 27  11 10 o 0 181.4   11.3  ?     ?   273.628   29.7076      335.457    29.7076      79.7598    29.7076      
1 1 1 27  11 11 o 0 30      12    ?     ?   169.668   25.8619      38.8618    25.8619      115.16     -154.138     
1 1 1 27  11 12 o 0 206.8   15    ?     ?   375.455   122.476      296.834    122.476      43.8347    -57.5243     
1 1 1 27  11 13 o 0 23.4    11    ?     ?   169.071   99.4304      10.7632    99.4304      141.92     -80.5696     
1 1 1 27  11 14 o 0 100.4   16    ?     ?   170.887   87.294       256.015    87.294       101.146    87.294       
1 1 1 27  11 15 o 0 24.4    19    ?     ?   111.279   -68.3458     54.1531    -68.3458     54.7026    111.654      
1 1 1 27  11 16 o 0 91.8    20.6  ?     ?   239.785   152.737      181.999    152.737      52.8794    -27.2627     
1 1 1 27  11 17 o 0 86.3    21.3  ?     ?   150.441   -58.6685     247.176    -58.6685     105.711    -58.6685     
1 1 1 27  11 18 o 0 158.8   28.8  ?     ?   274.761   -91.2221     292.422    -91.2221     41.2181    -91.2221     
1 1 1 27  11 19 o 0 119.6   29.4  ?     ?   249.505   -88.2638     233.909    -88.2638     10.4487    -88.2638     
1 1 1 -27 13 18 < 0 23.2    11.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 13 17 < 0 36.4    9.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 13 16 f 1 92.2    9.4   ?     ?   144.024   -95.5644     264.152    -95.5644     144.338    -95.5644     
1 1 1 -27 13 15 o 0 40.6    8.3   ?     ?   152.034   -133.57      117.007    -133.57      9.66649    46.4297      
1 1 1 -27 13 14 o 0 28.3    7.3   ?     ?   139.842   -96.8471     73.9819    -96.8471     45.0752    83.1529      
1 1 1 -27 13 13 o 0 21.5    6.7   ?     ?   153.118   -102.028     30.4587    -102.028     103.745    77.9715      
1 1 1 -27 13 12 o 0 87.3    6.6   ?     ?   244.254   -157.407     166.099    -157.407     57.1131    22.593       
1 1 1 -27 13 11 o 0 -2.2    6.9   ?     ?   88.1167   118.03       51.2636    -61.9697     131.754    -61.9697     
1 1 1 -27 13 10 o 0 24.1    5     ?     ?   131.846   50.017       48.6652    50.017       72.5629    -129.983     
1 1 1 -27 13 9  o 0 170.6   8.7   ?     ?   365.907   -128.087     228.787    -128.087     83.0342    51.913       
1 1 1 -27 13 8  o 0 51.3    4.7   ?     ?   138.2     -153.685     141.952    -153.685     23.5185    -153.685     
1 1 1 -27 13 7  o 0 172.7   6.6   ?     ?   381.067   160.544      223.928    160.544      101.464    -19.4562     
1 1 1 -27 13 6  o 0 78.4    6     ?     ?   327.311   -149.337     81.7318    -149.337     199.061    30.663       
1 1 1 -27 13 5  o 0 91.5    5.2   ?     ?   252.695   -99.7984     171.111    -99.7984     45.7602    80.2016      
1 1 1 -27 13 4  o 0 151.8   6.8   ?     ?   274.713   37.4309      275.718    37.4309      39.0728    37.4309      
1 1 1 -27 13 3  f 1 191.3   7.4   ?     ?   333.247   -8.15649     295.536    -8.15649     6.0558     -8.15649     
1 1 1 -27 13 2  o 0 188     8     ?     ?   241.647   3.00377      363.453    3.00377      154.034    3.00377      
1 1 1 -27 13 1  o 0 2.4     5.5   ?     ?   57.2809   97.3895      31.897     -82.6105     81.6542    -82.6105     
1 1 1 27  13 0  f 1 297.5   9.8   ?     ?   307.801   108.686      475.671    108.686      202.529    108.686      
1 1 1 27  13 1  o 0 69.6    6.6   ?     ?   271.364   54.9531      106.271    54.9531      133.397    -125.047     
1 1 1 27  13 2  o 0 50.1    6.1   ?     ?   264.668   52.332       54.4448    52.332       179.303    -127.668     
1 1 1 27  13 3  f 1 5.5     6.3   ?     ?   28.8613   -89.9446     12.2084    90.0554      37.8175    90.0554      
1 1 1 27  13 4  o 0 120.3   8.1   ?     ?   236.779   138.636      250.315    138.636      41.4746    138.636      
1 1 1 27  13 5  o 0 11.7    8.4   ?     ?   82.4561   151.181      10.1432    -28.8193     83.0482    -28.8193     
1 1 1 27  13 6  o 0 33.9    9.2   ?     ?   215.859   -86.2221     31.8513    -86.2221     158.668    93.7779      
1 1 1 27  13 7  o 0 -6.3    10.4  ?     ?   31.9428   -175.187     16.3429    4.81294      44.4737    4.81294      
1 1 1 27  13 8  o 0 10.4    9.9   ?     ?   35.4971   76.6142      0.0872233  -103.386     31.5379    -103.386     
1 1 1 27  13 9  o 0 47.1    10.3  ?     ?   196.356   162.541      93.8031    162.541      79.6249    -17.4585     
1 1 1 27  13 10 o 0 131.3   12.9  ?     ?   266.001   142.809      250.794    142.809      3.32459    -37.1908     
1 1 1 27  13 11 o 0 81      16.7  ?     ?   170.459   106.076      209.849    106.076      47.6661    106.076      
1 1 1 27  13 12 o 0 11.8    14.3  ?     ?   93.9639   29.5133      15.1825    29.5133      74.4819    -150.487     
1 1 1 27  13 13 o 0 134.7   18    ?     ?   139.645   110.67       359.371    110.67       231.246    110.67       
1 1 1 27  13 14 o 0 0.2     11.7  ?     ?   23.8495   25.0898      1.41315    -154.91      22.722     -154.91      
1 1 1 27  13 15 o 0 3.9     10.4  ?     ?   75.5539   42.3502      0.855686   -137.65      67.0867    -137.65      
1 1 1 27  13 16 f 1 11.8    23.7  ?     ?   83.9348   138.934      64.5685    138.934      9.08133    -41.0657     
1 1 1 27  13 17 < 0 4.5     25.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 15 13 < 0 81.6    10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 15 12 < 0 48.6    9.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 15 11 f 1 46.6    7.8   ?     ?   138.4     54.3276      146.458    54.3276      33.5202    54.3276      
1 1 1 -27 15 10 o 0 27.7    6.9   ?     ?   88.4368   -41.8279     98.0239    -41.8279     25.9022    -41.8279     
1 1 1 -27 15 9  f 1 9.5     6.5   ?     ?   8.11801   143.249      1.10171    143.249      5.68302    -36.7511     
1 1 1 -27 15 8  o 0 66.3    7.2   ?     ?   210.72    53.6719      147.172    53.6719      29.0575    -126.328     
1 1 1 -27 15 7  o 0 185.8   8.9   ?     ?   253.588   -10.7925     343.907    -10.7925     126.154    -10.7925     
1 1 1 -27 15 6  o 0 108.2   7.4   ?     ?   247.739   -18.2784     212.776    -18.2784     0.986951   161.722      
1 1 1 -27 15 5  o 0 194     8.9   ?     ?   327.73    -151.881     300        -151.881     15.9773    -151.881     
1 1 1 -27 15 4  o 0 42.2    6.7   ?     ?   168.328   164.538      98.0568    164.538      53.4965    -15.4617     
1 1 1 -27 15 3  o 0 12.6    7.9   ?     ?   43.2183   134.214      9.66959    134.214      29.3759    -45.7859     
1 1 1 -27 15 2  o 0 77.9    8.7   ?     ?   213.771   137.042      165.811    137.042      27.8968    -42.9584     
1 1 1 -27 15 1  o 0 39.1    7.7   ?     ?   100.421   141.791      125.72     141.791      34.4944    141.791      
1 1 1 27  15 0  o 0 11.7    8.4   ?     ?   164.606   13.9605      37.001     -166.039     189.723    -166.039     
1 1 1 27  15 1  o 0 2.3     7.7   ?     ?   174.569   1.22575      87.9911    -178.774     249.973    -178.774     
1 1 1 27  15 2  o 0 22.4    8.9   ?     ?   73.1862   -63.3847     55.0318    -63.3847     12.8549    116.615      
1 1 1 27  15 3  o 0 55.9    9.3   ?     ?   126.033   -20.6799     171.871    -20.6799     55.0526    -20.6799     
1 1 1 27  15 4  o 0 40.9    11    ?     ?   183.889   71.2451      86.5764    71.2451      77.9332    -108.755     
1 1 1 27  15 5  o 0 90.3    12.6  ?     ?   211.625   -97.0138     204.881    -97.0138     15.8681    -97.0138     
1 1 1 27  15 6  o 0 -7.4    10.3  ?     ?   99.3125   118.817      44.7204    -61.1831     133.237    -61.1831     
1 1 1 27  15 7  o 0 8       12.8  ?     ?   93.9201   -37.0629     6.90851    -37.0629     74.8498    142.937      
1 1 1 27  15 8  o 0 123     16.6  ?     ?   312.177   -72.3767     195.367    -72.3767     75.5763    107.623      
1 1 1 27  15 9  f 1 162.2   17.9  ?     ?   196.692   10.9291      361.698    10.9291      192.927    10.9291      
1 1 1 27  15 10 o 0 136.7   17.2  ?     ?   214.423   28.6949      302.401    28.6949      120.07     28.6949      
1 1 1 27  15 11 f 1 50.9    17.6  ?     ?   185.004   60.4681      112.353    60.4681      45.4362    -119.532     
1 1 1 27  15 12 < 0 16.1    16.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 27  15 13 < 0 -27.7   19.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 17 4  < 0 72.8    10.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 17 3  < 0 51.4    10.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 17 2  < 0 94.5    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -27 17 1  < 0 7.1     11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 27  17 0  < 0 90.3    12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 27  17 1  < 0 151     13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 27  17 2  < 0 14.6    13.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 27  17 3  < 0 21.7    14.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 27  17 4  < 0 15.2    14.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 0  27 < 0 12.9    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 0  26 o 0 7.5     13.2  ?     ?   47.3626   0            22.5393    0            20.1222    180          
1 1 1 -28 0  25 o 0 -16.2   14.2  ?     ?   60.428    0            8.57523    0            47.0841    180          
1 1 1 -28 0  24 o 0 215.1   14.9  ?     ?   223.645   0            345.028    0            124.899    0            
1 1 1 -28 0  23 o 0 61.5    12.6  ?     ?   234.732   180          182.545    180          49.2229    2.60217e-14  
1 1 1 -28 0  22 f 1 50.4    9     ?     ?   221.051   180          159.723    180          44.4398    2.52191e-14  
1 1 1 -28 0  21 o 0 9.9     8.5   ?     ?   28.9295   180          6.92751    180          19.5823    2.48226e-15  
1 1 1 -28 0  20 o 0 31.8    8.6   ?     ?   127.62    180          96.5537    180          24.4968    2.76562e-14  
1 1 1 -28 0  19 o 0 616.6   18.7  ?     ?   268.319   180          587.433    180          326.308    180          
1 1 1 -28 0  18 o 0 442.9   15.6  ?     ?   549.413   0            502.074    0            46.6803    180          
1 1 1 -28 0  17 f 1 613     21.9  ?     ?   403.747   0            528.852    0            167.018    0            
1 1 1 -28 0  16 o 0 5.8     6.3   ?     ?   23.0622   180          1.45983    180          19.2554    5.31964e-16  
1 1 1 -28 0  15 o 0 252.4   11.7  ?     ?   292.173   180          340.88     180          78.9141    180          
1 1 1 -28 0  14 o 0 85.7    5.3   ?     ?   326.227   0            183.336    0            117.311    180          
1 1 1 -28 0  13 o 0 52.5    4.8   ?     ?   343.949   0            134.587    0            184.274    180          
1 1 1 -28 0  12 o 0 579.3   16.2  ?     ?   413.177   0            517.316    0            137.773    0            
1 1 1 -28 0  11 f 1 3955.3  95.2  ?     ?   1598.07   180          1357.94    180          124.869    7.63059e-14  
1 1 1 -28 0  10 o 0 1374.5  49.4  ?     ?   857.577   180          803.982    180          1.67738    3.36316e-12  
1 1 1 -28 0  9  o 0 45.8    3     ?     ?   23.1349   180          12.0986    180          9.72183    8.73211e-15  
1 1 1 -28 0  8  f 1 872.4   22.5  ?     ?   446.208   180          645.695    180          221.191    180          
1 1 1 -28 0  7  f 1 284.9   11.8  ?     ?   338.207   180          388.03     180          52.2801    180          
1 1 1 -28 0  5  o 0 1849.5  44.8  ?     ?   921.197   180          997.866    180          83.3521    180          
1 1 1 -28 0  4  o 0 856.8   21.7  ?     ?   646.645   0            680.74     0            37.3863    0            
1 1 1 -28 0  3  o 0 71.8    2.9   ?     ?   154.791   180          121.005    180          33.3085    2.54906e-14  
1 1 1 -28 0  2  o 0 204.3   6.1   ?     ?   55.5971   180          135.957    180          80.4252    180          
1 1 1 -28 0  1  o 0 429.2   13.5  ?     ?   448.553   0            484.496    0            35.6442    0            
1 1 1 28  0  0  o 0 203.4   15    ?     ?   456.549   180          332.947    180          124.732    -1.43236e-13 
1 1 1 28  0  1  o 0 731.5   19.8  ?     ?   500.432   0            634.848    0            132.302    0            
1 1 1 28  0  2  o 0 460.2   13.9  ?     ?   524.096   180          504.351    180          22.8204    1.55075e-13  
1 1 1 28  0  3  o 0 2783.8  68.7  ?     ?   1012.63   180          1241.91    180          221.861    180          
1 1 1 28  0  4  o 0 2181.5  55    ?     ?   846.101   180          1100.82    180          247.511    180          
1 1 1 28  0  5  o 0 2178.3  55.9  ?     ?   883.096   180          1100.93    180          209.574    180          
1 1 1 28  0  6  o 0 120.1   6.4   ?     ?   74.6408   180          107.953    180          32.5833    180          
1 1 1 28  0  7  f 1 1672.1  42.8  ?     ?   1087.76   180          965.011    180          152.272    4.44677e-14  
1 1 1 28  0  8  f 1 739.9   21.9  ?     ?   903.181   180          609.378    180          271.248    1.57635e-14  
1 1 1 28  0  9  o 0 1412    38.4  ?     ?   869.063   0            840.82     0            1.2584     180          
1 1 1 28  0  10 o 0 840.9   27    ?     ?   371.644   0            647.712    0            288.209    0            
1 1 1 28  0  11 f 1 21.8    11.5  ?     ?   203.57    180          34.5757    180          160.346    1.51303e-15  
1 1 1 28  0  12 o 0 39.9    14    ?     ?   275.542   180          87.7893    180          173.974    3.54072e-15  
1 1 1 28  0  13 o 0 260.5   19.5  ?     ?   137       0            294.648    0            163.018    0            
1 1 1 28  0  14 o 0 10.5    14.2  ?     ?   144.309   0            12.8812    0            125.244    180          
1 1 1 28  0  15 o 0 61.6    15    ?     ?   158.479   0            103.115    0            44.7759    180          
1 1 1 28  0  16 o 0 166.3   18.5  ?     ?   34.0636   180          87.9818    180          56.0688    180          
1 1 1 28  0  17 f 1 54.4    25.7  ?     ?   506.102   0            158.997    0            376.301    180          
1 1 1 28  0  18 o 0 14.3    20.2  ?     ?   19.2879   180          6.16482    180          13.6636    3.16584e-15  
1 1 1 28  0  19 o 0 1356.7  47    ?     ?   653.444   180          913.071    180          256.584    180          
1 1 1 28  0  20 o 0 93.7    27.3  ?     ?   102.887   0            203.225    0            103.092    0            
1 1 1 28  0  21 o 0 218.9   30.5  ?     ?   464.614   0            356.203    0            94.5214    180          
1 1 1 28  0  22 f 1 125.3   38.3  ?     ?   45.4103   0            173.547    0            129.208    0            
1 1 1 28  0  23 o 0 46.1    38.2  ?     ?   118.545   0            110.122    0            13.9174    180          
1 1 1 -28 2  27 < 0 32.5    14.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 2  26 o 0 129.1   11.3  ?     ?   164.552   -165.412     349.509    -165.412     202.588    -165.412     
1 1 1 -28 2  25 o 0 198.1   12.2  ?     ?   292.795   175.767      365.786    175.767      98.3687    175.767      
1 1 1 -28 2  24 o 0 57.9    9.6   ?     ?   153.552   -163.76      173.064    -163.76      28.1953    -163.76      
1 1 1 -28 2  23 o 0 3.9     7.3   ?     ?   67.8268   -65.6025     27.4001    114.398      93.8517    114.398      
1 1 1 -28 2  22 o 0 74.5    8     ?     ?   99.9927   161.664      231.525    161.664      140.323    161.664      
1 1 1 -28 2  21 o 0 1.1     5.4   ?     ?   130.154   123.838      83.0849    -56.1616     201.958    -56.1616     
1 1 1 -28 2  20 o 0 0       5.3   ?     ?   80.2864   52.8401      57.1959    -127.16      132.839    -127.16      
1 1 1 -28 2  19 o 0 182.7   7.1   ?     ?   201.234   -27.4848     390.004    -27.4848     195.406    -27.4848     
1 1 1 -28 2  18 o 0 196     6.7   ?     ?   277.839   -135.448     341.285    -135.448     65.4348    -135.448     
1 1 1 -28 2  17 o 0 228.4   7.5   ?     ?   361.671   118.973      324.977    118.973      37.0843    -61.0272     
1 1 1 -28 2  16 o 0 460.1   10    ?     ?   441.912   121.148      490.152    121.148      95.2792    121.148      
1 1 1 -28 2  15 o 0 125.5   5.2   ?     ?   409.496   177.84       69.2453    177.84       296.147    -2.16013     
1 1 1 -28 2  14 o 0 26.6    4.3   ?     ?   228.715   -88.3746     95.8432    91.6254      305.695    91.6254      
1 1 1 -28 2  13 o 0 169.5   5.7   ?     ?   165       173.1        259.341    173.1        106.988    173.1        
1 1 1 -28 2  12 o 0 456.7   10.6  ?     ?   640.787   -117.055     303.1      -117.055     299.245    62.9448      
1 1 1 -28 2  11 o 0 227.1   7.9   ?     ?   235.069   -11.4011     331.34     -11.4011     115.027    -11.4011     
1 1 1 -28 2  10 o 0 629.5   12    ?     ?   474.277   -0.292926    597.53     -0.292926    153.18     -0.292926    
1 1 1 -28 2  9  o 0 419.6   11.2  ?     ?   409.289   78.9524      453.441    78.9524      68.2965    78.9524      
1 1 1 -28 2  8  o 0 3848.6  75.4  ?     ?   1357.81   151.559      1408.3     151.559      125.581    151.559      
1 1 1 -28 2  7  o 0 514.8   11.4  ?     ?   541.457   163.776      441.358    163.776      71.9356    -16.2237     
1 1 1 -28 2  6  o 0 1496.1  30.7  ?     ?   912.022   -9.87033     863.301    -9.87033     38.8636    170.13       
1 1 1 -28 2  5  o 0 1584.9  27.3  ?     ?   839.835   51.048       987.797    51.048       154.789    51.048       
1 1 1 -28 2  4  o 0 662.5   11.9  ?     ?   630.061   -115.487     535.904    -115.487     90.5303    64.5126      
1 1 1 -28 2  3  o 0 2947.4  50.2  ?     ?   1205.09   -169.742     1310.11    -169.742     109.402    -169.742     
1 1 1 -28 2  2  o 0 1248.2  22.2  ?     ?   709.088   -157.561     910.728    -157.561     202.866    -157.561     
1 1 1 -28 2  1  o 0 329.9   6.9   ?     ?   399.785   7.53156      393.934    7.53156      5.85436    -172.468     
1 1 1 28  2  0  o 0 172.2   6.9   ?     ?   295.977   113.075      238.719    113.075      56.9564    -66.9247     
1 1 1 28  2  1  o 0 1109.7  24    ?     ?   739.797   -71.054      789.075    -71.054      48.6309    -71.054      
1 1 1 28  2  2  o 0 491.5   14.6  ?     ?   350.482   -72.11       624.414    -72.11       273.005    -72.11       
1 1 1 28  2  3  o 0 312.2   6.9   ?     ?   402.266   -179.98      370.197    -179.98      33.7618    0.0195807    
1 1 1 28  2  4  o 0 186.4   6.7   ?     ?   230.072   114.403      305.863    114.403      74.53      114.403      
1 1 1 28  2  5  o 0 782.1   15    ?     ?   583.515   16.546       691.281    16.546       104.045    16.546       
1 1 1 28  2  6  o 0 181.6   5.7   ?     ?   283.411   163.194      266.262    163.194      19.0824    -16.8056     
1 1 1 28  2  7  o 0 643.4   15.8  ?     ?   771.771   172.002      359.445    172.002      387.459    -7.99849     
1 1 1 28  2  8  o 0 2652.8  47.7  ?     ?   1029.51   151.786      1284.64    151.786      288.902    151.786      
1 1 1 28  2  9  o 0 1135    22.9  ?     ?   815.629   99.8323      689.492    99.8323      98.4576    -80.1677     
1 1 1 28  2  10 o 0 705.9   16.1  ?     ?   499.953   80.8546      662.547    80.8546      186.678    80.8546      
1 1 1 28  2  11 o 0 303.1   12.2  ?     ?   516.215   67.2078      239.289    67.2078      250.927    -112.792     
1 1 1 28  2  12 o 0 163.2   9.8   ?     ?   354.402   31.4171      172.269    31.4171      168.253    -148.583     
1 1 1 28  2  13 o 0 159.5   10.9  ?     ?   542.376   -29.9274     9.96451    -29.9274     509.396    150.073      
1 1 1 28  2  14 o 0 583.1   18.4  ?     ?   298.073   -55.1937     743.678    -55.1937     465.299    -55.1937     
1 1 1 28  2  15 o 0 281.9   14.2  ?     ?   159.737   -131.227     466.099    -131.227     317.579    -131.227     
1 1 1 28  2  16 o 0 358.7   16.7  ?     ?   319.035   -174.231     498.947    -174.231     201.194    -174.231     
1 1 1 28  2  17 o 0 75.7    15    ?     ?   163.421   -132.462     167.1      -132.462     4.17717    47.5377      
1 1 1 28  2  18 o 0 34.8    14.4  ?     ?   22.6148   -171.251     19.9451    -171.251     3.20609    8.74866      
1 1 1 28  2  19 o 0 47.6    19    ?     ?   205.132   145.896      74.6346    145.896      130.55     -34.1041     
1 1 1 28  2  20 o 0 -1.8    20.3  ?     ?   46.9364   154.192      2.70845    -25.8075     48.1789    -25.8075     
1 1 1 28  2  21 o 0 -25.7   20.5  ?     ?   28.6243   64.9133      10.6943    -115.087     38.3295    -115.087     
1 1 1 28  2  22 o 0 86.2    25.3  ?     ?   270.429   -20.9644     150.879    -20.9644     123.15     159.036      
1 1 1 28  2  23 o 0 149.1   27.1  ?     ?   276.192   -93.5298     287.525    -93.5298     2.10687    86.4702      
1 1 1 28  2  24 o 0 -67.7   30.4  ?     ?   100.521   -147.7       27.066     32.3         128.08     32.3         
1 1 1 28  2  25 o 0 117.8   37.5  ?     ?   212.12    -35.9759     244.439    -35.9759     40.2369    -35.9759     
1 1 1 -28 4  26 < 0 1       9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 4  25 o 0 1.5     9.8   ?     ?   57.1963   -37.3606     4.66337    142.639      55.3783    142.639      
1 1 1 -28 4  24 o 0 112     9.1   ?     ?   154.34    59.0133      315.244    59.0133      174.95     59.0133      
1 1 1 -28 4  23 o 0 163.3   10.1  ?     ?   307.833   72.1614      278.754    72.1614      20.3417    -107.839     
1 1 1 -28 4  22 o 0 84.9    7.5   ?     ?   246.083   68.7152      169.597    68.7152      70.3171    -111.285     
1 1 1 -28 4  21 f 1 15.1    9.5   ?     ?   65.3173   119.671      11.4891    119.671      48.094     -60.3286     
1 1 1 -28 4  20 o 0 8.7     6.3   ?     ?   69.8258   -145.605     21.5206    34.3947      84.7338    34.3947      
1 1 1 -28 4  19 o 0 497     14.1  ?     ?   481.644   -171.698     564.476    -171.698     113.013    -171.698     
1 1 1 -28 4  18 o 0 142.1   7.1   ?     ?   163.654   163.561      336.109    163.561      178.675    163.561      
1 1 1 -28 4  17 o 0 233.8   7.3   ?     ?   202.986   106.914      456.214    106.914      255.746    106.914      
1 1 1 -28 4  16 o 0 246.5   7.1   ?     ?   449.647   7.08834      240.673    7.08834      157.121    -172.912     
1 1 1 -28 4  15 o 0 622.1   12.7  ?     ?   513.012   -60.9692     577.944    -60.9692     122.019    -60.9692     
1 1 1 -28 4  14 f 1 1823.9  32.6  ?     ?   725.13    -106.474     1159.96    -106.474     513.15     -106.474     
1 1 1 -28 4  13 o 0 56      3.7   ?     ?   67.5581   164.378      18.1332    164.378      43.5114    -15.6224     
1 1 1 -28 4  12 o 0 496.7   14.3  ?     ?   404.865   -62.3194     542.604    -62.3194     170.842    -62.3194     
1 1 1 -28 4  11 o 0 205.3   5.7   ?     ?   141.75    53.5554      308.538    53.5554      176.033    53.5554      
1 1 1 -28 4  10 o 0 685     13.4  ?     ?   374.453   42.9121      719.797    42.9121      377.138    42.9121      
1 1 1 -28 4  9  o 0 1256.1  23.1  ?     ?   723.717   -66.089      830.066    -66.089      164.566    -66.089      
1 1 1 -28 4  8  o 0 3012.3  51.6  ?     ?   1002.83   -153.611     1413.27    -153.611     474.824    -153.611     
1 1 1 -28 4  7  o 0 403.8   8     ?     ?   558.496   69.1305      309.913    69.1305      214.794    -110.87      
1 1 1 -28 4  6  f 1 24.4    1.5   ?     ?   262.879   -162.809     127.793    17.191       376.911    17.191       
1 1 1 -28 4  5  o 0 205.9   4.7   ?     ?   339.057   -27.5077     241.359    -27.5077     79.297     152.492      
1 1 1 -28 4  4  o 0 874.6   18.3  ?     ?   630.316   161.693      699.702    161.693      70.3955    161.693      
1 1 1 -28 4  3  o 0 1499.8  30.8  ?     ?   862.201   -25.8507     913.084    -25.8507     60.5244    -25.8507     
1 1 1 -28 4  2  o 0 783.8   15.4  ?     ?   622.267   -62.6714     645.945    -62.6714     29.3867    -62.6714     
1 1 1 -28 4  1  o 0 318.5   6.5   ?     ?   309.5     -146.569     448.784    -146.569     141.593    -146.569     
1 1 1 28  4  0  o 0 610.2   11.8  ?     ?   572.535   81.2927      539.612    81.2927      27.8001    -98.7073     
1 1 1 28  4  1  o 0 2083.1  37.1  ?     ?   1029.04   37.5091      1076.13    37.5091      54.4631    37.5091      
1 1 1 28  4  2  o 0 1229.8  22.8  ?     ?   771.098   130.253      835.908    130.253      69.1177    130.253      
1 1 1 28  4  3  o 0 5299.2  89.8  ?     ?   1629.34   89.0946      1752.02    89.0946      129.637    89.0946      
1 1 1 28  4  4  o 0 990.7   19    ?     ?   410.45    161.419      947.918    161.419      554.654    161.419      
1 1 1 28  4  5  o 0 479.2   9.9   ?     ?   425.53    142.063      510.958    142.063      103.004    142.063      
1 1 1 28  4  6  f 1 2155.7  53.6  ?     ?   1055.62   107.935      1018.59    107.935      1.22568    107.935      
1 1 1 28  4  7  o 0 362.7   11.5  ?     ?   340       93.709       452.97     93.709       127.087    93.709       
1 1 1 28  4  8  o 0 140.7   8.6   ?     ?   280.306   173.052      173.025    173.052      95.4048    -6.94787     
1 1 1 28  4  9  o 0 498.4   19.3  ?     ?   421.778   107.259      534.167    107.259      136.092    107.259      
1 1 1 28  4  10 o 0 5.7     8.3   ?     ?   152.171   -177.782     117.124    2.2181       260.457    2.2181       
1 1 1 28  4  11 o 0 730.6   21.6  ?     ?   605.595   -97.7312     605.463    -97.7312     28.1281    -97.7312     
1 1 1 28  4  12 o 0 163.3   10.8  ?     ?   374.969   -108.813     154.959    -108.813     201.406    71.1869      
1 1 1 28  4  13 o 0 355.7   13    ?     ?   600.548   21.7853      255.65     21.7853      301.185    -158.215     
1 1 1 28  4  14 f 1 665.8   17.4  ?     ?   432.974   -24.0885     704.519    -24.0885     302.673    -24.0885     
1 1 1 28  4  15 o 0 41      11    ?     ?   142.358   103.166      22.6609    103.166      109.32     -76.8342     
1 1 1 28  4  16 o 0 125.6   13.6  ?     ?   192.199   -53.0576     281.103    -53.0576     80.948     -53.0576     
1 1 1 28  4  17 o 0 227.9   15.9  ?     ?   252.275   -39.092      446.375    -39.092      189.698    -39.092      
1 1 1 28  4  18 o 0 92.8    16.2  ?     ?   211.494   -65.7691     216.685    -65.7691     6.38471    -65.7691     
1 1 1 28  4  19 o 0 54.8    20.6  ?     ?   220.394   -13.7081     94.7817    -13.7081     117.513    166.292      
1 1 1 28  4  20 o 0 145.8   21.7  ?     ?   196.583   -105.526     348.988    -105.526     160.242    -105.526     
1 1 1 28  4  21 f 1 9.5     21.6  ?     ?   159.256   22.238       7.94379    -157.762     161.836    -157.762     
1 1 1 28  4  22 o 0 37      24.6  ?     ?   109.766   -51.5574     104.713    -51.5574     8.94589    128.443      
1 1 1 28  4  23 o 0 -6.4    29.6  ?     ?   54.5122   -59.1018     28.0081    -59.1018     26.4951    120.898      
1 1 1 28  4  24 o 0 21.6    27.3  ?     ?   121.422   21.001       68.2802    21.001       49.5699    -158.999     
1 1 1 28  4  25 o 0 40.4    22.8  ?     ?   175.121   -46.5512     86.3746    -46.5512     80.2505    133.449      
1 1 1 -28 6  25 < 0 14.2    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 6  24 o 0 28      9.1   ?     ?   128.143   39.0359      83.662     39.0359      28.5334    -140.964     
1 1 1 -28 6  23 o 0 13.9    7.4   ?     ?   70.8959   75.5879      24.0801    75.5879      39.5489    -104.412     
1 1 1 -28 6  22 o 0 5.7     8.5   ?     ?   149.051   95.2423      55.6427    -84.7577     198.62     -84.7577     
1 1 1 -28 6  21 o 0 158     8.6   ?     ?   215.77    -91.4393     349.721    -91.4393     142.059    -91.4393     
1 1 1 -28 6  20 o 0 74.5    7     ?     ?   114.484   -109.665     224.843    -109.665     122.287    -109.665     
1 1 1 -28 6  19 f 1 124.4   6.6   ?     ?   261.386   -101.933     242.369    -101.933     6.73227    -101.933     
1 1 1 -28 6  18 o 0 116.3   6     ?     ?   294.257   -96.0549     202.593    -96.0549     62.8292    83.9451      
1 1 1 -28 6  17 f 1 99.3    6.1   ?     ?   171.504   -2.81119     249.095    -2.81119     88.1878    -2.81119     
1 1 1 -28 6  16 o 0 234.8   6.8   ?     ?   331.172   -122.68      366.595    -122.68      49.5197    -122.68      
1 1 1 -28 6  15 o 0 36      4.5   ?     ?   194.346   151.306      13.7497    151.306      177.171    -28.694      
1 1 1 -28 6  14 o 0 127.7   4.7   ?     ?   153.805   129.227      229.316    129.227      94.4725    129.227      
1 1 1 -28 6  13 o 0 962     18.3  ?     ?   580.894   -160.338     774.8      -160.338     261.856    -160.338     
1 1 1 -28 6  12 o 0 176.3   4.9   ?     ?   351.158   -29.1971     200.368    -29.1971     109.087    150.803      
1 1 1 -28 6  11 o 0 651.5   12.8  ?     ?   480.749   -60.5149     628.98     -60.5149     202.679    -60.5149     
1 1 1 -28 6  10 o 0 67      3.6   ?     ?   42.4066   5.12035      22.1819    5.12035      16.4433    -174.88      
1 1 1 -28 6  9  o 0 191     5.9   ?     ?   260.05    -47.2454     269.78     -47.2454     31.666     -47.2454     
1 1 1 -28 6  8  o 0 71.1    3.7   ?     ?   281.323   103.783      14.0305    103.783      247.937    -76.2166     
1 1 1 -28 6  7  o 0 345.8   7     ?     ?   557.555   -54.7653     245.89     -54.7653     261.86     125.235      
1 1 1 -28 6  6  o 0 1066.6  22    ?     ?   550.732   -97.6121     854.73     -97.6121     351.243    -97.6121     
1 1 1 -28 6  5  o 0 425.6   12.3  ?     ?   431.757   -64.2488     438.616    -64.2488     42.5383    -64.2488     
1 1 1 -28 6  4  o 0 2237.7  56    ?     ?   870.625   175.246      1201.02    175.246      389.365    175.246      
1 1 1 -28 6  3  o 0 638.1   22.1  ?     ?   646.549   -53.8882     454.11     -53.8882     150.204    126.112      
1 1 1 -28 6  2  o 0 166.5   8.7   ?     ?   343.115   28.0442      172.781    28.0442      148.622    -151.956     
1 1 1 -28 6  1  o 0 244.1   6.6   ?     ?   411.806   0.926873     238.843    0.926873     147.598    -179.073     
1 1 1 28  6  0  o 0 1.2     1.7   ?     ?   142.289   -1.51411     128.246    178.486      261.866    178.486      
1 1 1 28  6  1  o 0 1543.8  28.1  ?     ?   945.901   -70.4138     795.66     -70.4138     93.9777    109.586      
1 1 1 28  6  2  o 0 3874.6  66.3  ?     ?   1438.44   -168.839     1338.13    -168.839     16.4291    11.161       
1 1 1 28  6  3  o 0 1493    27.1  ?     ?   662.215   141.951      1026.87    141.951      402.689    141.951      
1 1 1 28  6  4  o 0 632     14.5  ?     ?   242.198   94.2597      775.622    94.2597      550.186    94.2597      
1 1 1 28  6  5  o 0 66.6    3.9   ?     ?   191.931   -7.41949     39.2587    -7.41949     139.415    172.581      
1 1 1 28  6  6  o 0 166.5   6.5   ?     ?   156.775   9.05063      248.777    9.05063      102.877    9.05063      
1 1 1 28  6  7  o 0 440.3   11.5  ?     ?   404.767   -1.92007     481.523    -1.92007     105.131    -1.92007     
1 1 1 28  6  8  o 0 855.2   18.2  ?     ?   397.179   97.5634      869.258    97.5634      490.449    97.5634      
1 1 1 28  6  9  o 0 34.9    10.1  ?     ?   337.622   -11.791      134.207    168.209      451.785    168.209      
1 1 1 28  6  10 o 0 590.7   15.2  ?     ?   284.161   -123.914     732.697    -123.914     466.032    -123.914     
1 1 1 28  6  11 o 0 121.2   8.9   ?     ?   286.553   -62.414      150.273    -62.414      112.279    117.586      
1 1 1 28  6  12 o 0 530.3   16.8  ?     ?   680.676   -50.5697     366.479    -50.5697     255.071    129.43       
1 1 1 28  6  13 o 0 297     12.4  ?     ?   416.824   -56.4204     338.032    -56.4204     44.4167    123.58       
1 1 1 28  6  14 o 0 24.7    10.5  ?     ?   106.407   -169.063     6.40503    10.9373      116.154    10.9373      
1 1 1 28  6  15 o 0 846.1   25.1  ?     ?   481.231   116.248      903.895    116.248      409.992    116.248      
1 1 1 28  6  16 o 0 236.6   15.1  ?     ?   371.821   -163.336     347.937    -163.336     24.9872    16.6643      
1 1 1 28  6  17 f 1 128.8   17.3  ?     ?   56.7167   -38.9187     309.937    -38.9187     254.045    -38.9187     
1 1 1 28  6  18 o 0 54.3    18.5  ?     ?   130       -120.438     149.171    -120.438     25.6767    -120.438     
1 1 1 28  6  19 f 1 333.3   24.9  ?     ?   473.343   -90.5588     400.383    -90.5588     50.2097    89.4412      
1 1 1 28  6  20 o 0 112.7   26.7  ?     ?   361.365   -115.044     125.184    -115.044     217.56     64.9561      
1 1 1 28  6  21 o 0 23      26.5  ?     ?   164.015   121.619      37.4962    121.619      131.34     -58.3807     
1 1 1 28  6  22 o 0 45.8    32.6  ?     ?   104.47    120.528      140.836    120.528      37.753     120.528      
1 1 1 28  6  23 o 0 -1.5    31.2  ?     ?   182.613   -149.859     7.8257     30.1413      182.767    30.1413      
1 1 1 28  6  24 o 0 22.6    25.6  ?     ?   157.251   165.788      51.4787    165.788      96.2193    -14.2122     
1 1 1 -28 8  24 < 0 45      11.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 8  23 o 0 -11.9   10.1  ?     ?   67.2748   -178.03      21.0472    1.96963      78.8687    1.96963      
1 1 1 -28 8  22 o 0 117.5   10.7  ?     ?   269.212   171.015      231.87     171.015      1.66752    -8.98519     
1 1 1 -28 8  21 o 0 39.7    9.1   ?     ?   127.008   3.36145      123.533    3.36145      8.25172    3.36145      
1 1 1 -28 8  20 o 0 26.8    7.3   ?     ?   158.68    -58.3433     48.7582    -58.3433     101.885    121.657      
1 1 1 -28 8  19 f 1 58.9    7.4   ?     ?   50.7877   -59.8546     170.575    -59.8546     121.979    -59.8546     
1 1 1 -28 8  18 o 0 46.3    6.3   ?     ?   211.092   84.2512      83.5872    84.2512      103.344    -95.7488     
1 1 1 -28 8  17 f 1 83.9    5.5   ?     ?   390.403   82.3361      44.2553    82.3361      303.448    -97.6639     
1 1 1 -28 8  16 o 0 296.5   8.5   ?     ?   378.222   70.8116      421.821    70.8117      84.9779    70.8117      
1 1 1 -28 8  15 o 0 566.8   14.1  ?     ?   494.991   -161.255     612.026    -161.255     156.118    -161.255     
1 1 1 -28 8  14 o 0 445.9   10.1  ?     ?   510.201   19.1923      469.084    19.1923      12.6252    -160.808     
1 1 1 -28 8  13 o 0 118.7   4.7   ?     ?   104.503   179.037      261.79     179.037      160.617    179.037      
1 1 1 -28 8  12 o 0 176.5   5.3   ?     ?   251.985   171.519      322.028    171.519      76.3571    171.519      
1 1 1 -28 8  11 o 0 840.3   16.2  ?     ?   487.801   114.254      754.09     114.254      330.128    114.254      
1 1 1 -28 8  10 o 0 25.6    2.7   ?     ?   122.873   -122.889     20.5876    57.1111      128.028    57.1111      
1 1 1 -28 8  9  o 0 248.2   6     ?     ?   530.657   49.5653      166.099    49.5653      296.457    -130.435     
1 1 1 -28 8  8  o 0 112.5   3.6   ?     ?   233.667   130.736      153.552    130.736      51.1703    -49.2641     
1 1 1 -28 8  7  o 0 151.1   4     ?     ?   174.36    -123.621     244.093    -123.621     90.6221    -123.621     
1 1 1 -28 8  6  o 0 214.5   5.6   ?     ?   332.114   150.714      258.307    150.714      41.4835    -29.2864     
1 1 1 -28 8  5  o 0 329.8   7.1   ?     ?   444.773   41.8464      326.994    41.8464      75.9782    -138.154     
1 1 1 -28 8  4  o 0 798.4   15.6  ?     ?   665.041   74.5663      579.646    74.5663      24.8488    -105.434     
1 1 1 -28 8  3  o 0 119.6   3.8   ?     ?   270.861   -41.7478     135.094    -41.7478     111.797    138.252      
1 1 1 -28 8  2  o 0 368.1   12.4  ?     ?   614.225   126.198      233.392    126.198      327.795    -53.8018     
1 1 1 -28 8  1  o 0 3921.4  115.9 ?     ?   1044.3    107.649      1732.04    107.649      776.075    107.649      
1 1 1 28  8  0  o 0 230.7   6.1   ?     ?   465.921   166.327      185.005    166.327      243.5      -13.6734     
1 1 1 28  8  1  o 0 1224.8  23.2  ?     ?   823.219   154.758      741.978    154.758      16.0472    -25.2419     
1 1 1 28  8  2  o 0 396.6   9     ?     ?   261.22    -66.3223     540.7      -66.3223     299.959    -66.3223     
1 1 1 28  8  3  o 0 1391.7  26.1  ?     ?   587.384   -2.13829     1050.35    -2.13829     508.745    -2.13829     
1 1 1 28  8  4  o 0 185.3   6.7   ?     ?   530.238   -2.90375     63.1789    -2.90375     425.782    177.096      
1 1 1 28  8  5  o 0 974.8   20.1  ?     ?   682.682   40.4113      701.87     40.4113      72.5346    40.4113      
1 1 1 28  8  6  o 0 237.6   9.7   ?     ?   250.721   154.116      346.916    154.116      115.964    154.116      
1 1 1 28  8  7  o 0 473.8   12.2  ?     ?   459.324   -126.449     492.347    -126.449     78.5675    -126.449     
1 1 1 28  8  8  o 0 839.6   19    ?     ?   636.251   102.321      657.929    102.321      85.7501    102.321      
1 1 1 28  8  9  o 0 706.5   18.1  ?     ?   491.594   156.839      672.942    156.839      231.829    156.839      
1 1 1 28  8  10 o 0 154     8.8   ?     ?   362.564   -108.067     166.491    -108.067     160.801    71.9333      
1 1 1 28  8  11 o 0 148.2   10.5  ?     ?   273.903   -124.81      219.953    -124.81      26.51      55.1904      
1 1 1 28  8  12 o 0 42.8    10.1  ?     ?   164.464   -47.5768     54.0521    -47.5768     112.421    132.423      
1 1 1 28  8  13 o 0 320.9   14.2  ?     ?   556.1     -156.304     292.988    -156.304     257.745    23.6955      
1 1 1 28  8  14 o 0 25      12.9  ?     ?   46.1128   -123.851     14.0261    -123.851     31.427     56.1493      
1 1 1 28  8  15 o 0 122.5   16.3  ?     ?   113.273   -34.669      333.393    -34.669      224.175    -34.669      
1 1 1 28  8  16 o 0 -2.9    16.6  ?     ?   56.8824   -151.202     13.4862    28.7975      66.6641    28.7975      
1 1 1 28  8  17 f 1 38.2    15.1  ?     ?   131.798   117.36       90.2582    117.36       33.2948    -62.6395     
1 1 1 28  8  18 o 0 -7.1    17.9  ?     ?   91.6808   102.199      21.239     -77.8009     106.927    -77.8009     
1 1 1 28  8  19 f 1 44.3    25.9  ?     ?   138.324   94.8512      109.629    94.8512      30.4409    -85.1488     
1 1 1 28  8  20 o 0 290.9   33.1  ?     ?   296.168   166.243      488.264    166.243      189.896    166.243      
1 1 1 28  8  21 o 0 147.6   30.2  ?     ?   230.34    148.392      318.127    148.392      100.295    148.392      
1 1 1 28  8  22 o 0 153.9   35.5  ?     ?   206.68    -177.164     336.801    -177.164     145.492    -177.164     
1 1 1 -28 10 22 < 0 5.2     9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 10 21 o 0 106.3   10.3  ?     ?   223.951   -164.575     240.159    -164.575     51.0512    -164.575     
1 1 1 -28 10 20 o 0 113.6   9.2   ?     ?   178.761   -179.784     290.307    -179.784     138.045    -179.784     
1 1 1 -28 10 19 o 0 41.8    7.3   ?     ?   153.237   -175.795     119.503    -175.795     14.1342    4.2046       
1 1 1 -28 10 18 f 1 37.1    7.4   ?     ?   122.063   -1.5417      111.84     -1.5417      2.38242    178.458      
1 1 1 -28 10 17 o 0 101.8   7.3   ?     ?   201.928   -61.4986     238.062    -61.4986     49.678     -61.4986     
1 1 1 -28 10 16 o 0 49.8    5.9   ?     ?   151.358   -132.383     131.582    -132.383     0.311965   -132.383     
1 1 1 -28 10 15 o 0 8.8     5.2   ?     ?   152.208   151.114      57.8017    -28.886      189.799    -28.886      
1 1 1 -28 10 14 o 0 43.5    4.9   ?     ?   149.684   -49.4063     109.424    -49.4063     21.4513    130.594      
1 1 1 -28 10 13 o 0 214.8   6.3   ?     ?   265.637   -50.6841     392.383    -50.6841     159.206    -50.6841     
1 1 1 -28 10 12 f 1 199.1   6.2   ?     ?   326.351   100.281      311.132    100.281      13.6886    100.281      
1 1 1 -28 10 11 o 0 150.2   5.2   ?     ?   354.768   46.5147      196.858    46.5147      132.519    -133.485     
1 1 1 -28 10 10 o 0 150.2   5     ?     ?   228.363   151.572      300.295    151.572      86.9369    151.572      
1 1 1 -28 10 9  o 0 144.4   4.7   ?     ?   187.925   -90.4        299.641    -90.4        119.902    -90.4        
1 1 1 -28 10 8  o 0 27.9    2.7   ?     ?   136.668   118.889      4.31494    118.889      127.1      -61.1109     
1 1 1 -28 10 7  o 0 7.7     2.5   ?     ?   78.1705   63.2571      49.9707    -116.743     125.503    -116.743     
1 1 1 -28 10 6  o 0 498.2   11.2  ?     ?   482.952   101.876      474.808    101.876      59.6935    101.876      
1 1 1 -28 10 5  o 0 363.5   8.8   ?     ?   356.225   126.557      440.278    126.557      132.888    126.557      
1 1 1 -28 10 4  o 0 29.7    2.7   ?     ?   277.304   -64.1007     75.8352    115.899      315.951    115.899      
1 1 1 -28 10 3  o 0 232.8   7.1   ?     ?   289.095   -73.4951     332.238    -73.4951     81.1616    -73.4951     
1 1 1 -28 10 2  o 0 171.8   5.4   ?     ?   321.98    -97.17       219.909    -97.17       60.4391    82.83        
1 1 1 -28 10 1  f 1 34      3.6   ?     ?   142.829   -102.159     0.573395   -102.159     124.69     77.841       
1 1 1 28  10 0  o 0 112.5   4.8   ?     ?   297.171   -39.4461     133.431    -39.4461     128.314    140.554      
1 1 1 28  10 1  f 1 574.2   12.5  ?     ?   550.76    109.344      498.203    109.344      10.1769    109.344      
1 1 1 28  10 2  o 0 699.5   16.1  ?     ?   552.166   -140.237     604.626    -140.237     117.615    -140.237     
1 1 1 28  10 3  o 0 358.3   9.3   ?     ?   510.19    -60.1206     321.48     -60.1206     128.556    119.879      
1 1 1 28  10 4  o 0 434.8   12.9  ?     ?   445.132   159.018      455.537    159.018      63.0098    159.018      
1 1 1 28  10 5  o 0 153.7   9.1   ?     ?   145.729   -84.2172     278.125    -84.2172     149.713    -84.2172     
1 1 1 28  10 6  o 0 579.5   14.5  ?     ?   529.57    -77.371      521.62     -77.371      55.531     -77.371      
1 1 1 28  10 7  o 0 541.7   13.9  ?     ?   541.508   -91.7308     542.657    -91.7308     5.41623    -91.7308     
1 1 1 28  10 8  o 0 62      8.3   ?     ?   127.149   -84.6358     125.884    -84.6358     0.00281198 -84.6358     
1 1 1 28  10 9  o 0 61      7.9   ?     ?   174.348   140.579      135.053    140.579      34.1043    -39.4209     
1 1 1 28  10 10 o 0 132.1   11.7  ?     ?   330.608   55.1413      189.055    55.1413      130.728    -124.859     
1 1 1 28  10 11 o 0 216.1   11.5  ?     ?   371.274   97.1277      313.949    97.1277      37.9185    -82.8723     
1 1 1 28  10 12 f 1 36.6    12    ?     ?   330.964   69.8573      65.6479    -110.143     379.654    -110.143     
1 1 1 28  10 13 o 0 56.2    12.6  ?     ?   137.935   -160.115     158.241    -160.115     31.8562    -160.115     
1 1 1 28  10 14 o 0 83.6    12.6  ?     ?   175.334   -114.023     216.024    -114.023     55.5709    -114.023     
1 1 1 28  10 15 o 0 7.2     14.8  ?     ?   77.1919   -93.6783     1.0944     86.3217      71.9648    86.3217      
1 1 1 28  10 16 o 0 45      19.6  ?     ?   175.589   96.1225      92.1725    96.1226      81.7896    -83.8774     
1 1 1 28  10 17 o 0 3.6     21.9  ?     ?   90.027    29.6838      20.6127    29.6838      68.676     -150.316     
1 1 1 28  10 18 f 1 6.5     22.3  ?     ?   43.7513   -140.32      26.5038    -140.32      15.3553    39.6804      
1 1 1 28  10 19 o 0 15.8    23.5  ?     ?   100.534   17.9365      54.8992    17.9365      38.1185    -162.063     
1 1 1 28  10 20 o 0 47.5    26.6  ?     ?   111.745   2.35365      143.095    2.35365      41.8388    2.35365      
1 1 1 -28 12 19 < 0 62.9    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 12 18 o 0 7.2     8.6   ?     ?   76.1409   97.5903      12.4932    97.5903      50.7408    -82.4097     
1 1 1 -28 12 17 o 0 46.4    8.1   ?     ?   137.874   -90.3501     145.9      -90.3501     30.5305    -90.3501     
1 1 1 -28 12 16 o 0 36.4    7.1   ?     ?   125.05    -156.585     115.02     -156.585     8.00675    -156.585     
1 1 1 -28 12 15 o 0 28.2    7.3   ?     ?   51.5362   -80.3327     77.4294    -80.3327     31.9865    -80.3327     
1 1 1 -28 12 14 o 0 49.4    6     ?     ?   202.607   20.3512      98.5108    20.3512      87.924     -159.649     
1 1 1 -28 12 13 o 0 -0.4    6.8   ?     ?   28.5424   80.8605      15.0654    -99.1395     41.3412    -99.1395     
1 1 1 -28 12 12 o 0 2.1     5.3   ?     ?   198.634   -91.8163     116.943    88.1837      286.655    88.1837      
1 1 1 -28 12 11 o 0 188.3   6.8   ?     ?   273.029   18.3329      334.423    18.3329      99.5147    18.3329      
1 1 1 -28 12 10 f 1 10.8    4.3   ?     ?   136.853   124.214      37.2789    -55.7856     155.366    -55.7856     
1 1 1 -28 12 9  o 0 203.9   7     ?     ?   493.917   -148.432     183.939    -148.432     241.031    31.5681      
1 1 1 -28 12 8  o 0 243.6   8     ?     ?   386.176   -178.059     332.432    -178.059     1.68402    1.94108      
1 1 1 -28 12 7  o 0 200.4   6.8   ?     ?   420.247   -129.908     242.148    -129.908     123.293    50.0922      
1 1 1 -28 12 6  o 0 853.5   17.5  ?     ?   629.55    -99.7995     717.541    -99.7995     153.53     -99.7995     
1 1 1 -28 12 5  o 0 164.2   5.5   ?     ?   216.134   -44.335      338.606    -44.335      144.173    -44.335      
1 1 1 -28 12 4  o 0 401.8   10.7  ?     ?   395.425   17.0469      518.081    17.0469      161.056    17.0469      
1 1 1 -28 12 3  o 0 21.1    4.1   ?     ?   179.944   35.3145      8.99256    -144.685     171.981    -144.685     
1 1 1 -28 12 2  o 0 176.2   6.6   ?     ?   250.849   135.773      325.882    135.773      94.1778    135.773      
1 1 1 -28 12 1  o 0 82.7    5.9   ?     ?   325.418   112.942      77.9028    112.942      223.365    -67.0582     
1 1 1 28  12 0  o 0 60.9    5.2   ?     ?   167.756   69.0202      134.38     69.0202      23.1896    -110.98      
1 1 1 28  12 1  o 0 70.8    5.3   ?     ?   270.801   -10.4187     92.6323    -10.4187     161.867    169.581      
1 1 1 28  12 2  o 0 66.7    6.3   ?     ?   276.711   -66.3276     76.3191    -66.3276     183.777    113.672      
1 1 1 28  12 3  o 0 44.2    6.1   ?     ?   118.456   7.79874      113.553    7.79874      4.09707    7.79874      
1 1 1 28  12 4  o 0 489.8   12.8  ?     ?   559.026   104.632      479.884    104.632      36.3198    -75.3676     
1 1 1 28  12 5  o 0 4.1     6.5   ?     ?   81.3724   87.8865      44.611     -92.1135     119.667    -92.1135     
1 1 1 28  12 6  o 0 11      7.9   ?     ?   127.553   -67.5506     40.2577    112.449      157.727    112.449      
1 1 1 28  12 7  o 0 49.5    8.1   ?     ?   297.242   1.72577      26.7591    1.72577      239.633    -178.274     
1 1 1 28  12 8  o 0 86.9    9.2   ?     ?   310.747   -115.517     119.81     -115.517     158.001    64.4834      
1 1 1 28  12 9  o 0 179.3   11.2  ?     ?   321.531   108.122      294.298    108.122      6.60824    108.122      
1 1 1 28  12 10 f 1 146.8   12    ?     ?   371.868   48.0525      191.89     48.0526      141.415    -131.947     
1 1 1 28  12 11 o 0 23.9    12.3  ?     ?   22.4853   56.9437      19.4367    56.9437      0.711358   -123.056     
1 1 1 28  12 12 o 0 69.8    13.7  ?     ?   107.562   147.58       223.825    147.58       119.653    147.58       
1 1 1 28  12 13 o 0 92.2    15.2  ?     ?   141.137   148.125      263.43     148.126      127.399    148.126      
1 1 1 28  12 14 o 0 0.5     10.3  ?     ?   51.083    21.3978      14.0729    -158.602     63.4165    -158.602     
1 1 1 28  12 15 o 0 43.9    22    ?     ?   95.8162   -98.3161     134.74     -98.3161     45.8148    -98.3161     
1 1 1 28  12 16 o 0 36.2    23.1  ?     ?   143.002   -164.536     85.9288    -164.536     43.217     15.4641      
1 1 1 28  12 17 o 0 161.2   27.6  ?     ?   229.029   -102.297     335.44     -102.297     132.655    -102.297     
1 1 1 28  12 18 < 0 34.2    26.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 14 15 < 1 23.9    9.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 14 14 o 0 28.5    7.8   ?     ?   159.95    -112.068     69.5614    -112.068     60.7426    67.9322      
1 1 1 -28 14 13 o 0 4.9     7.4   ?     ?   46.4908   -11.7423     2.51424    168.258      40.6112    168.258      
1 1 1 -28 14 12 o 0 19.3    6.9   ?     ?   90.7296   111.781      48.0131    111.781      27.8954    -68.2192     
1 1 1 -28 14 11 o 0 53.7    6.8   ?     ?   113.637   113.605      175.708    113.605      79.9498    113.605      
1 1 1 -28 14 10 o 0 110.5   7.3   ?     ?   241.414   -72.8218     223.373    -72.8218     14.2159    -72.8218     
1 1 1 -28 14 9  o 0 156.3   8.4   ?     ?   282.934   -80.3788     268.389    -80.3788     13.1363    -80.3788     
1 1 1 -28 14 8  f 1 54.5    5.8   ?     ?   115.771   -65.4127     171.16     -65.4127     65.5747    -65.4127     
1 1 1 -28 14 7  o 0 5.8     5.5   ?     ?   96.2914   -83.8556     38.3013    96.1444      125.478    96.1444      
1 1 1 -28 14 6  o 0 32.9    5.4   ?     ?   113.799   178.41       93.4355    178.41       10.0866    -1.59047     
1 1 1 -28 14 5  o 0 72.9    6.1   ?     ?   210.797   -145.695     157.744    -145.695     34.8468    34.305       
1 1 1 -28 14 4  o 0 30.6    5.4   ?     ?   71.712    87.3896      79.2182    87.3896      15.6973    87.3896      
1 1 1 -28 14 3  o 0 315.9   10.6  ?     ?   320.346   5.09844      464.044    5.09844      192.47     5.09844      
1 1 1 -28 14 2  o 0 138.7   9.2   ?     ?   194.162   35.3047      304.405    35.3047      139.321    35.3047      
1 1 1 -28 14 1  o 0 196.4   10.1  ?     ?   281.923   -171.827     335.927    -171.827     95.6325    -171.827     
1 1 1 28  14 0  o 0 20.4    6.4   ?     ?   149.008   -56.1615     18.3642    -56.1615     111.143    123.839      
1 1 1 28  14 1  o 0 41.1    7.1   ?     ?   166.587   29.2378      93.8188    29.2378      51.0056    -150.762     
1 1 1 28  14 2  o 0 86.3    8.7   ?     ?   230.764   29.9336      175.665    29.9336      24.9224    -150.066     
1 1 1 28  14 3  o 0 119.1   9.1   ?     ?   281.906   6.35965      206.966    6.35965      37.935     -173.64      
1 1 1 28  14 4  o 0 0.9     8.8   ?     ?   22.1181   84.283       8.45458    -95.717      29.2918    -95.717      
1 1 1 28  14 5  o 0 383.8   14.5  ?     ?   385.317   -13.4531     512.826    -13.4531     150.344    -13.4531     
1 1 1 28  14 6  o 0 41      10.1  ?     ?   67.4418   24.3219      124.34     24.3219      61.0148    24.3219      
1 1 1 28  14 7  o 0 105.3   13.6  ?     ?   168.923   -157.195     271.298    -157.195     111.868    -157.195     
1 1 1 28  14 8  f 1 66      10.9  ?     ?   147.012   -153.455     189.609    -153.455     50.5342    -153.455     
1 1 1 28  14 9  o 0 53.2    15    ?     ?   211.096   -173.967     102.071    -173.967     89.295     6.03285      
1 1 1 28  14 10 o 0 -33.9   16.6  ?     ?   59.7004   -59.8389     26.071     120.161      79.991     120.161      
1 1 1 28  14 11 o 0 51.1    17.9  ?     ?   163.808   -28.8814     126.155    -28.8814     18.1039    151.119      
1 1 1 28  14 12 o 0 28.5    14.9  ?     ?   93.7394   2.84129      90.5407    2.84129      9.44101    2.84129      
1 1 1 28  14 13 o 0 107.5   20.9  ?     ?   211.66    -85.5538     245.644    -85.5538     63.0459    -85.5538     
1 1 1 28  14 14 < 0 11.7    21.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 28  14 15 < 1 0       12.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 16 9  < 0 43      9.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 16 8  < 0 28.8    7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -28 16 7  o 0 32.5    8     ?     ?   138.365   -30.2796     97.7565    -30.2796     13.2064    149.72       
1 1 1 -28 16 6  o 0 3.3     7.7   ?     ?   80.2394   146.374      6.06377    -33.6256     70.7337    -33.6256     
1 1 1 -28 16 5  o 0 197.9   10.7  ?     ?   297.855   116.688      331.123    116.688      89.9774    116.688      
1 1 1 -28 16 4  o 0 37.3    8.9   ?     ?   117.133   87.234       122.064    87.234       27.0619    87.234       
1 1 1 -28 16 3  o 0 9       8.4   ?     ?   87.9669   -122.836     6.0412     -122.836     65.5615    57.1643      
1 1 1 -28 16 2  o 0 86.2    10.4  ?     ?   272.671   -124.673     149.721    -124.673     72.9194    55.3273      
1 1 1 -28 16 1  o 0 33.3    10.5  ?     ?   78.085    -37.6346     114.077    -37.6346     50.149     -37.6346     
1 1 1 28  16 0  o 0 121.2   11.2  ?     ?   221.093   24.9131      268.436    24.9131      82.9509    24.9131      
1 1 1 28  16 1  o 0 126.6   11.2  ?     ?   219.181   16.1354      280.456    16.1354      96.5772    16.1354      
1 1 1 28  16 2  o 0 -6.5    11.5  ?     ?   64.3537   164.944      13.5805    -15.0555     67.5456    -15.0555     
1 1 1 28  16 3  o 0 14.9    13.2  ?     ?   54.2061   83.6275      37.9654    83.6275      7.45072    -96.3725     
1 1 1 28  16 4  o 0 2.2     13.3  ?     ?   77.1887   18.9249      5.76023    18.9249      58.8275    -161.075     
1 1 1 28  16 5  o 0 16.4    13.4  ?     ?   96.6793   -144.271     51.008     -144.271     29.9287    35.7289      
1 1 1 28  16 6  o 0 28.2    13.6  ?     ?   23.6604   -172.257     61.6224    -172.257     41.858     -172.257     
1 1 1 28  16 7  < 0 -4.9    11.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 28  16 8  < 0 122     19.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 28  16 9  < 0 64.6    20    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 1  26 o 0 67.5    10.9  ?     ?   221.98    158.472      157.747    158.472      40.6045    -21.5281     
1 1 1 -29 1  25 f 1 245.4   11.6  ?     ?   279.158   133.749      451.036    133.749      194.597    133.749      
1 1 1 -29 1  24 o 0 149.5   9.6   ?     ?   230.645   -141.229     331.703    -141.229     113.991    -141.229     
1 1 1 -29 1  23 o 0 3       8     ?     ?   38.8286   -160.896     14.7262    19.1035      52.7812    19.1035      
1 1 1 -29 1  22 o 0 163.7   8.1   ?     ?   240.824   33.8683      337.828    33.8683      118.132    33.8683      
1 1 1 -29 1  21 o 0 31.6    6.1   ?     ?   137.947   80.0306      72.4466    80.0306      53.551     -99.9694     
1 1 1 -29 1  20 o 0 13.1    4.7   ?     ?   110.412   155.002      14.9451    -24.9979     116.372    -24.9979     
1 1 1 -29 1  19 o 0 415.2   10.5  ?     ?   404.555   160.053      542.345    160.053      151.231    160.053      
1 1 1 -29 1  18 o 0 113.6   5.1   ?     ?   197.288   -173.565     259.702    -173.565     67.3277    -173.565     
1 1 1 -29 1  17 o 0 166.4   6.1   ?     ?   303.145   142.293      270.021    142.293      33.2728    -37.7067     
1 1 1 -29 1  16 o 0 516.7   10.8  ?     ?   557.45    173.978      448.687    173.978      49.0447    -6.02169     
1 1 1 -29 1  15 o 0 44.9    4.3   ?     ?   74.5928   116.852      12.7853    116.852      53.7111    -63.1475     
1 1 1 -29 1  14 o 0 746.3   19.7  ?     ?   502.589   21.061       681.451    21.061       220.831    21.061       
1 1 1 -29 1  13 o 0 4.4     3     ?     ?   358.689   81.5476      298.289    -98.4524     629.054    -98.4524     
1 1 1 -29 1  12 o 0 984     18.3  ?     ?   710.306   -2.01298     680.267    -2.01298     13.5691    -2.01298     
1 1 1 -29 1  11 o 0 134     5.3   ?     ?   332.974   23.2601      121.247    23.2601      184.649    -156.74      
1 1 1 -29 1  10 o 0 240.3   6.3   ?     ?   372.933   25.8976      264.672    25.8976      79.5394    -154.102     
1 1 1 -29 1  9  o 0 242.6   7.6   ?     ?   353.972   -6.20299     282.133    -6.20299     50.2848    173.797      
1 1 1 -29 1  8  o 0 1654.8  37.3  ?     ?   974.202   104.128      831.622    104.128      86.7003    -75.8719     
1 1 1 -29 1  7  o 0 738.4   15.6  ?     ?   618.302   -48.4381     568.646    -48.4381     16.139     131.562      
1 1 1 -29 1  6  o 0 1751.8  32.4  ?     ?   1159.1    -55.3057     768.933    -55.3057     374.86     124.694      
1 1 1 -29 1  5  o 0 463.3   8.7   ?     ?   464.143   -175.997     489.759    -175.997     30.5422    -175.997     
1 1 1 -29 1  4  o 0 315.7   6.7   ?     ?   368.197   -8.93211     398.654    -8.93211     33.5073    -8.93211     
1 1 1 -29 1  3  o 0 719.4   12.8  ?     ?   652.536   174.216      564.868    174.216      83.6452    -5.78397     
1 1 1 -29 1  2  o 0 595     12.8  ?     ?   411.295   63.1019      672.971    63.1019      263.406    63.1019      
1 1 1 -29 1  1  o 0 1016.4  23.3  ?     ?   745.474   60.0592      714.306    60.0592      29.3998    -119.941     
1 1 1 29  1  0  o 0 594.3   18.3  ?     ?   582.52    -44.1172     518.728    -44.1172     62.658     135.883      
1 1 1 29  1  1  o 0 345.5   7.6   ?     ?   664.529   -90.1912     171.731    -90.1912     492.722    89.8088      
1 1 1 29  1  2  o 0 2089.1  37.5  ?     ?   1221.64   127.98       898.983    127.98       324.602    -52.0198     
1 1 1 29  1  3  o 0 1300.5  24.7  ?     ?   1022.1    -146.248     644.933    -146.248     380.345    33.7515      
1 1 1 29  1  4  o 0 246.6   6.8   ?     ?   313.066   -85.6074     350.094    -85.6074     35.6699    -85.6074     
1 1 1 29  1  5  o 0 350.3   9.2   ?     ?   448.624   -75.2978     379.237    -75.2978     71.7269    104.702      
1 1 1 29  1  6  o 0 365     10.3  ?     ?   537.524   -149.423     308.788    -149.423     238.307    30.5771      
1 1 1 29  1  7  o 0 1701.5  35.4  ?     ?   1043.32   160.854      813.062    160.854      195.514    -19.1459     
1 1 1 29  1  8  o 0 784.2   16.1  ?     ?   672.591   103.567      568.348    103.567      81.4859    -76.4325     
1 1 1 29  1  9  o 0 233.9   11.1  ?     ?   257.662   -0.909134    343.959    -0.909134    95.2879    -0.909134    
1 1 1 29  1  10 o 0 992.3   21    ?     ?   646.243   48.6737      752.851    48.6737      138.291    48.6737      
1 1 1 29  1  11 o 0 640.4   16.4  ?     ?   462.048   151.041      636.45     151.041      198.018    151.041      
1 1 1 29  1  12 o 0 342.5   12.1  ?     ?   304.409   171.094      471.164    171.094      178.871    171.094      
1 1 1 29  1  13 o 0 103.2   12.1  ?     ?   451.504   -122.795     25.6138    57.2052      457.729    57.2052      
1 1 1 29  1  14 o 0 128.7   11.9  ?     ?   363.517   160.501      114.256    160.501      225.112    -19.4985     
1 1 1 29  1  15 o 0 129.2   12.9  ?     ?   258.333   -82.4708     184.824    -82.4707     55.3131    97.5293      
1 1 1 29  1  16 o 0 62.4    14.2  ?     ?   44.8305   -4.43425     44.8414    -4.43425     3.0047     -4.43425     
1 1 1 29  1  17 o 0 119.1   15.2  ?     ?   262.629   48.0943      215.618    48.0943      59.6596    -131.906     
1 1 1 29  1  18 o 0 380.4   19.7  ?     ?   204.172   175.51       707.664    175.51       498.596    175.51       
1 1 1 29  1  19 o 0 573.4   22.4  ?     ?   511.875   168.65       653.235    168.65       141.009    168.65       
1 1 1 29  1  20 o 0 112.6   19.1  ?     ?   279.837   103.93       214.852    103.93       56.4087    -76.0703     
1 1 1 29  1  21 o 0 88.5    25.2  ?     ?   214.393   -3.7477      200.126    -3.7477      7.02199    176.252      
1 1 1 29  1  22 o 0 -15.4   26.1  ?     ?   40.5374   -48.0399     2.34669    -48.0399     38.7701    131.96       
1 1 1 29  1  23 o 0 97.4    28.6  ?     ?   98.2753   118.37       309.576    118.37       206.399    118.37       
1 1 1 29  1  24 o 0 -4.8    32.7  ?     ?   48.3252   150.776      31.7592    150.776      16.8684    -29.2241     
1 1 1 29  1  25 f 1 68.7    25.6  ?     ?   116.251   50.715       216.437    50.715       103.776    50.715       
1 1 1 29  1  26 < 0 5.1     23.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 3  26 < 0 59.9    10.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 3  25 o 0 77.6    11    ?     ?   200.153   134.57       199.77     134.57       21.4767    134.57       
1 1 1 -29 3  24 o 0 59.6    9.2   ?     ?   143.88    58.1899      182.759    58.1899      48.59      58.1899      
1 1 1 -29 3  23 o 0 118.2   9.6   ?     ?   194.928   29.9489      290.699    29.9489      100.483    29.9489      
1 1 1 -29 3  22 o 0 8.9     6.9   ?     ?   81.3709   -162.094     16.3758    17.9057      96.0386    17.9057      
1 1 1 -29 3  21 o 0 79.2    6.8   ?     ?   133.081   -104.564     228.041    -104.564     107.83     -104.564     
1 1 1 -29 3  20 f 1 19.8    5.7   ?     ?   90.5469   22.5602      26.4539    22.5602      56.2585    -157.44      
1 1 1 -29 3  19 o 0 96.4    6     ?     ?   292.09    -144.64      153.078    -144.64      121.725    35.3603      
1 1 1 -29 3  18 o 0 257     9.1   ?     ?   192.917   139.175      513.516    139.175      327.275    139.175      
1 1 1 -29 3  17 o 0 20      4.7   ?     ?   119.362   -175.181     23.7314    4.81888      142.01     4.81888      
1 1 1 -29 3  16 o 0 30.6    4.7   ?     ?   94.3842   116.56       0.852591   -63.4396     84.3531    -63.4396     
1 1 1 -29 3  15 o 0 1384.9  29.5  ?     ?   772.865   -127.811     881.61     -127.811     192.688    -127.811     
1 1 1 -29 3  14 o 0 3696.2  72.8  ?     ?   1285.94   -109.968     1454.73    -109.968     310.351    -109.968     
1 1 1 -29 3  13 o 0 962.5   20.6  ?     ?   539.401   -163.329     810.377    -163.329     316.904    -163.329     
1 1 1 -29 3  12 o 0 835.8   16.7  ?     ?   665.965   -71.5399     614.682    -71.5399     1.6931     -71.5399     
1 1 1 -29 3  11 o 0 623.8   12.5  ?     ?   629.293   -11.4929     458.066    -11.4929     115.994    168.507      
1 1 1 -29 3  10 o 0 984.2   18.3  ?     ?   821.569   -33.7346     566.913    -33.7346     186.408    146.265      
1 1 1 -29 3  9  o 0 215.5   6     ?     ?   349.542   -132.498     245.618    -132.498     76.3868    47.5017      
1 1 1 -29 3  8  o 0 2903.2  49.9  ?     ?   1233.05   -109.376     1160.29    -109.376     4.53508    -109.376     
1 1 1 -29 3  7  f 1 169.9   4.2   ?     ?   202.708   14.1061      258.201    14.1061      66.5026    14.1061      
1 1 1 -29 3  6  f 1 817     14.8  ?     ?   778.405   -72.6857     481.411    -72.6857     257.189    107.314      
1 1 1 -29 3  5  o 0 464.2   8.8   ?     ?   715.484   135.552      248.144    135.552      465.077    -44.4482     
1 1 1 -29 3  4  o 0 2737.9  59.2  ?     ?   1014.48   -98.1415     1392.36    -98.1415     390.531    -98.1415     
1 1 1 -29 3  3  o 0 272.4   6.5   ?     ?   132.269   -70.081      442.774    -70.081      311.852    -70.081      
1 1 1 -29 3  2  o 0 1323.4  27.3  ?     ?   711.46    -101.569     951.159    -101.569     245.513    -101.569     
1 1 1 -29 3  1  o 0 55.5    2.1   ?     ?   277.222   -126.655     21.1163    53.3447      296.565    53.3447      
1 1 1 29  3  0  o 0 22.8    2.2   ?     ?   40.0406   2.60832      16.7969    -177.392     56.5364    -177.392     
1 1 1 29  3  1  o 0 1966.2  35.3  ?     ?   1012.18   -29.0166     1033.75    -29.0166     27.3243    -29.0166     
1 1 1 29  3  2  o 0 1351.6  24.4  ?     ?   517.516   24.2565      1154.86    24.2565      639.423    24.2565      
1 1 1 29  3  3  o 0 430.4   9.2   ?     ?   290.623   98.8459      600.715    98.8459      310.841    98.8459      
1 1 1 29  3  4  o 0 44.1    2.9   ?     ?   251.053   -62.1653     44.4744    117.835      295.161    117.835      
1 1 1 29  3  5  o 0 252.1   6.9   ?     ?   230.212   139.548      383.231    139.548      162.089    139.548      
1 1 1 29  3  6  f 1 1820.5  46.6  ?     ?   966.256   92.4258      938.445    92.4258      5.20354    92.4258      
1 1 1 29  3  7  f 1 5.6     5     ?     ?   201.103   97.4616      166.311    -82.5384     360.506    -82.5384     
1 1 1 29  3  8  o 0 501.5   15.9  ?     ?   689.515   76.9873      300.24     76.9873      361.713    -103.013     
1 1 1 29  3  9  o 0 1086.4  25.3  ?     ?   761.614   36.8777      709.866    36.8777      10.8771    -143.122     
1 1 1 29  3  10 o 0 176     8.8   ?     ?   259.493   163.165      246.642    163.165      1.518      163.165      
1 1 1 29  3  11 o 0 1505.4  31.3  ?     ?   810.722   -148.522     944.514    -148.522     159.877    -148.522     
1 1 1 29  3  12 o 0 430     13.7  ?     ?   517.179   -102.525     398.937    -102.525     94.1748    77.4752      
1 1 1 29  3  13 o 0 119.2   11    ?     ?   324.002   11.0021      123.303    11.0021      178.144    -168.998     
1 1 1 29  3  14 o 0 300.3   12.9  ?     ?   446.855   -12.8749     317.152    -12.8749     96.9446    167.125      
1 1 1 29  3  15 o 0 4.5     11.2  ?     ?   60.285    -156.653     38.496     23.347       94.5984    23.347       
1 1 1 29  3  16 o 0 92      12.2  ?     ?   11.0024   157.31       35.5657    157.31       24.0623    157.31       
1 1 1 29  3  17 o 0 23.6    15    ?     ?   266.628   -73.2086     100.534    106.791      377.785    106.791      
1 1 1 29  3  18 o 0 104.1   18.6  ?     ?   166.486   -150.491     262.52     -150.491     93.4297    -150.491     
1 1 1 29  3  19 o 0 0.9     13.5  ?     ?   86.6467   169.903      34.6677    -10.097      120.649    -10.097      
1 1 1 29  3  20 f 1 112.3   20.6  ?     ?   186.156   -78.9217     285.563    -78.9217     105.061    -78.9217     
1 1 1 29  3  21 o 0 10.1    22.8  ?     ?   177.848   -95.4754     13.7621    84.5246      185.582    84.5246      
1 1 1 29  3  22 o 0 96.3    23.5  ?     ?   279.473   -97.1729     164.435    -97.1729     126.427    82.8271      
1 1 1 29  3  23 o 0 89.9    29.6  ?     ?   172.874   -90.1346     218.595    -90.1346     38.7782    -90.1346     
1 1 1 29  3  24 o 0 90.7    30.2  ?     ?   153.617   42.3256      243.359    42.3256      93.44      42.3256      
1 1 1 29  3  25 o 0 95.1    28.4  ?     ?   264.179   -73.8146     166.779    -73.8146     86.0173    106.185      
1 1 1 -29 5  25 o 0 152.9   9.8   ?     ?   210.366   76.5871      353.108    76.5871      169.13     76.5871      
1 1 1 -29 5  24 o 0 5.6     8.9   ?     ?   114.449   161.964      16.5975    -18.0365     117.663    -18.0365     
1 1 1 -29 5  23 o 0 75.3    7.7   ?     ?   177.018   118.305      204.6      118.305      40.9735    118.305      
1 1 1 -29 5  22 o 0 30.5    7     ?     ?   111.609   168.064      94.7985    168.064      13.1515    -11.9356     
1 1 1 -29 5  21 o 0 349.2   11.5  ?     ?   367.221   -79.0524     514.448    -79.0524     170.328    -79.0524     
1 1 1 -29 5  20 o 0 119.7   6.9   ?     ?   128.718   -104.657     321.736    -104.657     206.512    -104.657     
1 1 1 -29 5  19 o 0 94.9    5.9   ?     ?   86.153    -141.872     269.737    -141.872     192.152    -141.872     
1 1 1 -29 5  18 o 0 150.1   6.3   ?     ?   200.058   -130.597     336.414    -130.597     149.924    -130.597     
1 1 1 -29 5  17 o 0 131.5   5.1   ?     ?   155.426   50.5253      317.202    50.5253      168.543    50.5253      
1 1 1 -29 5  16 o 0 124.5   5.7   ?     ?   222.389   -109.291     245.039    -109.291     26.7255    -109.291     
1 1 1 -29 5  15 o 0 43.9    4.3   ?     ?   114.168   -169.234     67.6135    -169.234     45.3559    10.7658      
1 1 1 -29 5  14 o 0 47.9    4.3   ?     ?   87.6319   27.1297      40.1135    27.1297      37.26      -152.87      
1 1 1 -29 5  13 o 0 50.1    3.9   ?     ?   22.7605   -112.439     7.58997    -112.439     12.4717    67.5609      
1 1 1 -29 5  12 o 0 352.1   8.5   ?     ?   500.949   -26.49       322.594    -26.49       121.848    153.51       
1 1 1 -29 5  11 o 0 139     4.5   ?     ?   315.166   -52.8366     146.968    -52.8366     140.332    127.163      
1 1 1 -29 5  10 o 0 31.4    2.6   ?     ?   270.428   126.163      101.275    -53.8369     349.173    -53.8369     
1 1 1 -29 5  9  o 0 804.9   15.4  ?     ?   462.801   -40.8097     758.841    -40.8097     327.26     -40.8097     
1 1 1 -29 5  8  o 0 185.2   4.4   ?     ?   127.287   -136.58      261.206    -136.58      145.086    -136.58      
1 1 1 -29 5  7  o 0 103.6   3.6   ?     ?   389.8     138.557      19.4497    138.557      337.649    -41.4433     
1 1 1 -29 5  6  f 1 520.5   11.5  ?     ?   581.97    -91.6045     401.533    -91.6045     143.468    88.3955      
1 1 1 -29 5  5  o 0 1707.7  43.6  ?     ?   893.315   -19.3653     925.88     -19.3653     90.8177    -19.3653     
1 1 1 -29 5  4  o 0 193.1   6.9   ?     ?   313.75    17.2733      237.398    17.2733      56.7494    -162.727     
1 1 1 -29 5  3  o 0 1057.3  29.5  ?     ?   566.123   -23.9622     842.73     -23.9622     310.631    -23.9622     
1 1 1 -29 5  2  o 0 21.6    3.5   ?     ?   186.056   38.0359      91.5345    -141.964     266.788    -141.964     
1 1 1 -29 5  1  o 0 89.6    3.9   ?     ?   153.066   -109.792     104.302    -109.792     40.1397    70.2082      
1 1 1 29  5  0  o 0 797.1   17.7  ?     ?   765.345   -114.121     481.328    -114.121     240.827    65.879       
1 1 1 29  5  1  o 0 1097.1  20.4  ?     ?   816.86    -68.2388     648.757    -68.2388     123.292    111.761      
1 1 1 29  5  2  o 0 4015.9  68.9  ?     ?   1335.47   145.836      1490.53    145.836      226.533    145.836      
1 1 1 29  5  3  o 0 2151.9  37.9  ?     ?   1149.25   90.9029      923.421    90.9029      165.543    -89.0971     
1 1 1 29  5  4  o 0 1005.3  18.9  ?     ?   714.107   80.0698      682.547    80.0698      5.38213    80.0698      
1 1 1 29  5  5  o 0 15.1    4.1   ?     ?   219.564   -170.47      138.608    9.52977      346.889    9.52977      
1 1 1 29  5  6  f 1 440.6   9.7   ?     ?   470.272   -139.533     429.867    -139.533     12.6617    40.4673      
1 1 1 29  5  7  o 0 377.7   12.1  ?     ?   145.361   99.3807      542.036    99.3807      406.027    99.3807      
1 1 1 29  5  8  o 0 831.4   19.2  ?     ?   596.36    172.95       666.892    172.95       109.487    172.95       
1 1 1 29  5  9  o 0 263.8   9.4   ?     ?   481.827   -29.4825     218.648    -29.4825     243.126    150.518      
1 1 1 29  5  10 o 0 291.7   10.2  ?     ?   257.519   46.412       428.043    46.412       184.71     46.412       
1 1 1 29  5  11 o 0 214.2   10.9  ?     ?   251.935   -49.9127     318.754    -49.9127     81.3286    -49.9127     
1 1 1 29  5  12 o 0 63.4    10    ?     ?   254.105   -35.8205     28.9082    -35.8205     204.828    144.179      
1 1 1 29  5  13 o 0 310.3   13.2  ?     ?   248.909   -18.139      469.312    -18.139      241.203    -18.139      
1 1 1 29  5  14 o 0 224.8   12.3  ?     ?   396.798   20.0451      256.303    20.0451      108.973    -159.955     
1 1 1 29  5  15 o 0 0.6     12.6  ?     ?   72.0941   25.6866      46.6697    -154.313     121.251    -154.313     
1 1 1 29  5  16 o 0 450.1   19.8  ?     ?   457.184   -30.1472     556.618    -30.1472     94.3388    -30.1472     
1 1 1 29  5  17 o 0 146.8   16.2  ?     ?   289.475   -5.89382     273.058    -5.89382     13.1178    174.106      
1 1 1 29  5  18 o 0 21.7    17.6  ?     ?   158.856   21.2614      4.2941     21.2614      151.787    -158.739     
1 1 1 29  5  19 o 0 172.1   20.4  ?     ?   328.6     -52.1416     289.676    -52.1416     24.2499    127.858      
1 1 1 29  5  20 o 0 15.3    19.4  ?     ?   83.6795   -3.85372     30.0951    -3.85372     49.9813    176.146      
1 1 1 29  5  21 o 0 22.4    26.8  ?     ?   229.045   23.7558      21.2411    -156.244     257.399    -156.244     
1 1 1 29  5  22 o 0 112.9   26.9  ?     ?   260.159   39.4829      215.023    39.4829      53.1046    -140.517     
1 1 1 29  5  23 o 0 110.9   28.1  ?     ?   189.046   32.7939      280.604    32.7939      97.7747    32.7939      
1 1 1 29  5  24 o 0 38.2    28    ?     ?   188.117   27.0475      68.1632    27.0475      109.844    -152.953     
1 1 1 29  5  25 < 0 3.1     24    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 7  24 < 0 2.5     10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 7  23 o 0 65.7    9.7   ?     ?   163.968   115.524      191.144    115.524      48.7549    115.524      
1 1 1 -29 7  22 o 0 59.6    8.9   ?     ?   30.4401   13.1842      148.416    13.1842      121.326    13.1842      
1 1 1 -29 7  21 o 0 10.8    7.1   ?     ?   93.2009   9.79495      5.66648    -170.205     94.2953    -170.205     
1 1 1 -29 7  20 o 0 10.9    7     ?     ?   35.9119   -56.9044     0.264246   -56.9044     33.9903    123.096      
1 1 1 -29 7  19 o 0 55.5    6.2   ?     ?   144.114   63.796       156.526    63.796       28.6098    63.796       
1 1 1 -29 7  18 o 0 245.9   8.2   ?     ?   367.297   -6.03072     358.436    -6.03072     32.1215    -6.03072     
1 1 1 -29 7  17 o 0 614.2   13.5  ?     ?   487.811   -36.5168     671.92     -36.5168     236.179    -36.5168     
1 1 1 -29 7  16 o 0 186.8   6.4   ?     ?   343.005   -103.945     284.04     -103.945     32.9327    76.0545      
1 1 1 -29 7  15 o 0 79.7    4.4   ?     ?   217.207   -75.3552     158.094    -75.3552     47.7347    104.645      
1 1 1 -29 7  14 o 0 636.1   13.1  ?     ?   363.462   -20.1196     783.865    -20.1196     430.571    -20.1196     
1 1 1 -29 7  13 o 0 796.5   15    ?     ?   578.857   -122.101     732.315    -122.101     165.501    -122.101     
1 1 1 -29 7  12 f 1 838.3   16.1  ?     ?   836.535   -97.6488     460.699    -97.6488     273.54     82.3512      
1 1 1 -29 7  11 f 1 851.9   16.1  ?     ?   485.041   155.1        771.253    155.1        342.787    155.1        
1 1 1 -29 7  10 o 0 15.5    2.4   ?     ?   179.34    -76.9908     94.8108    103.009      251.985    103.009      
1 1 1 -29 7  9  o 0 1761.7  33.1  ?     ?   829.606   112.867      1035.09    112.867      304.04     112.867      
1 1 1 -29 7  8  o 0 66.5    2.8   ?     ?   359.182   -125.136     43.1214    54.864       367.987    54.864       
1 1 1 -29 7  7  o 0 547.7   10.8  ?     ?   580.907   -59.7378     442.102    -59.7378     85.6914    120.262      
1 1 1 -29 7  6  o 0 495.3   10.9  ?     ?   629.834   -7.27268     352.61     -7.27268     221.971    172.727      
1 1 1 -29 7  5  o 0 2045.1  51.6  ?     ?   895.332   -15.8137     1106.09    -15.8137     276.415    -15.8137     
1 1 1 -29 7  4  o 0 1066.4  29.6  ?     ?   438.917   -117.74      936.8      -117.74      539.499    -117.74      
1 1 1 -29 7  3  o 0 1031    40.4  ?     ?   663.852   -15.3246     728.218    -15.3246     125.657    -15.3246     
1 1 1 -29 7  2  o 0 12.5    1.6   ?     ?   46.5659   91.9248      29.9896    -88.0752     72.3546    -88.0752     
1 1 1 -29 7  1  o 0 68.2    2.6   ?     ?   297.374   62.2849      2.99977    -117.715     274.066    -117.715     
1 1 1 29  7  0  o 0 1038.1  20.4  ?     ?   795.356   88.1866      624.668    88.1866      102.603    -91.8134     
1 1 1 29  7  1  o 0 205.4   5.8   ?     ?   338.944   168.103      236.551    168.103      73.8052    -11.8972     
1 1 1 29  7  2  o 0 1111.8  20.7  ?     ?   661.93    18.516       791.191    18.516       184.446    18.516       
1 1 1 29  7  3  o 0 859.6   18.2  ?     ?   493.328   -21.0867     762.093    -21.0867     309.571    -21.0867     
1 1 1 29  7  4  o 0 168.5   5.5   ?     ?   263.08    -159.722     231.33     -159.722     16.5841    20.2777      
1 1 1 29  7  5  o 0 247.6   7.7   ?     ?   216.889   -80.6218     379.522    -80.6217     177.599    -80.6217     
1 1 1 29  7  6  o 0 1103.6  23.5  ?     ?   482.913   -52.0016     968.754    -52.0016     519.395    -52.0016     
1 1 1 29  7  7  o 0 373.3   10.5  ?     ?   516.569   -13.4908     327.161    -13.4908     153.04     166.509      
1 1 1 29  7  8  o 0 122.2   7.7   ?     ?   217.096   -87.0535     165.666    -87.0535     35.8477    92.9465      
1 1 1 29  7  9  o 0 293.2   10.4  ?     ?   344.006   -116.875     381.013    -116.875     68.9663    -116.875     
1 1 1 29  7  10 o 0 284.9   9.7   ?     ?   355.666   161.696      360.751    161.696      38.9278    161.696      
1 1 1 29  7  11 f 1 245.8   11.8  ?     ?   280.886   -61.549      370.929    -61.549      113.996    -61.549      
1 1 1 29  7  12 f 1 372.8   12.1  ?     ?   410.772   -13.2505     427.65     -13.2505     53.2217    -13.2505     
1 1 1 29  7  13 o 0 75.5    10.8  ?     ?   139.414   -137.764     169.41     -137.764     27.2299    -137.764     
1 1 1 29  7  14 o 0 492.4   17.4  ?     ?   488.304   123.157      567.519    123.157      80.4212    123.157      
1 1 1 29  7  15 o 0 254.3   13.9  ?     ?   492.926   85.07        258.622    85.07        230.635    -94.93       
1 1 1 29  7  16 o 0 351.2   16.8  ?     ?   439.88    91.3764      451.53     91.3764      24.563     91.3764      
1 1 1 29  7  17 o 0 84.9    16.1  ?     ?   244.522   -91.1703     172.368    -91.1703     57.6947    88.8297      
1 1 1 29  7  18 o 0 22.1    17.2  ?     ?   78.5559   -21.8052     36.9822    -21.8052     36.7328    158.195      
1 1 1 29  7  19 o 0 0.4     19.9  ?     ?   27.7353   -41.5474     2.64728    -41.5474     23.4274    138.453      
1 1 1 29  7  20 o 0 138.4   20.3  ?     ?   182.996   125.074      350.615    125.074      163.826    125.074      
1 1 1 29  7  21 o 0 148.1   25.3  ?     ?   298.156   114.585      266.334    114.585      25.4923    -65.4154     
1 1 1 29  7  22 o 0 102     30.4  ?     ?   111.725   -54.5211     292.494    -54.5211     186.289    -54.5211     
1 1 1 29  7  23 o 0 26.5    27.7  ?     ?   145.358   -48.0905     70.4551    -48.0905     65.0645    131.909      
1 1 1 -29 9  22 o 0 74.6    10.5  ?     ?   239.288   146.895      155.27     146.895      47.8606    -33.1047     
1 1 1 -29 9  21 o 0 19.9    8.2   ?     ?   11.1682   -157.66      15.98      -157.66      6.4136     -157.66      
1 1 1 -29 9  20 o 0 93.9    8.1   ?     ?   144.82    163.699      270.861    163.699      143.807    163.699      
1 1 1 -29 9  19 o 0 9.8     6.7   ?     ?   69.4003   -128.253     3.92348    51.7469      68.9435    51.7469      
1 1 1 -29 9  18 o 0 47      5.9   ?     ?   107.324   -160.814     151.313    -160.814     50.5167    -160.814     
1 1 1 -29 9  17 o 0 8       5.7   ?     ?   39.5064   97.8683      10.0272    -82.1317     44.5325    -82.1317     
1 1 1 -29 9  16 o 0 89.7    5.8   ?     ?   299.778   -139.039     132.735    -139.039     129.169    40.9608      
1 1 1 -29 9  15 f 1 32      5.7   ?     ?   102.935   164.906      77.6737    164.906      13.153     -15.0943     
1 1 1 -29 9  14 o 0 180.8   5.7   ?     ?   340.817   -34.7432     270.927    -34.7432     38.3931    145.257      
1 1 1 -29 9  13 o 0 273.7   7.3   ?     ?   313.881   42.3145      435.813    42.3145      148.758    42.3145      
1 1 1 -29 9  12 o 0 79.9    4     ?     ?   212.269   -141.251     160.268    -141.251     38.5747    38.749       
1 1 1 -29 9  11 o 0 283.7   6.8   ?     ?   296.407   44.0501      445.947    44.0501      161.459    44.0501      
1 1 1 -29 9  10 f 1 83.3    3.5   ?     ?   157.048   -69.7916     178.853    -69.7916     26.402     -69.7916     
1 1 1 -29 9  9  o 0 26.3    2.6   ?     ?   148.718   -126.201     26.0737    53.7985      154.01     53.7985      
1 1 1 -29 9  8  o 0 354.4   8.1   ?     ?   464.111   110.764      347.866    110.764      53.4967    -69.2362     
1 1 1 -29 9  7  f 1 38.7    2.4   ?     ?   182.603   48.0127      4.20365    48.0127      155.285    -131.987     
1 1 1 -29 9  6  o 0 39.8    2.4   ?     ?   152.1     135.355      4.97102    -44.645      136.559    -44.645      
1 1 1 -29 9  5  o 0 428.3   9.3   ?     ?   225.649   -15.6622     587.202    -15.6622     391.231    -15.6622     
1 1 1 -29 9  4  o 0 1026.2  19.5  ?     ?   557.591   -78.7558     830.955    -78.7558     345.053    -78.7558     
1 1 1 -29 9  3  o 0 801.9   27.1  ?     ?   451.282   166.741      760.315    166.741      365.895    166.741      
1 1 1 -29 9  2  o 0 2971.6  78.7  ?     ?   1013.82   144.922      1399.39    144.922      511.09     144.922      
1 1 1 -29 9  1  f 1 2388    73.2  ?     ?   963.358   -173.751     1201.74    -173.751     351.57     -173.751     
1 1 1 29  9  0  o 0 139.1   6.2   ?     ?   458.053   -40.5577     56.6471    -40.5577     348.593    139.442      
1 1 1 29  9  1  f 1 383.1   12.8  ?     ?   278.441   31.6008      520.372    31.6008      272.506    31.6008      
1 1 1 29  9  2  o 0 196.6   6     ?     ?   401.473   -156.096     196.514    -156.096     159.294    23.9039      
1 1 1 29  9  3  o 0 326.3   9.4   ?     ?   442.336   36.6529      338.871    36.6529      53.2751    -143.347     
1 1 1 29  9  4  o 0 1219.3  24.5  ?     ?   676.647   76.422       869.235    76.422       269.416    76.422       
1 1 1 29  9  5  o 0 593.8   14.4  ?     ?   592.619   110.441      487.098    110.441      37.9655    -69.5587     
1 1 1 29  9  6  o 0 158.1   8.4   ?     ?   173.613   -133.103     286.775    -133.103     131.753    -133.103     
1 1 1 29  9  7  f 1 392     10.7  ?     ?   416.128   -154.306     437.443    -154.306     64.4924    -154.306     
1 1 1 29  9  8  o 0 305.9   10.2  ?     ?   491.657   115.909      278.03     115.909      159.536    -64.0911     
1 1 1 29  9  9  o 0 41.6    7     ?     ?   127.968   -27.7044     59.2911    -27.7044     68.9976    152.296      
1 1 1 29  9  10 f 1 218.5   9.9   ?     ?   440.741   -34.0072     233.797    -34.0072     209.06     145.993      
1 1 1 29  9  11 o 0 111.4   10.8  ?     ?   158.263   -42.4452     277.885    -42.4452     122.956    -42.4452     
1 1 1 29  9  12 o 0 218.5   11.6  ?     ?   204.85    -81.0639     450.255    -81.0639     250.486    -81.0639     
1 1 1 29  9  13 o 0 27.3    12.6  ?     ?   68.6596   -166.216     39.2366    -166.216     26.3184    13.7843      
1 1 1 29  9  14 o 0 63.9    14.1  ?     ?   202.224   141.692      144.71     141.692      42.6626    -38.3084     
1 1 1 29  9  15 f 1 116.7   17.7  ?     ?   207.368   74.5383      270.234    74.5383      77.3996    74.5383      
1 1 1 29  9  16 o 0 123.5   20.1  ?     ?   278.625   103.868      227.104    103.868      31.4366    -76.1323     
1 1 1 29  9  17 o 0 48.6    20.4  ?     ?   93.9353   73.6706      148.772    73.6706      54.7383    73.6706      
1 1 1 29  9  18 o 0 44.5    22.4  ?     ?   112.674   172.559      130.73     172.559      17.8461    172.559      
1 1 1 29  9  19 o 0 45.6    29.5  ?     ?   103.788   -134.894     133.736    -134.894     33.9674    -134.894     
1 1 1 29  9  20 o 0 140.2   31    ?     ?   295.997   -169.92      238.801    -169.921     37.707     10.0795      
1 1 1 29  9  21 o 0 50.9    29.6  ?     ?   173.344   -163.307     113.874    -163.307     45.0334    16.6927      
1 1 1 -29 11 20 < 0 40.7    9.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 11 19 o 0 136.5   10    ?     ?   266.55    89.3303      265.114    89.3303      41.453     89.3303      
1 1 1 -29 11 18 o 0 91.6    8.6   ?     ?   275.953   49.1974      161.508    49.1974      74.966     -130.803     
1 1 1 -29 11 17 o 0 20      7.8   ?     ?   151.003   29.8961      19.7372    29.8961      113.707    -150.104     
1 1 1 -29 11 16 o 0 75.9    7     ?     ?   199.299   -131.63      176.147    -131.63      7.80791    48.3699      
1 1 1 -29 11 15 o 0 2.2     5     ?     ?   41.2767   -17.25       22.673     162.75       60.8215    162.75       
1 1 1 -29 11 14 o 0 104.3   6.6   ?     ?   245.464   -35.4121     213.085    -35.4121     7.84739    144.588      
1 1 1 -29 11 13 o 0 110.5   5.9   ?     ?   270.173   -122.647     199.157    -122.647     34.6168    57.3532      
1 1 1 -29 11 12 f 1 61.1    4.3   ?     ?   165.97    122.321      153.802    122.321      9.64818    122.321      
1 1 1 -29 11 11 o 0 79.9    4.6   ?     ?   149.917   179.489      212.798    179.489      82.8453    179.489      
1 1 1 -29 11 10 o 0 356.5   8.7   ?     ?   389.344   -174.87      477.732    -174.87      138.059    -174.87      
1 1 1 -29 11 9  o 0 463.6   11    ?     ?   504.958   -166.977     488.389    -166.977     33.9045    -166.977     
1 1 1 -29 11 8  o 0 95.7    4.4   ?     ?   133.575   -68.2252     252.719    -68.2252     131.835    -68.2252     
1 1 1 -29 11 7  o 0 101.2   4.2   ?     ?   281.151   24.4529      157.74     24.4529      102.321    -155.547     
1 1 1 -29 11 6  o 0 9.4     2.8   ?     ?   194.339   -145.836     100.779    34.1645      281.357    34.1645      
1 1 1 -29 11 5  o 0 266     7.3   ?     ?   341.698   130.033      393.14     130.033      74.3463    130.033      
1 1 1 -29 11 4  o 0 190.3   5.6   ?     ?   294.758   -48.7173     304.914    -48.7173     24.0173    -48.7173     
1 1 1 -29 11 3  o 0 113.8   4.9   ?     ?   244.628   -50.5552     200.609    -50.5552     33.2473    129.445      
1 1 1 -29 11 2  o 0 140.4   5.2   ?     ?   167.858   -58.1903     302.153    -58.1903     141.255    -58.1903     
1 1 1 -29 11 1  o 0 405.8   10.7  ?     ?   388.611   -49.1485     519.613    -49.1485     146.281    -49.1485     
1 1 1 29  11 0  o 0 33.2    4.3   ?     ?   282.379   -122.547     56.7005    57.4528      331.422    57.4528      
1 1 1 29  11 1  o 0 111.1   5.7   ?     ?   287.62    -126.132     165.057    -126.132     114.971    53.8683      
1 1 1 29  11 2  o 0 172.4   6.4   ?     ?   305.993   -58.3409     271.23     -58.3409     26.7907    121.659      
1 1 1 29  11 3  o 0 133     8.9   ?     ?   236.19    -17.8072     250.605    -17.8072     20.5804    -17.8072     
1 1 1 29  11 4  o 0 58.9    6.5   ?     ?   213.234   77.8313      102.776    77.8313      101.171    -102.169     
1 1 1 29  11 5  o 0 346.6   10.2  ?     ?   401.303   -58.6316     457.165    -58.6316     73.6849    -58.6316     
1 1 1 29  11 6  o 0 621.3   15.4  ?     ?   447.117   -57.0685     707.944    -57.0685     281.257    -57.0685     
1 1 1 29  11 7  o 0 37.4    7.5   ?     ?   88.5767   -20.4013     68.1413    -20.4013     16.2369    159.599      
1 1 1 29  11 8  o 0 107.4   8.5   ?     ?   218.438   -63.7959     235.529    -63.7959     31.3808    -63.7959     
1 1 1 29  11 9  o 0 357.7   14.2  ?     ?   419.816   69.9371      460.105    69.9371      68.8184    69.9371      
1 1 1 29  11 10 o 0 93.9    11.9  ?     ?   199.983   -7.35503     223.508    -7.35503     42.3344    -7.35503     
1 1 1 29  11 11 o 0 131.3   12.3  ?     ?   201.286   164.491      303.262    164.491      121.576    164.491      
1 1 1 29  11 12 f 1 71.5    12.4  ?     ?   159.125   -134.582     190.7      -134.582     46.3843    -134.582     
1 1 1 29  11 13 o 0 24.5    10.2  ?     ?   134.774   -126.902     39.1801    -126.902     82.9265    53.0975      
1 1 1 29  11 14 o 0 73.6    16.1  ?     ?   125.881   -31.8305     226.675    -31.8305     103.499    -31.8305     
1 1 1 29  11 15 o 0 71.1    19.4  ?     ?   193.409   44.8112      167.828    44.8112      21.7898    -135.189     
1 1 1 29  11 16 o 0 88.3    22.7  ?     ?   138.476   -140.427     249.902    -140.427     119.498    -140.427     
1 1 1 29  11 17 o 0 60.1    25    ?     ?   113.211   -112.352     178.056    -112.352     74.341     -112.352     
1 1 1 29  11 18 o 0 -7.1    30.7  ?     ?   45.0382   125.982      38.3362    125.982      2.10571    -54.018      
1 1 1 29  11 19 o 0 122.5   26.7  ?     ?   219.164   59.0349      268.393    59.0349      72.601     59.0349      
1 1 1 -29 13 17 < 0 75.9    9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 13 16 o 0 -5.3    7.8   ?     ?   23.2364   8.77452      6.37004    -171.225     25.4299    -171.225     
1 1 1 -29 13 15 f 1 6       7.5   ?     ?   103.952   -171.579     14.8231    8.42079      101.109    8.42079      
1 1 1 -29 13 14 o 0 63      7.5   ?     ?   156.426   -115.762     177.568    -115.762     45.5638    -115.762     
1 1 1 -29 13 13 o 0 32.9    6.6   ?     ?   20.2339   -153.374     46.413     -153.374     28.8334    -153.374     
1 1 1 -29 13 12 o 0 -5.1    7     ?     ?   111.014   124.402      63.947     -55.598      161.132    -55.598      
1 1 1 -29 13 11 o 0 35      6.1   ?     ?   94.7497   40.1067      113.214    40.1067      26.7646    40.1067      
1 1 1 -29 13 10 o 0 13      4.7   ?     ?   20.7418   70.9418      4.13851    70.9418      14.7702    -109.058     
1 1 1 -29 13 9  o 0 258.7   8.3   ?     ?   356.12    -138.244     371.478    -138.244     44.8268    -138.244     
1 1 1 -29 13 8  o 0 41.2    4.5   ?     ?   187.01    -176.821     80.3992    -176.821     78.5203    3.17862      
1 1 1 -29 13 7  o 0 32      4.3   ?     ?   96.9553   -5.33529     86.2636    -5.33529     3.44209    -5.33529     
1 1 1 -29 13 6  o 0 204.7   7.2   ?     ?   337.508   -39.7748     308.047    -39.7748     20.8879    -39.7748     
1 1 1 -29 13 5  o 0 377.7   9.9   ?     ?   457.354   51.2696      433.465    51.2696      42.6769    51.2696      
1 1 1 -29 13 4  o 0 140.2   6.2   ?     ?   172.635   1.81814      324.932    1.81814      176.862    1.81814      
1 1 1 -29 13 3  o 0 57.1    5.3   ?     ?   152.544   -160.083     149.12     -160.083     17.8452    -160.083     
1 1 1 -29 13 2  o 0 367     11.5  ?     ?   395.467   167.192      477.238    167.192      137.215    167.192      
1 1 1 -29 13 1  o 0 616.9   15    ?     ?   501.549   -174.624     638.954    -174.624     206.675    -174.624     
1 1 1 29  13 0  o 0 15.2    5.3   ?     ?   159.201   36.385       23.6526    -143.615     163.326    -143.615     
1 1 1 29  13 1  o 0 224.1   9.2   ?     ?   267.758   -26.0117     404.144    -26.0117     169.124    -26.0117     
1 1 1 29  13 2  o 0 77.5    6.4   ?     ?   109.548   -62.9643     222.267    -62.9643     126.109    -62.9643     
1 1 1 29  13 3  o 0 31.7    7.8   ?     ?   177.997   -102.819     48.8202    -102.819     107.947    77.1813      
1 1 1 29  13 4  o 0 145.7   9     ?     ?   159.84    -34.7425     350.679    -34.7425     210.018    -34.7425     
1 1 1 29  13 5  o 0 134.4   9.6   ?     ?   384.429   -25.9345     157.814    -25.9345     180.069    154.066      
1 1 1 29  13 6  o 0 24.3    7.1   ?     ?   85.9063   22.7856      46.9594    22.7856      28.4182    -157.214     
1 1 1 29  13 7  o 0 62.9    10.2  ?     ?   79.206    170.968      187.899    170.968      117.941    170.968      
1 1 1 29  13 8  o 0 54.5    10.4  ?     ?   230.444   -130.573     91.9179    -130.573     111.093    49.427       
1 1 1 29  13 9  o 0 33      9.8   ?     ?   93.0664   -141.712     100.374    -141.712     11.6452    -141.712     
1 1 1 29  13 10 o 0 -0.8    13.8  ?     ?   121.903   -33.4035     37.6317    146.597      153.446    146.597      
1 1 1 29  13 11 o 0 99.5    16.2  ?     ?   282.744   -44.1606     162.377    -44.1606     107.186    135.839      
1 1 1 29  13 12 o 0 88.8    20.8  ?     ?   194.73    -128.627     211.383    -128.627     32.7774    -128.627     
1 1 1 29  13 13 o 0 118.6   20.3  ?     ?   170.383   -96.2981     301.776    -96.2981     149.508    -96.2981     
1 1 1 29  13 14 o 0 34.3    15.2  ?     ?   187.709   -54.3933     57.906     -54.3933     106.772    125.607      
1 1 1 29  13 15 f 1 22.3    12.5  ?     ?   136.431   -55.4729     53.8693    -55.4729     66.0076    124.527      
1 1 1 29  13 16 < 0 -21.3   24.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 29  13 17 < 0 29.9    27.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 15 12 < 0 7.3     8.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 15 11 f 1 49.7    8.1   ?     ?   107.547   -46.4611     172.872    -46.4611     85.8639    -46.4611     
1 1 1 -29 15 10 o 0 26.4    7.3   ?     ?   90.506    -102.738     100.844    -102.738     27.4989    -102.738     
1 1 1 -29 15 9  o 0 -1.1    6.1   ?     ?   17.155    57.0297      6.48249    -122.97      20.4418    -122.97      
1 1 1 -29 15 8  o 0 125.4   8.2   ?     ?   225.972   -21.1043     268.311    -21.1043     83.3513    -21.1043     
1 1 1 -29 15 7  o 0 42.8    6.1   ?     ?   110.615   -92.7533     141.414    -92.7533     49.1825    -92.7533     
1 1 1 -29 15 6  o 0 36.6    6.6   ?     ?   194.689   -159.961     69.3714    -159.962     93.7635    20.0385      
1 1 1 -29 15 5  o 0 173     8.7   ?     ?   271.924   -155.983     309.709    -155.983     75.9665    -155.983     
1 1 1 -29 15 4  o 0 101     7.7   ?     ?   187.616   -15.0497     243.197    -15.0497     81.2802    -15.0497     
1 1 1 -29 15 3  o 0 73.1    7.5   ?     ?   188.704   48.0955      177.722    48.0955      14.2905    48.0955      
1 1 1 -29 15 2  o 0 2.9     6.7   ?     ?   118.989   -59.9128     49.4512    120.087      152.821    120.087      
1 1 1 -29 15 1  o 0 163.4   9.6   ?     ?   283.54    -88.3308     287.836    -88.3308     40.8709    -88.3308     
1 1 1 29  15 0  o 0 280.2   12.1  ?     ?   382.113   -85.0372     385.953    -85.0372     45.4259    -85.0372     
1 1 1 29  15 1  o 0 -2.1    8.2   ?     ?   139.986   17.951       70.1382    -162.049     194.909    -162.049     
1 1 1 29  15 2  o 0 34.9    10.1  ?     ?   153.547   64.6462      84.8092    64.6462      52.012     -115.354     
1 1 1 29  15 3  o 0 298.6   18.1  ?     ?   313.089   64.6932      466.228    64.6932      187.436    64.6932      
1 1 1 29  15 4  o 0 161.3   12.5  ?     ?   235.036   81.1406      329.546    81.1406      120.491    81.1406      
1 1 1 29  15 5  o 0 32.6    12.1  ?     ?   192.911   10.361       39.2719    10.361       132.047    -169.639     
1 1 1 29  15 6  o 0 286.8   16.9  ?     ?   314.34    25.3053      454.336    25.3053      181.547    25.3053      
1 1 1 29  15 7  o 0 56.2    14.1  ?     ?   155.517   147.515      156.336    147.515      21.7063    147.515      
1 1 1 29  15 8  o 0 56.3    15    ?     ?   120.176   -25.8044     181.562    -25.8044     79.1813    -25.8044     
1 1 1 29  15 9  o 0 128.6   15.9  ?     ?   193.115   161.519      303.731    161.519      139.763    161.519      
1 1 1 29  15 10 o 0 126     18    ?     ?   222.94    -166.67      273.747    -166.67      84.7521    -166.67      
1 1 1 29  15 11 < 1 30.8    16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 29  15 12 < 0 0.1     17.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -29 17 1  < 0 39.7    10.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 29  17 0  < 0 105.6   12.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 0  26 o 0 67.9    12.9  ?     ?   163.721   180          183.705    180          37.5905    180          
1 1 1 -30 0  25 o 0 97.5    14.5  ?     ?   207.607   180          224.715    180          37.7073    180          
1 1 1 -30 0  24 o 0 116.9   12.9  ?     ?   134.456   180          250.79     180          124.063    180          
1 1 1 -30 0  23 o 0 4.8     10.6  ?     ?   52.5031   0            13.0587    0            38.6999    180          
1 1 1 -30 0  22 o 0 45.3    13.4  ?     ?   114.615   0            126.534    0            22.1593    0            
1 1 1 -30 0  21 o 0 5.8     8.3   ?     ?   135.145   180          21.056     180          102.146    1.44639e-15  
1 1 1 -30 0  20 o 0 -5.1    8.2   ?     ?   90.0357   180          6.11582    180          76.4229    5.61519e-16  
1 1 1 -30 0  19 o 0 146.3   8.2   ?     ?   177.586   180          282.201    180          113.756    180          
1 1 1 -30 0  18 o 0 -0.4    5.1   ?     ?   331.287   180          13.9428    180          308.333    3.17294e-16  
1 1 1 -30 0  17 o 0 681.6   20.2  ?     ?   526.062   180          622.402    180          97.3991    180          
1 1 1 -30 0  16 o 0 2097    52.4  ?     ?   881.233   180          976.829    180          192.087    180          
1 1 1 -30 0  15 o 0 141.5   8.2   ?     ?   6.89105   0            11.937     0            5.81117    0            
1 1 1 -30 0  14 f 1 1047.3  26.9  ?     ?   688.538   0            700.244    0            81.0046    0            
1 1 1 -30 0  13 o 0 553.9   22.4  ?     ?   672.184   0            512.092    0            105.843    180          
1 1 1 -30 0  12 o 0 255.4   8.3   ?     ?   836.041   0            349.848    0            422.969    180          
1 1 1 -30 0  10 o 0 564.9   23.3  ?     ?   746.885   0            511.3      0            175.656    180          
1 1 1 -30 0  9  o 0 3640.8  87.4  ?     ?   1539.63   0            1303.52    0            137.15     180          
1 1 1 -30 0  8  o 0 211.1   6.3   ?     ?   216.204   0            292.938    0            89.887     0            
1 1 1 -30 0  7  o 0 1353.3  33.2  ?     ?   536.153   0            800.566    0            295.381    0            
1 1 1 -30 0  6  o 0 560.9   21.1  ?     ?   458.099   0            544.036    0            88.2648    0            
1 1 1 -30 0  5  o 0 1851.9  52.2  ?     ?   1217.72   0            991.213    0            209.009    180          
1 1 1 -30 0  4  o 0 1040.2  36.2  ?     ?   667.69    0            744.554    0            84.8962    0            
1 1 1 -30 0  3  o 0 -1.4    2.4   ?     ?   248.307   180          1.76944    180          244.088    5.08655e-17  
1 1 1 -30 0  2  o 0 153.7   5.9   ?     ?   65.0593   0            118.64     0            54.0902    0            
1 1 1 -30 0  1  o 0 9.9     4.7   ?     ?   216.9     180          20.1562    180          195.463    7.23564e-16  
1 1 1 30  0  0  o 0 76.3    3.4   ?     ?   0.0715442 -180         0.0691092  180          0.00214404 3.46461e-09  
1 1 1 30  0  1  o 0 1135    28.8  ?     ?   451.174   180          785.639    180          335.517    180          
1 1 1 30  0  2  o 0 666.8   19    ?     ?   666.066   180          603.13     180          62.4399    6.7777e-14   
1 1 1 30  0  3  o 0 571.9   16.7  ?     ?   587.754   0            559.34     0            28.7902    180          
1 1 1 30  0  4  o 0 425.6   12.7  ?     ?   425.978   180          483        180          56.2751    180          
1 1 1 30  0  5  o 0 3.8     3.8   ?     ?   115.098   180          3.84567    180          111.543    2.41915e-16  
1 1 1 30  0  6  o 0 347.3   16.1  ?     ?   520.884   180          414.687    180          87.4809    3.32614e-14  
1 1 1 30  0  7  o 0 -7.9    5.3   ?     ?   45.0559   180          0.431768   180          43.0015    7.04531e-17  
1 1 1 30  0  8  o 0 752.3   26.2  ?     ?   533.436   0            610.151    0            96.2202    0            
1 1 1 30  0  9  o 0 562.2   21.9  ?     ?   531.813   0            526.82     0            15.0084    0            
1 1 1 30  0  10 o 0 152     11.3  ?     ?   103.904   0            154.296    0            55.7608    0            
1 1 1 30  0  11 o 0 82.7    13.2  ?     ?   198.805   180          142.345    180          45.7851    2.18148e-14  
1 1 1 30  0  12 o 0 380.4   17.9  ?     ?   249.624   180          435.473    180          196.417    180          
1 1 1 30  0  13 o 0 64.6    17.7  ?     ?   326.594   180          149.464    180          162.312    6.4613e-15   
1 1 1 30  0  14 f 1 1556.5  49.7  ?     ?   847.264   180          887.909    180          94.7921    180          
1 1 1 30  0  15 o 0 184.8   19.5  ?     ?   152.734   180          274.056    180          131.166    180          
1 1 1 30  0  16 o 0 15.7    18.1  ?     ?   182.767   180          30.4446    180          139.748    1.52861e-15  
1 1 1 30  0  17 o 0 15.2    19.8  ?     ?   68.1934   0            17.4409    0            53.8926    180          
1 1 1 30  0  18 o 0 79.5    22.9  ?     ?   246.01    180          207.65     180          43.7895    3.32733e-14  
1 1 1 30  0  19 o 0 -26.2   23.3  ?     ?   149.276   180          20.2311    180          128.892    1.10136e-15  
1 1 1 30  0  20 o 0 69.9    32.7  ?     ?   263.413   0            171.579    0            83.3679    180          
1 1 1 30  0  21 o 0 -29.8   35.7  ?     ?   14.3598   180          3.93612    180          9.9193     2.78433e-15  
1 1 1 30  0  22 o 0 3.4     38.2  ?     ?   265.793   180          83.9011    180          194.905    3.02049e-15  
1 1 1 -30 2  26 < 0 14.9    10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 2  25 o 0 72.6    9.1   ?     ?   185.272   155.588      200.248    155.588      34.7913    155.588      
1 1 1 -30 2  24 o 0 77.2    9.3   ?     ?   218.207   -73.2047     177.112    -73.2047     26.8556    106.795      
1 1 1 -30 2  23 o 0 275     11.2  ?     ?   273.032   38.9705      491.586    38.9705      224.554    38.9705      
1 1 1 -30 2  22 o 0 146.7   8.1   ?     ?   303.667   100.878      264.556    100.878      23.1702    -79.1225     
1 1 1 -30 2  21 f 1 46.3    5.6   ?     ?   99.863    131.492      136.833    131.492      45.9877    131.492      
1 1 1 -30 2  20 o 0 92.8    6.2   ?     ?   265.926   -171.196     173.948    -171.196     68.1594    8.8044       
1 1 1 -30 2  19 o 0 308.1   8.6   ?     ?   478.708   -163.707     349.808    -163.707     101.3      16.2933      
1 1 1 -30 2  18 f 1 513.3   12.8  ?     ?   460.761   177.639      595.987    177.639      148.229    177.639      
1 1 1 -30 2  17 o 0 5.4     3.8   ?     ?   34.7831   -53.7689     26.1312    126.231      60.643     126.231      
1 1 1 -30 2  16 f 1 504.3   11.8  ?     ?   351.583   91.8974      598.128    91.8974      285.14     91.8974      
1 1 1 -30 2  15 o 0 117.1   4.6   ?     ?   404.279   -156.872     63.9915    -156.872     296.713    23.1282      
1 1 1 -30 2  14 o 0 424.4   9     ?     ?   439.684   168.576      452.101    168.576      60.5278    168.576      
1 1 1 -30 2  13 o 0 671.4   14    ?     ?   558.544   126.579      573.093    126.579      61.8225    126.579      
1 1 1 -30 2  12 o 0 1510.2  31.6  ?     ?   917.845   44.266       825.758    44.266       19.3817    -135.734     
1 1 1 -30 2  11 o 0 772.9   17.2  ?     ?   889.652   27.6572      351.39     27.6572      460.316    -152.343     
1 1 1 -30 2  10 o 0 38.1    2.8   ?     ?   259.869   95.53        73.6144    -84.47       311.891    -84.47       
1 1 1 -30 2  9  o 0 2639.8  52.4  ?     ?   1122.1    -111.462     1148.9     -111.462     101.767    -111.462     
1 1 1 -30 2  8  o 0 500.7   12.3  ?     ?   667.779   -113.733     311.733    -113.733     313.946    66.2667      
1 1 1 -30 2  7  o 0 373.6   8.7   ?     ?   332.251   -69.1279     462.603    -69.1279     150.172    -69.1279     
1 1 1 -30 2  6  o 0 1793.7  44.2  ?     ?   763.867   -115.004     1097.48    -115.004     376.863    -115.004     
1 1 1 -30 2  5  o 0 919.2   19.2  ?     ?   573.345   153.039      785.541    153.039      214.453    153.039      
1 1 1 -30 2  4  o 0 1552.6  26.9  ?     ?   804.822   -47.9842     997.292    -47.9842     203.175    -47.9842     
1 1 1 -30 2  3  o 0 437     9.9   ?     ?   708.331   46.709       235.801    46.709       464.708    -133.291     
1 1 1 -30 2  1  o 0 701.5   13.4  ?     ?   702.155   -36.0781     501.807    -36.0781     195.32     143.922      
1 1 1 30  2  0  o 0 321     7.9   ?     ?   329.849   -71.5995     436.562    -71.5995     109.161    -71.5995     
1 1 1 30  2  1  o 0 1484.4  31.5  ?     ?   913.21    75.8658      859.594    75.8658      48.52      -104.134     
1 1 1 30  2  2  o 0 135.6   3.8   ?     ?   247.689   178.771      198.025    178.771      48.6995    -1.22872     
1 1 1 30  2  3  o 0 2439.2  55    ?     ?   1107.77   -46.9463     1178.33    -46.9463     73.2403    -46.9463     
1 1 1 30  2  4  o 0 1785    40.6  ?     ?   1103.74   -18.4493     850.724    -18.4493     251.642    161.551      
1 1 1 30  2  5  o 0 273.9   7.9   ?     ?   232.921   -123.766     412.416    -123.766     188.609    -123.766     
1 1 1 30  2  6  o 0 228.1   7     ?     ?   175.831   -161.559     363.528    -161.559     194.51     -161.559     
1 1 1 30  2  7  o 0 735.9   16.6  ?     ?   405.924   -110.501     761.385    -110.501     371.225    -110.501     
1 1 1 30  2  8  o 0 636     14.7  ?     ?   504.59    -32.9542     591.987    -32.9542     107.28     -32.9542     
1 1 1 30  2  9  o 0 1743.8  32.6  ?     ?   982.892   55.5499      897.491    55.5499      33.3238    -124.45      
1 1 1 30  2  10 o 0 28.8    7.5   ?     ?   162.551   -38.0163     58.8871    141.984      212.568    141.984      
1 1 1 30  2  11 o 0 426.6   12.6  ?     ?   260.94    -106.351     591.898    -106.351     339.101    -106.351     
1 1 1 30  2  12 o 0 1.9     9.1   ?     ?   73.0359   -93.878      58.4923    86.122       128.21     86.122       
1 1 1 30  2  13 o 0 206.6   11.6  ?     ?   315.418   -136.554     271.182    -136.554     28.9138    43.4464      
1 1 1 30  2  14 o 0 2       11.1  ?     ?   211.202   -149.597     154.536    30.4026      350.543    30.4026      
1 1 1 30  2  15 o 0 94.6    12.7  ?     ?   61.8304   82.2329      114.751    82.2329      57.1164    82.2329      
1 1 1 30  2  16 f 1 8.3     12.5  ?     ?   142.077   104.038      78.8248    -75.9619     228.405    -75.9619     
1 1 1 30  2  17 o 0 8.5     15    ?     ?   98.4643   -109.216     45.4938    70.7836      148.084    70.7836      
1 1 1 30  2  18 f 1 719.6   23.4  ?     ?   442.796   172.89       849.484    172.89       396.473    172.89       
1 1 1 30  2  19 o 0 56.8    20    ?     ?   75.5487   43.0227      141.868    43.0227      66.7242    43.0227      
1 1 1 30  2  20 o 0 18.2    22.1  ?     ?   39.7908   -117.777     22.7856    -117.777     15.5517    62.2234      
1 1 1 30  2  21 f 1 24.2    22.6  ?     ?   106.018   -83.2769     59.1086    -83.2769     44.1208    96.7231      
1 1 1 30  2  22 o 0 38.1    28.2  ?     ?   15.3759   -160.035     35.4897    -160.035     19.4409    -160.035     
1 1 1 30  2  23 o 0 179.3   28.6  ?     ?   219.134   109.164      396.27     109.164      167.633    109.164      
1 1 1 30  2  24 o 0 138.3   29.5  ?     ?   248.207   137.901      293.472    137.901      50.4467    137.901      
1 1 1 30  2  25 o 0 -33.8   34.1  ?     ?   80.609    173.57       40.7091    173.57       36.6948    -6.42995     
1 1 1 -30 4  26 < 1 13.6    10.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 4  25 o 0 58.7    9     ?     ?   233.797   84.9021      122.3      84.9021      83.5132    -95.0979     
1 1 1 -30 4  24 o 0 5.3     8.8   ?     ?   123.357   141.183      29.898     -38.8165     140.979    -38.8165     
1 1 1 -30 4  23 o 0 -10.5   8.7   ?     ?   50.8397   147.113      29.4007    -32.8874     76.6901    -32.8874     
1 1 1 -30 4  22 f 1 31.6    6.4   ?     ?   215.573   -98.6448     23.8421    -98.6448     185.452    81.3552      
1 1 1 -30 4  21 o 0 218.6   8.9   ?     ?   343.044   -89.1003     338.639    -89.1003     30.1774    -89.1003     
1 1 1 -30 4  20 o 0 48.8    6.8   ?     ?   209.823   -159.589     92.3546    -159.589     96.5676    20.4107      
1 1 1 -30 4  19 o 0 27      5.4   ?     ?   141.531   155.154      48.7954    155.154      79.3856    -24.8459     
1 1 1 -30 4  18 o 0 244.8   8.7   ?     ?   421.874   -4.4624      310.325    -4.4624      85.114     175.538      
1 1 1 -30 4  17 o 0 11.1    4.9   ?     ?   82.0978   -2.04476     32.7656    177.955      111.71     177.955      
1 1 1 -30 4  16 o 0 12.8    3.8   ?     ?   140.833   -164.669     67.0625    15.3306      206.033    15.3306      
1 1 1 -30 4  15 o 0 360.1   8     ?     ?   306.617   -89.9645     482.252    -89.9645     212.194    -89.9645     
1 1 1 -30 4  14 o 0 221.9   6.2   ?     ?   468.415   169.253      186.012    169.253      229.575    -10.7473     
1 1 1 -30 4  13 o 0 103.8   3.8   ?     ?   135.636   109.19       148.392    109.19       28.2805    109.19       
1 1 1 -30 4  12 o 0 208.3   5.4   ?     ?   548.331   -13.2043     82.8573    -13.2043     416.202    166.796      
1 1 1 -30 4  11 o 0 121.7   3.9   ?     ?   499.989   7.36423      24.7385    -172.636     482.48     -172.636     
1 1 1 -30 4  10 o 0 73.6    4.2   ?     ?   157.047   -120.355     61.9752    -120.355     84.3307    59.6446      
1 1 1 -30 4  9  f 1 122.3   4.8   ?     ?   401.926   -3.13223     46.8644    -3.13223     321.423    176.868      
1 1 1 -30 4  8  o 0 651.2   13    ?     ?   273.723   -104.371     761.793    -104.371     511.141    -104.371     
1 1 1 -30 4  7  o 0 501.3   10.1  ?     ?   555.476   122.889      408.742    122.889      108.71     -57.111      
1 1 1 -30 4  6  o 0 1084.4  19.3  ?     ?   900.035   -74.3809     558.033    -74.3809     283.429    105.619      
1 1 1 -30 4  5  o 0 1380.4  25.7  ?     ?   935.357   -2.81974     710.531    -2.81974     166.767    177.18       
1 1 1 -30 4  4  o 0 601.7   12.1  ?     ?   629.803   -104.014     440.41     -104.014     151.977    75.9856      
1 1 1 -30 4  3  o 0 78.1    2.4   ?     ?   273.809   -4.98605     38.4405    -4.98605     219.742    175.014      
1 1 1 -30 4  2  o 0 2442.1  45.3  ?     ?   1103.9    -88.3735     1095.13    -88.3735     51.9838    -88.3735     
1 1 1 -30 4  1  o 0 423     9     ?     ?   321.118   -39.0318     528.289    -39.0318     224.28     -39.0318     
1 1 1 30  4  0  o 0 773.2   14.6  ?     ?   614.08    -131.791     600.467    -131.791     19.3262    -131.791     
1 1 1 30  4  1  o 0 106.5   3.7   ?     ?   175.086   30.7284      142.041    30.7284      23.9458    -149.272     
1 1 1 30  4  2  o 0 25.6    2.2   ?     ?   153.888   149.143      61.9471    -30.8568     208.064    -30.8568     
1 1 1 30  4  3  o 0 335.7   7.6   ?     ?   530.363   -76.6678     260.297    -76.6678     243.923    103.332      
1 1 1 30  4  4  o 0 1578.6  29.1  ?     ?   862.792   -38.5416     901.345    -38.5416     80.3074    -38.5416     
1 1 1 30  4  5  o 0 2108.3  37.9  ?     ?   907.92    35.6337      1132       35.6337      267.531    35.6337      
1 1 1 30  4  6  o 0 119.7   5.1   ?     ?   761.055   -53.8926     271.654    126.107      996.374    126.107      
1 1 1 30  4  7  o 0 692.7   19.9  ?     ?   630.073   -150.039     530.024    -150.039     61.9468    29.9611      
1 1 1 30  4  8  o 0 1656.5  41    ?     ?   724.139   119.497      1077.43    119.497      397.662    119.497      
1 1 1 30  4  9  f 1 553.1   13.3  ?     ?   376.872   90.8354      617.241    90.8354      262.133    90.8354      
1 1 1 30  4  10 o 0 217.5   8.8   ?     ?   283.687   -134.959     308.552    -134.959     39.2223    -134.959     
1 1 1 30  4  11 o 0 30.5    8.7   ?     ?   324.48    -95.923      143.608    84.077       450.911    84.077       
1 1 1 30  4  12 o 0 281.5   12.7  ?     ?   271.681   -57.2229     422.515    -57.2229     171.327    -57.2229     
1 1 1 30  4  13 o 0 614.1   20.6  ?     ?   705.143   9.73701      426.171    9.73701      223.494    -170.263     
1 1 1 30  4  14 o 0 650.4   23.3  ?     ?   539.013   72.7945      603.219    72.7945      104.28     72.7945      
1 1 1 30  4  15 o 0 97.4    14    ?     ?   71.736    -142.229     194.389    -142.229     119.753    -142.229     
1 1 1 30  4  16 o 0 120.8   15.4  ?     ?   286.613   -24.4224     196.488    -24.4224     100.214    155.578      
1 1 1 30  4  17 o 0 -8.9    16.1  ?     ?   44.9294   -149.915     24.362     30.0851      69.8097    30.0851      
1 1 1 30  4  18 o 0 62.5    16.6  ?     ?   173.335   161.684      155.25     161.684      16.1288    -18.3165     
1 1 1 30  4  19 o 0 91.2    21.7  ?     ?   160.823   -57.6046     249.36     -57.6046     95.3027    -57.6046     
1 1 1 30  4  20 o 0 106.8   22.5  ?     ?   302.586   -137.066     174.011    -137.066     114.947    42.9341      
1 1 1 30  4  21 o 0 13.8    21.2  ?     ?   27.3696   138.03       21.075     138.03       7.33844    -41.9704     
1 1 1 30  4  22 f 1 16.6    26.8  ?     ?   47.9772   23.4152      54.7191    23.4152      4.66691    23.4152      
1 1 1 30  4  23 o 0 30      30.3  ?     ?   183.613   -73.8823     34.0429    -73.8823     148.63     106.118      
1 1 1 30  4  24 o 0 -12.4   28    ?     ?   55.8267   -29.2546     32.3181    -29.2546     20.9028    150.745      
1 1 1 -30 6  25 < 0 31.1    10.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 6  24 o 0 -10.5   8.7   ?     ?   52.4966   179.902      19.4635    -0.0977786   65.0943    -0.0977786   
1 1 1 -30 6  23 o 0 1.4     8.4   ?     ?   92.0629   -162.41      28.9201    17.5902      110.769    17.5902      
1 1 1 -30 6  22 o 0 71.9    8.6   ?     ?   31.3304   -111.335     174.244    -111.335     145.474    -111.335     
1 1 1 -30 6  21 o 0 75.5    7     ?     ?   153.649   -68.1204     218.113    -68.1204     70.514     -68.1204     
1 1 1 -30 6  20 o 0 99.6    6.9   ?     ?   262.386   47.7109      195.286    47.7109      48.8589    -132.289     
1 1 1 -30 6  19 o 0 149.1   7.1   ?     ?   270.057   13.8332      281.96     13.8332      41.9829    13.8332      
1 1 1 -30 6  18 o 0 580.8   13    ?     ?   475.79    -73.724      651.73     -73.724      226.499    -73.724      
1 1 1 -30 6  17 o 0 300.8   7.9   ?     ?   485.027   -112.53      328.217    -112.53      120.38     67.4695      
1 1 1 -30 6  16 o 0 68.2    4.5   ?     ?   186.8     -121.25      146.883    -121.25      30.3392    58.7503      
1 1 1 -30 6  15 o 0 926.7   17.7  ?     ?   560.061   -44.5446     848.502    -44.5446     303.293    -44.5446     
1 1 1 -30 6  14 o 0 616.1   12.4  ?     ?   588.461   -18.8737     565.192    -18.8737     12.0766    161.126      
1 1 1 -30 6  13 o 0 671.8   13.3  ?     ?   557.488   -156.718     573.431    -156.718     85.5722    -156.718     
1 1 1 -30 6  12 o 0 79.3    4     ?     ?   298.881   -106.679     59.3043    -106.679     204.016    73.321       
1 1 1 -30 6  11 o 0 34.1    3     ?     ?   347.225   129.533      120.57     -50.467      425.734    -50.467      
1 1 1 -30 6  10 f 1 807.9   15.4  ?     ?   937.8     78.6602      362.333    78.6602      470.922    -101.34      
1 1 1 -30 6  9  o 0 547.3   11.2  ?     ?   450.721   134.812      548.272    134.812      139.193    134.812      
1 1 1 -30 6  8  o 0 45.8    2.5   ?     ?   302.176   12.158       68.7477    -167.842     344.344    -167.842     
1 1 1 -30 6  7  o 0 419.6   9.9   ?     ?   706.289   -29.1222     202.986    -29.1222     451.859    150.878      
1 1 1 -30 6  6  o 0 1489.2  38.5  ?     ?   852.737   -139.54      838.615    -139.54      65.7055    -139.54      
1 1 1 -30 6  5  o 0 101.2   5.7   ?     ?   348.042   -146.283     43.8645    -146.283     272.711    33.717       
1 1 1 -30 6  4  o 0 226.1   8.2   ?     ?   328.763   54.7777      273.091    54.7777      26.8775    -125.222     
1 1 1 -30 6  3  o 0 1244.1  39.4  ?     ?   739.899   32.233       803.701    32.233       126.782    32.233       
1 1 1 -30 6  2  o 0 895.9   29.8  ?     ?   788.425   -148.284     533.908    -148.284     189.067    31.7157      
1 1 1 -30 6  1  o 0 744.4   15.6  ?     ?   602.473   -140.281     583.713    -140.281     30.1906    -140.281     
1 1 1 30  6  0  f 1 393.2   9     ?     ?   260.792   -114.076     526.051    -114.076     284.756    -114.076     
1 1 1 30  6  1  o 0 1360.5  25    ?     ?   831.082   -54.2064     799.406    -54.2064     33.2164    -54.2064     
1 1 1 30  6  2  o 0 331.4   8.3   ?     ?   335.868   113.044      409.206    113.044      99.1789    113.044      
1 1 1 30  6  3  o 0 429.3   9.1   ?     ?   778.78    108.956      148.501    108.956      571.022    -71.0437     
1 1 1 30  6  4  o 0 661.9   13.6  ?     ?   492.646   -131.981     613.162    -131.981     157.749    -131.981     
1 1 1 30  6  5  o 0 2067.9  37.1  ?     ?   793.479   -110.986     1206.64    -110.986     473.018    -110.986     
1 1 1 30  6  6  o 0 945.9   25.1  ?     ?   790.888   -95.3328     571.734    -95.3328     159.281    84.6672      
1 1 1 30  6  7  o 0 1284.2  25.7  ?     ?   724.866   -167.625     880.775    -167.625     201.445    -167.625     
1 1 1 30  6  8  o 0 530.7   13.2  ?     ?   473       172.204      531.045    172.204      88.3078    172.204      
1 1 1 30  6  9  o 0 15.5    7.4   ?     ?   21.8695   94.9206      13.2249    -85.0794     33.6595    -85.0794     
1 1 1 30  6  10 f 1 256.6   10.4  ?     ?   218.202   127.792      410.961    127.792      210.749    127.792      
1 1 1 30  6  11 o 0 183.7   10.2  ?     ?   249.456   112.792      284.793    112.792      57.7027    112.792      
1 1 1 30  6  12 o 0 123.2   10.8  ?     ?   161.239   -43.9395     229.026    -43.9395     81.4448    -43.9395     
1 1 1 30  6  13 o 0 156.7   12.4  ?     ?   453.216   137.47       98.6771    137.47       314.578    -42.5299     
1 1 1 30  6  14 o 0 857.2   22    ?     ?   549.231   53.9319      846.57     53.9319      283.539    53.9319      
1 1 1 30  6  15 o 0 995.1   25.6  ?     ?   675.17    20.7487      844.238    20.7487      167.443    20.7487      
1 1 1 30  6  16 o 0 103.3   13.1  ?     ?   207.363   44.6153      244.36     44.6153      41.0475    44.6153      
1 1 1 30  6  17 o 0 -2.3    15.2  ?     ?   15.9115   -93.7596     4.14845    86.2404      19.2736    86.2404      
1 1 1 30  6  18 o 0 8.3     20.6  ?     ?   132.056   52.5695      4.07285    -127.43      129.295    -127.43      
1 1 1 30  6  19 o 0 22.9    20.7  ?     ?   235.513   42.7475      27.4388    -137.253     251.223    -137.253     
1 1 1 30  6  20 o 0 190.7   23.8  ?     ?   250.151   68.7292      392.92     68.7292      136.721    68.7292      
1 1 1 30  6  21 o 0 159.1   27.3  ?     ?   311.195   80.2967      266.798    80.2967      51.9042    -99.7033     
1 1 1 30  6  22 o 0 9.2     26.1  ?     ?   119.573   -9.41116     38.4546    -9.41116     76.496     170.589      
1 1 1 30  6  23 o 0 25.5    34    ?     ?   77.5681   -19.4816     104.42     -19.4816     31.434     -19.4816     
1 1 1 -30 8  23 < 1 33.7    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 8  22 o 0 -4.9    8.6   ?     ?   22.7264   21.8853      7.40647    -158.115     26.9355    -158.115     
1 1 1 -30 8  21 o 0 55.9    7.3   ?     ?   113.988   1.30405      189.9      1.30405      89.5442    1.30405      
1 1 1 -30 8  20 o 0 69.4    7.8   ?     ?   248.227   -179.523     128.506    -179.523     97.0911    0.476903     
1 1 1 -30 8  19 o 0 16.9    6.4   ?     ?   167.011   97.3884      14.0497    -82.6116     171.561    -82.6116     
1 1 1 -30 8  18 o 0 111.3   6.1   ?     ?   308.165   -48.4223     172.964    -48.4223     97.412     131.578      
1 1 1 -30 8  17 o 0 55.1    5     ?     ?   302.661   -97.6935     39.9629    -97.6935     225.753    82.3065      
1 1 1 -30 8  16 o 0 52.3    4.4   ?     ?   259.457   -97.0143     65.8773    -97.0143     163.084    82.9857      
1 1 1 -30 8  15 o 0 72      4.3   ?     ?   193.307   -151.813     162.903    -151.813     13.5221    28.1865      
1 1 1 -30 8  14 o 0 324.3   8.3   ?     ?   448.543   -11.6796     388.994    -11.6796     23.6583    168.32       
1 1 1 -30 8  13 o 0 213.4   6.1   ?     ?   332.644   -91.8458     326.906    -91.8458     13.3311    -91.8458     
1 1 1 -30 8  12 o 0 1284.2  23.6  ?     ?   706.547   -100.777     954.068    -100.777     271.391    -100.777     
1 1 1 -30 8  11 o 0 90.2    3.4   ?     ?   211.906   -49.0771     171.432    -49.0771     34.6673    130.923      
1 1 1 -30 8  10 o 0 82.9    3.2   ?     ?   170.226   -154.008     130.157    -154.008     17.3728    25.9921      
1 1 1 -30 8  9  o 0 246.3   6     ?     ?   279.709   139.837      358.133    139.837      114.347    139.837      
1 1 1 -30 8  8  o 0 17.8    1.7   ?     ?   121.222   166.826      55.5769    -13.1737     160.856    -13.1737     
1 1 1 -30 8  7  o 0 198.8   5.1   ?     ?   429.947   -18.1899     175.335    -18.1899     199.827    161.81       
1 1 1 -30 8  6  o 0 170.7   5.1   ?     ?   219.202   94.7797      266.763    94.7797      74.6792    94.7797      
1 1 1 -30 8  5  o 0 162.7   5.1   ?     ?   302.662   60.4314      194.494    60.4314      77.3932    -119.569     
1 1 1 -30 8  4  o 0 27.8    2.3   ?     ?   163.413   -86.3021     57.7853    93.6979      205.073    93.6979      
1 1 1 -30 8  3  o 0 357.2   11.3  ?     ?   548.765   -105.524     273.461    -105.524     222.587    74.4765      
1 1 1 -30 8  2  o 0 3947.3  103.2 ?     ?   1134.99   124.966      1643.36    124.966      614.875    124.966      
1 1 1 -30 8  1  o 0 142.6   4.1   ?     ?   161.626   108.217      206.87     108.217      60.1102    108.217      
1 1 1 30  8  0  o 0 132.6   4.3   ?     ?   294.928   -82.9882     147.644    -82.9882     121.737    97.0118      
1 1 1 30  8  1  o 0 1593.2  28.8  ?     ?   843.605   93.4891      931.727    93.4891      160.244    93.4891      
1 1 1 30  8  2  o 0 291.8   7.3   ?     ?   343.797   -38.8939     360.193    -38.8939     45.5073    -38.8939     
1 1 1 30  8  3  o 0 19.1    4.2   ?     ?   87.457    114.367      44.3144    -65.6325     124.408    -65.6325     
1 1 1 30  8  4  o 0 89.4    5.3   ?     ?   175.782   -139.968     99.9851    -139.968     61.0185    40.0323      
1 1 1 30  8  5  o 0 173.3   7     ?     ?   132.47    44.8689      278.961    44.8689      160.19     44.8689      
1 1 1 30  8  6  o 0 878     21.1  ?     ?   323.691   172.245      933.975    172.245      643.964    172.245      
1 1 1 30  8  7  o 0 164.5   7.9   ?     ?   333.627   -57.2605     195.95     -57.2605     102.614    122.74       
1 1 1 30  8  8  o 0 163.7   8.3   ?     ?   18.0271   77.3983      56.0722    77.3983      39.9663    77.3983      
1 1 1 30  8  9  o 0 408.4   13.7  ?     ?   338.267   -90.619      521.72     -90.619      217.504    -90.619      
1 1 1 30  8  10 o 0 412.1   13.2  ?     ?   468.431   9.96925      420.264    9.96925      0.0889835  9.96925      
1 1 1 30  8  11 o 0 166.2   11.1  ?     ?   332.128   66.831       246.109    66.831       89.2195    -113.169     
1 1 1 30  8  12 o 0 164.7   13.9  ?     ?   455.319   6.55474      128.683    6.55474      329.366    -173.445     
1 1 1 30  8  13 o 0 146.4   12.6  ?     ?   205.899   -165.48      324.131    -165.48      121.448    -165.48      
1 1 1 30  8  14 o 0 276.2   14.6  ?     ?   403.034   80.8077      381.223    80.8077      7.10264    -99.1923     
1 1 1 30  8  15 o 0 740.9   25.5  ?     ?   564.437   99.1676      746.22     99.1676      218.604    99.1676      
1 1 1 30  8  16 o 0 73.2    19.7  ?     ?   192.977   95.9528      173.4      95.9528      6.66607    -84.0472     
1 1 1 30  8  17 o 0 13.1    20.3  ?     ?   23.9129   164.701      12.7707    164.701      9.60291    -15.2992     
1 1 1 30  8  18 o 0 34.8    22.4  ?     ?   132.033   -166.095     86.2938    -166.095     46.9421    13.9051      
1 1 1 30  8  19 o 0 -6.4    26.9  ?     ?   114.223   159.046      10.8539    159.046      104.474    -20.9535     
1 1 1 30  8  20 o 0 55.4    28.8  ?     ?   94.8742   -179.721     175.964    -179.721     84.0756    -179.721     
1 1 1 30  8  21 o 0 77.8    28.4  ?     ?   159.24    -19.7584     195.637    -19.7584     45.7941    -19.7584     
1 1 1 30  8  22 o 0 44.2    31.1  ?     ?   148.219   -45.0866     109.076    -45.0866     27.7615    134.913      
1 1 1 -30 10 21 < 0 4.3     9.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 10 20 o 0 17.2    8.4   ?     ?   112.776   45.4132      45.6855    45.4132      49.6876    -134.587     
1 1 1 -30 10 19 o 0 121.3   8.8   ?     ?   253.151   -12.9369     244.798    -12.9369     26.0819    -12.9369     
1 1 1 -30 10 18 o 0 259.5   9.3   ?     ?   355.171   11.78        383.034    11.78        66.467     11.78        
1 1 1 -30 10 17 o 0 21.7    6.1   ?     ?   135.038   -49.7657     39.7532    -49.7657     86.0046    130.234      
1 1 1 -30 10 16 o 0 -7.1    5.7   ?     ?   87.5579   -135.898     64.4928    44.1018      146.171    44.1018      
1 1 1 -30 10 15 o 0 49.2    6     ?     ?   94.0973   -3.55611     147.997    -3.55611     66.4281    -3.55611     
1 1 1 -30 10 14 o 0 23.3    5.5   ?     ?   32.8284   63.7335      24.2374    63.7335      4.20623    -116.266     
1 1 1 -30 10 13 f 1 47.3    4.1   ?     ?   92.3401   -152.816     131.907    -152.816     51.1663    -152.816     
1 1 1 -30 10 12 o 0 380.4   8.7   ?     ?   446.754   143.608      459.622    143.608      68.1378    143.608      
1 1 1 -30 10 11 f 1 529.7   11.4  ?     ?   293.829   -126.277     735.912    -126.277     468.684    -126.277     
1 1 1 -30 10 10 o 0 334.1   7.8   ?     ?   346.88    177.156      474.608    177.156      153.378    177.156      
1 1 1 -30 10 9  o 0 21.8    2.7   ?     ?   45.4823   -85.8327     9.7322     -85.8327     32.6355    94.1673      
1 1 1 -30 10 8  o 0 542.8   11.5  ?     ?   512.386   20.5277      562.763    20.5277      82.8768    20.5277      
1 1 1 -30 10 7  o 0 36.2    2.7   ?     ?   152.727   -42.4656     32.2082    -42.4656     114.095    137.534      
1 1 1 -30 10 6  o 0 20.6    2.4   ?     ?   153.472   -69.634      33.7633    110.366      181.438    110.366      
1 1 1 -30 10 5  o 0 163.5   4.8   ?     ?   235.647   -24.7239     307.969    -24.7239     80.3145    -24.7239     
1 1 1 -30 10 4  o 0 351.4   8.2   ?     ?   401.968   -63.5347     390.441    -63.5347     45.2869    -63.5347     
1 1 1 -30 10 3  o 0 168.8   5.9   ?     ?   142.63    7.54124      297.443    7.54124      174.594    7.54124      
1 1 1 -30 10 2  o 0 43.4    3.2   ?     ?   77.174    -150.801     27.4103    -150.801     39.2366    29.199       
1 1 1 -30 10 1  o 0 66.2    3.8   ?     ?   320.829   -100.223     10.8142    -100.223     266.861    79.7769      
1 1 1 30  10 0  o 0 22.9    3.5   ?     ?   91.8921   52.2877      19.6539    -127.712     100.045    -127.712     
1 1 1 30  10 1  o 0 221.2   6.3   ?     ?   141.453   124.049      383.97     124.049      260.107    124.049      
1 1 1 30  10 2  o 0 49.2    4.4   ?     ?   148.762   -117.25      45.8833    -117.25      84.4511    62.7499      
1 1 1 30  10 3  o 0 248.3   7.3   ?     ?   376.881   93.3234      292.063    93.3234      38.1817    -86.6766     
1 1 1 30  10 4  o 0 606.9   14.2  ?     ?   723.748   113.865      380.34     113.865      253.687    -66.1353     
1 1 1 30  10 5  o 0 49.3    5.8   ?     ?   121.11    55.8995      85.6205    55.8995      34.091     -124.1       
1 1 1 30  10 6  o 0 45.2    6.6   ?     ?   152.706   -75.5096     66.4325    -75.5096     84.3414    104.49       
1 1 1 30  10 7  o 0 266.1   9.4   ?     ?   255.33    160.662      465.876    160.662      214.171    160.662      
1 1 1 30  10 8  o 0 31.6    8.6   ?     ?   117.668   61.7274      47.5829    61.7274      66.1578    -118.273     
1 1 1 30  10 9  o 0 94.1    7.9   ?     ?   189.358   -5.71442     215.969    -5.71442     33.3878    -5.71442     
1 1 1 30  10 10 o 0 144.2   10.6  ?     ?   348.298   -60.2756     207.243    -60.2756     121.998    119.724      
1 1 1 30  10 11 f 1 231.2   12.1  ?     ?   472.399   -109.642     242.743    -109.642     204.558    70.3579      
1 1 1 30  10 12 o 0 42      12.9  ?     ?   112.172   -88.1714     115.207    -88.1714     12.5726    -88.1714     
1 1 1 30  10 13 f 1 29.1    11.5  ?     ?   354.388   -138.04      107.511    41.9597      433.222    41.9597      
1 1 1 30  10 14 o 0 -14     16.4  ?     ?   154.432   -56.0502     72.6647    123.95       213.186    123.95       
1 1 1 30  10 15 o 0 5       15.8  ?     ?   118.327   -123.154     16.9479    56.8463      124.98     56.8463      
1 1 1 30  10 16 o 0 -15.1   19.3  ?     ?   112.045   137.445      34.4307    -42.5547     144.832    -42.5547     
1 1 1 30  10 17 o 0 92.8    20.6  ?     ?   183.513   -130.109     233.135    -130.109     52.0965    -130.109     
1 1 1 30  10 18 o 0 28.5    25.9  ?     ?   83.5341   -76.631      81.0207    -76.631      1.92175    -76.631      
1 1 1 30  10 19 o 0 15.7    28.3  ?     ?   103.036   153.933      68.882     153.933      24.7299    -26.067      
1 1 1 30  10 20 o 0 31.6    32.5  ?     ?   200.973   -172.518     39.7206    -172.518     141.895    7.48226      
1 1 1 -30 12 18 < 0 21.7    8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 12 17 f 1 31.6    7.5   ?     ?   157.032   -76.4845     85.6423    -76.4845     45.5103    103.516      
1 1 1 -30 12 16 o 0 37.9    7     ?     ?   135.122   150.227      113.718    150.227      0.856745   -29.773      
1 1 1 -30 12 15 o 0 42.8    6.4   ?     ?   127.221   -127.454     130.86     -127.454     19.7009    -127.454     
1 1 1 -30 12 14 f 1 41.1    6.6   ?     ?   135.988   -95.4878     121.316    -95.4878     0.872451   -95.4878     
1 1 1 -30 12 13 o 0 176.7   7.2   ?     ?   266.343   -160.826     323.261    -160.826     78.4437    -160.826     
1 1 1 -30 12 12 o 0 172.8   6.6   ?     ?   291.438   113.76       297.575    113.76       29.6803    113.76       
1 1 1 -30 12 11 o 0 83.1    4.9   ?     ?   219.872   97.5205      174.128    97.5205      13.3724    -82.4795     
1 1 1 -30 12 10 o 0 200.1   6.7   ?     ?   367.558   -177.111     276.48     -177.111     39.0272    2.88943      
1 1 1 -30 12 9  o 0 37.5    4.3   ?     ?   75.4711   -149.802     94.1274    -149.802     29.5143    -149.802     
1 1 1 -30 12 8  o 0 142.7   5.3   ?     ?   206.831   -12.8888     308.432    -12.8888     130.36     -12.8888     
1 1 1 -30 12 7  o 0 252.4   7.5   ?     ?   303.707   0.546268     409.721    0.546268     147.882    0.546268     
1 1 1 -30 12 6  o 0 47.2    3.9   ?     ?   164.506   73.504       112.48     73.504       30.0124    -106.496     
1 1 1 -30 12 5  o 0 42.4    3.9   ?     ?   208.368   111.378      60.8178    111.378      125.055    -68.6223     
1 1 1 -30 12 4  o 0 15.8    3.9   ?     ?   49.9443   22.287       3.20797    22.287       41.5114    -157.713     
1 1 1 -30 12 3  o 0 124.4   5.6   ?     ?   303.381   -172.785     196.708    -172.785     75.8272    7.21468      
1 1 1 -30 12 2  o 0 -1.7    3.8   ?     ?   64.7992   -118.746     49.954     61.254       108.33     61.254       
1 1 1 -30 12 1  o 0 160.8   6.3   ?     ?   329.987   -78.3049     244.212    -78.3049     53.7713    101.695      
1 1 1 30  12 0  o 0 201.8   7.5   ?     ?   299.006   -80.9811     343.16     -80.9811     68.8152    -80.9811     
1 1 1 30  12 1  o 0 59      5.2   ?     ?   219.485   -78.157      108.423    -78.157      93.0837    101.843      
1 1 1 30  12 2  o 0 46.3    7.2   ?     ?   119.485   -14.7999     119.59     -14.7999     9.86838    -14.7999     
1 1 1 30  12 3  o 0 53      7     ?     ?   211.906   65.8927      94.8571    65.8927      99.6959    -114.107     
1 1 1 30  12 4  o 0 12.7    5.6   ?     ?   147.898   -94.8515     43.1989    85.1485      178.902    85.1485      
1 1 1 30  12 5  o 0 198.5   8.7   ?     ?   400.931   -93.8914     261.889    -93.8914     96.4519    86.1086      
1 1 1 30  12 6  o 0 92.9    8.3   ?     ?   285.542   -88.2993     154.572    -88.2993     100.259    91.7007      
1 1 1 30  12 7  o 0 161     9.4   ?     ?   262.09    -16.4943     311.089    -16.4943     77.6385    -16.4943     
1 1 1 30  12 8  o 0 54.3    10.6  ?     ?   114.166   0.810848     157.555    0.810848     55.7234    0.810848     
1 1 1 30  12 9  o 0 172.2   11.9  ?     ?   262.777   64.8555      327.606    64.8555      93.8874    64.8555      
1 1 1 30  12 10 o 0 36.4    11.8  ?     ?   56.4742   -163.242     84.285     -163.242     33.7829    -163.242     
1 1 1 30  12 11 o 0 45.9    14.4  ?     ?   231.781   -136.304     63.8402    -136.304     152.643    43.6964      
1 1 1 30  12 12 o 0 113.1   16.5  ?     ?   239.308   -128.664     234.328    -128.664     3.87832    -128.664     
1 1 1 30  12 13 o 0 28.7    16    ?     ?   104.552   -91.4441     76.4056    -91.4441     24.5552    88.5559      
1 1 1 30  12 14 f 1 58      14.2  ?     ?   93.4085   131.008      197.982    131.008      110.822    131.008      
1 1 1 30  12 15 o 0 12.4    18.6  ?     ?   32.9959   -124.175     26.4961    -124.175     3.32768    55.8246      
1 1 1 30  12 16 o 0 -7      22.2  ?     ?   134.265   -157.069     2.99787    22.9313      122.045    22.9313      
1 1 1 30  12 17 f 1 34      23.6  ?     ?   71.8423   156.021      120.969    156.021      57.2165    156.021      
1 1 1 30  12 18 < 0 0.8     26.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 14 15 < 0 20.5    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 14 14 < 1 28.6    7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 14 13 o 0 111.3   8.3   ?     ?   241.969   -6.44026     229.282    -6.44026     32.336     -6.44026     
1 1 1 -30 14 12 o 0 55.7    7.2   ?     ?   172.204   -74.3937     148.987    -74.3937     8.05691    -74.3937     
1 1 1 -30 14 11 f 1 2.6     7.8   ?     ?   113.458   33.5425      36.5616    -146.458     131.812    -146.458     
1 1 1 -30 14 10 f 1 13.9    5.4   ?     ?   147.407   20.7925      3.78875    -159.208     128.379    -159.208     
1 1 1 -30 14 9  o 0 81.6    9.6   ?     ?   131.459   -120.999     235.969    -120.999     122.36     -120.999     
1 1 1 -30 14 8  o 0 5       5.5   ?     ?   4.13995   53.9091      1.1758     -126.091     4.77446    -126.091     
1 1 1 -30 14 7  o 0 12.9    4.7   ?     ?   154.598   -48.5589     23.4528    131.441      163.265    131.441      
1 1 1 -30 14 6  o 0 32.8    4.7   ?     ?   160.454   148.235      71.6175    148.235      74.198     -31.7653     
1 1 1 -30 14 5  o 0 10.9    5.1   ?     ?   65.9467   -140.325     3.87554    39.675       63.6219    39.675       
1 1 1 -30 14 4  o 0 55.5    6     ?     ?   91.4541   -2.3905      176.514    -2.3905      93.3316    -2.3905      
1 1 1 -30 14 3  o 0 50.7    8.6   ?     ?   80.1392   -57.4442     159.859    -57.4442     86.7145    -57.4442     
1 1 1 -30 14 2  o 0 109.1   7.2   ?     ?   201.585   -156.048     249.861    -156.048     65.3151    -156.048     
1 1 1 -30 14 1  o 0 252.3   10.9  ?     ?   330.023   -163.474     384.823    -163.474     81.9214    -163.474     
1 1 1 30  14 0  o 0 14.1    7.1   ?     ?   100.649   13.9329      3.95178    13.9329      90.4041    -166.067     
1 1 1 30  14 1  o 0 27.2    7.3   ?     ?   113.35    122.593      70.9627    122.593      35.3352    -57.407      
1 1 1 30  14 2  o 0 76.8    8.8   ?     ?   225.935   -101.532     158.768    -101.532     53.0915    78.4684      
1 1 1 30  14 3  o 0 162.3   10.1  ?     ?   244.231   -114.652     324.221    -114.652     95.3206    -114.652     
1 1 1 30  14 4  o 0 28.1    9.4   ?     ?   35.8261   -13.9787     48.7212    -13.9787     15.1754    -13.9787     
1 1 1 30  14 5  o 0 41.5    9.4   ?     ?   103.749   64.2073      129.957    64.2073      32.9448    64.2073      
1 1 1 30  14 6  o 0 69.5    11.1  ?     ?   189.633   80.7788      167.799    80.7788      10.5275    -99.2212     
1 1 1 30  14 7  o 0 14.6    11.5  ?     ?   104.748   -105.378     14.8513    -105.378     83.4288    74.6217      
1 1 1 30  14 8  o 0 18      13.5  ?     ?   209.187   -43.456      32.7629    136.544      221.912    136.544      
1 1 1 30  14 9  o 0 57      13    ?     ?   84.158    -86.8187     190.707    -86.8187     114.851    -86.8187     
1 1 1 30  14 10 f 1 20.1    17    ?     ?   71.7243   69.9174      55.9974    69.9174      7.39911    -110.083     
1 1 1 30  14 11 f 1 7.2     17.2  ?     ?   22.601    -57.3729     15.8504    -57.3729     3.78571    122.627      
1 1 1 30  14 12 o 0 64.5    17.5  ?     ?   181.082   158.681      164.367    158.681      8.55341    158.681      
1 1 1 30  14 13 o 0 32      19.7  ?     ?   186.371   161.093      47.0933    161.093      112.829    -18.907      
1 1 1 30  14 14 < 1 133.5   21    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 16 8  < 1 11.5    7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 16 7  < 0 3.3     7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 16 6  < 0 11.3    7.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -30 16 5  o 0 90.8    7.8   ?     ?   222.925   -31.2577     198.414    -31.2577     19.4443    -31.2577     
1 1 1 -30 16 4  f 1 120.3   8.6   ?     ?   121.599   -55.8341     328.834    -55.8341     230.304    -55.8341     
1 1 1 -30 16 3  o 0 65.8    8.2   ?     ?   141.938   -67.2203     198.102    -67.2203     83.2605    -67.2203     
1 1 1 -30 16 2  o 0 85.9    9.4   ?     ?   170.78    -34.987      227.123    -34.987      88.502     -34.987      
1 1 1 -30 16 1  o 0 85.8    10    ?     ?   163.881   4.20739      227.788    4.20739      94.6996    4.20739      
1 1 1 30  16 0  o 0 7.4     8.8   ?     ?   48.1023   -94.9261     7.53755    -94.9261     32.5703    85.0739      
1 1 1 30  16 1  o 0 79.4    9.2   ?     ?   111.135   -102.185     251.381    -102.185     158.712    -102.185     
1 1 1 30  16 2  o 0 35.8    9.4   ?     ?   138.185   173.816      113.151    173.816      2.28943    -6.18415     
1 1 1 30  16 3  o 0 11.4    9.6   ?     ?   102.347   102.303      22.7075    102.303      62.7253    -77.6969     
1 1 1 30  16 4  f 1 58.6    14    ?     ?   169.62    85.46        157.106    85.46        14.9651    85.46        
1 1 1 30  16 5  o 0 22.3    15.3  ?     ?   124.563   73.1423      57.7482    73.1423      45.9276    -106.858     
1 1 1 30  16 6  < 0 94.1    18.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 30  16 7  < 0 130.9   21    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 30  16 8  < 1 34.5    17.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 1  26 < 0 -3.5    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 1  25 f 1 118.7   9.8   ?     ?   230.996   172.817      272.638    172.817      65.1817    172.817      
1 1 1 -31 1  24 o 0 13.4    7.7   ?     ?   36.2655   -95.5979     12.3444    -95.5979     21.5669    84.4021      
1 1 1 -31 1  23 o 0 168.7   9.5   ?     ?   323.91    83.5463      276.026    83.5463      40.836     -96.4537     
1 1 1 -31 1  22 o 0 74      6.4   ?     ?   192.868   91.2792      187.16     91.2792      2.07071    -88.7208     
1 1 1 -31 1  21 f 1 138.9   6.6   ?     ?   194.997   -177.155     324.377    -177.155     147.001    -177.155     
1 1 1 -31 1  20 o 0 50.6    4.8   ?     ?   175.944   159.774      122.643    159.774      37.5064    -20.2255     
1 1 1 -31 1  19 o 0 113.3   5.7   ?     ?   186.683   -149.591     274.043    -149.591     98.1894    -149.591     
1 1 1 -31 1  18 o 0 141.7   5.6   ?     ?   114.093   -145.539     352.509    -145.539     242.262    -145.539     
1 1 1 -31 1  17 f 1 189.5   6.7   ?     ?   186.101   6.91596      394.953    6.91596      209.483    6.91596      
1 1 1 -31 1  16 o 0 27.8    3.8   ?     ?   193.131   175.629      39.2117    -4.37057     210.116    -4.37057     
1 1 1 -31 1  15 o 0 210.9   6     ?     ?   244.732   42.0546      338.444    42.0546      120.313    42.0546      
1 1 1 -31 1  14 o 0 133.3   4.5   ?     ?   290.478   46.6133      167.357    46.6133      91.0285    -133.387     
1 1 1 -31 1  13 o 0 105.3   5.1   ?     ?   216.794   -40.1181     127.79     -40.1181     70.3855    139.882      
1 1 1 -31 1  12 o 0 203.9   7.7   ?     ?   339.877   49.2683      241.486    49.2683      70.9919    -130.732     
1 1 1 -31 1  11 o 0 782.5   17.2  ?     ?   547.781   54.137       654.167    54.137       155.222    54.137       
1 1 1 -31 1  10 o 0 830.8   15.4  ?     ?   601.824   168.581      648.051    168.581      97.2473    168.581      
1 1 1 -31 1  9  o 0 491.7   10.9  ?     ?   227.558   -117.611     644.502    -117.611     435.331    -117.611     
1 1 1 -31 1  8  o 0 212.2   5.4   ?     ?   162.402   177.437      329.11     177.437      177.269    177.437      
1 1 1 -31 1  7  o 0 1821.5  40.4  ?     ?   854.866   -119.418     1023.34    -119.418     221.263    -119.418     
1 1 1 -31 1  6  o 0 1342    25.3  ?     ?   990.681   35.5842      639.57     35.5842      292.847    -144.416     
1 1 1 -31 1  5  o 0 2116.1  46.5  ?     ?   967.549   67.8652      1070.68    67.8652      157.48     67.8652      
1 1 1 -31 1  4  o 0 1307.7  24.4  ?     ?   706.95    19.6029      938.357    19.6028      242.488    19.6028      
1 1 1 -31 1  3  o 0 106     2.7   ?     ?   485.385   105.621      50.0468    -74.3794     528.922    -74.3794     
1 1 1 -31 1  2  o 0 112.1   2.9   ?     ?   300.499   151.142      113.75     151.142      183.344    -28.8577     
1 1 1 -31 1  1  o 0 1055.7  19.9  ?     ?   768.005   -116.901     716.284    -116.901     44.4989    63.0986      
1 1 1 31  1  0  f 1 1472.5  32    ?     ?   872.365   -53.5766     884.89     -53.5766     15.547     -53.5766     
1 1 1 31  1  1  o 0 2201.7  44.9  ?     ?   872.565   100.114      1287.41    100.114      420.749    100.114      
1 1 1 31  1  2  o 0 1175.7  25.5  ?     ?   792.98    -16.1393     778.899    -16.1393     10.02      163.861      
1 1 1 31  1  3  o 0 5086.5  122.6 ?     ?   1440.81   -52.3924     1868.04    -52.3924     432.56     -52.3924     
1 1 1 31  1  4  o 0 45.8    3.1   ?     ?   111.629   4.07813      8.61311    4.07813      102.732    -175.922     
1 1 1 31  1  5  o 0 1418.5  28.9  ?     ?   630.805   -149.956     1030.67    -149.956     425.342    -149.956     
1 1 1 31  1  6  o 0 2536    45    ?     ?   1147.31   139.722      1113.35    139.722      11.9476    139.722      
1 1 1 31  1  7  o 0 1303.6  29.6  ?     ?   1000.66   103.621      619.35     103.621      341.217    -76.3785     
1 1 1 31  1  8  o 0 2606.7  50.7  ?     ?   1032.52   -19.5061     1251.27    -19.5061     260.65     -19.5061     
1 1 1 31  1  9  o 0 1528.5  29.5  ?     ?   890.69    -32.9821     863.437    -32.9821     20.9211    -32.9821     
1 1 1 31  1  10 o 0 465.9   13.6  ?     ?   601.394   -51.5165     348.773    -51.5165     219.191    128.484      
1 1 1 31  1  11 o 0 131.4   9.3   ?     ?   420.97    -121.496     54.2901    -121.496     353.143    58.5038      
1 1 1 31  1  12 o 0 152.8   9.5   ?     ?   148.726   -74.7124     233.158    -74.7124     91.3125    -74.7124     
1 1 1 31  1  13 o 0 890.6   22.1  ?     ?   621.257   -142.586     733.247    -142.586     154.912    -142.586     
1 1 1 31  1  14 o 0 27.1    11.3  ?     ?   80.4583   -133.091     22.9848    46.9088      97.6092    46.9088      
1 1 1 31  1  15 o 0 175.3   13.8  ?     ?   284.107   20.507       268.456    20.507       3.74934    20.507       
1 1 1 31  1  16 o 0 62.6    11.9  ?     ?   147.014   -158.134     131.862    -158.134     22.0764    21.8662      
1 1 1 31  1  17 f 1 98.7    15.6  ?     ?   183.798   -155.777     219.338    -155.777     26.8837    -155.777     
1 1 1 31  1  18 o 0 169.8   16.2  ?     ?   117.832   -132.992     425.613    -132.992     305.678    -132.992     
1 1 1 31  1  19 o 0 292.8   20.2  ?     ?   367.565   48.7117      448.906    48.7117      83.2448    48.7117      
1 1 1 31  1  20 o 0 -19.8   21    ?     ?   45.8102   -69.7742     13.6171    110.226      57.9356    110.226      
1 1 1 31  1  21 f 1 78.7    22.8  ?     ?   316.562   -92.7446     86.9257    -92.7446     221.472    87.2554      
1 1 1 31  1  22 o 0 36.9    26.8  ?     ?   117.735   -107.605     102.159    -107.605     20.8153    72.3951      
1 1 1 31  1  23 o 0 90.3    30.2  ?     ?   134.151   115.251      253.37     115.251      117.994    115.251      
1 1 1 31  1  24 o 0 64.7    34.7  ?     ?   115.1     135.277      184.46     135.277      71.6409    135.277      
1 1 1 -31 3  26 < 1 1.1     9.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 3  25 o 0 35.4    9.7   ?     ?   128.77    -78.6146     123.698    -78.6146     9.83501    -78.6146     
1 1 1 -31 3  24 o 0 18.5    9.2   ?     ?   244.437   -41.4897     53.3311    138.51       274.394    138.51       
1 1 1 -31 3  23 o 0 25.4    7.1   ?     ?   51.5934   -11.9591     70.4714    -11.9591     22.2805    -11.9591     
1 1 1 -31 3  22 o 0 226     9.3   ?     ?   324.069   -133.761     372.339    -133.761     58.0564    -133.761     
1 1 1 -31 3  21 o 0 107.2   6.7   ?     ?   340.024   -164.662     142.17     -164.662     164.762    15.3383      
1 1 1 -31 3  20 o 0 97.9    6     ?     ?   313.472   -169.736     145.328    -169.736     137.969    10.2642      
1 1 1 -31 3  19 o 0 110.8   6     ?     ?   225.854   -157.69      246.344    -157.69      41.066     -157.69      
1 1 1 -31 3  18 o 0 226.6   7.1   ?     ?   332.13    -75.9998     363.071    -75.9998     50.6952    -75.9998     
1 1 1 -31 3  17 o 0 21.6    5.2   ?     ?   13.9273   108.607      3.32219    108.607      10.1134    -71.3928     
1 1 1 -31 3  16 o 0 153.2   5.3   ?     ?   357.956   107.065      195.025    107.065      159.277    -72.9346     
1 1 1 -31 3  15 o 0 74.1    3.9   ?     ?   133.734   -126.781     113.152    -126.781     4.97488    53.2187      
1 1 1 -31 3  14 o 0 602.2   18.1  ?     ?   470.67    167.661      590.87     167.661      175.79     167.661      
1 1 1 -31 3  13 o 0 1015.8  24    ?     ?   665.241   67.8895      749.327    67.8895      158.748    67.8895      
1 1 1 -31 3  12 o 0 1347.1  27.6  ?     ?   857.447   35.4951      778.311    35.4951      3.90371    -144.505     
1 1 1 -31 3  11 f 1 143.3   4.2   ?     ?   384.633   70.674       105.78     70.674       248.921    -109.326     
1 1 1 -31 3  10 o 0 62.4    3.1   ?     ?   200.407   99.9244      25.1262    99.9244      157.025    -80.0756     
1 1 1 -31 3  9  o 0 792.3   14.9  ?     ?   583.808   -49.976      633.064    -49.976      99.9096    -49.976      
1 1 1 -31 3  8  f 1 2263.8  39.2  ?     ?   800.39    -59.2335     1277.74    -59.2335     539.86     -59.2335     
1 1 1 -31 3  7  o 0 235.5   5.9   ?     ?   288       178.054      316.62     178.054      47.9459    178.054      
1 1 1 -31 3  6  f 1 74.1    2.6   ?     ?   203.022   -163.872     59.0993    -163.872     131.937    16.1284      
1 1 1 -31 3  5  o 0 2341.1  39.9  ?     ?   1096.64   -62.5763     1050.3     -62.5763     20.4859    -62.5763     
1 1 1 -31 3  4  o 0 2007.3  35.1  ?     ?   1182.44   7.26835      818.048    7.26835      295.397    -172.732     
1 1 1 -31 3  3  o 0 2511.2  46    ?     ?   1376.38   172.198      870.758    172.198      428.488    -7.80159     
1 1 1 -31 3  2  o 0 1297.2  23.1  ?     ?   901.253   -105.485     698.431    -105.485     154.159    74.5154      
1 1 1 -31 3  1  o 0 631.7   12.4  ?     ?   676.359   0.298765     451.116    0.298765     223.811    -179.701     
1 1 1 31  3  0  o 0 2164.6  39.5  ?     ?   974.165   116.839      1149.84    116.839      177.894    116.839      
1 1 1 31  3  1  o 0 42      2.5   ?     ?   148.381   -51.9235     13.2965    128.076      161.61     128.076      
1 1 1 31  3  2  o 0 602.2   12.3  ?     ?   350.656   -161.209     683.472    -161.209     350.023    -161.209     
1 1 1 31  3  3  o 0 424.8   9.5   ?     ?   527.931   -83.3378     363.653    -83.3378     139.061    96.6622      
1 1 1 31  3  4  o 0 1169.9  21.5  ?     ?   763.463   15.9899      751.018    15.9899      23.2512    15.9899      
1 1 1 31  3  5  o 0 1056.7  22.1  ?     ?   704.221   68.2015      730.838    68.2015      59.0791    68.2015      
1 1 1 31  3  6  f 1 688.4   19.4  ?     ?   822.243   -61.528      342.364    -61.528      446.223    118.472      
1 1 1 31  3  7  o 0 1422.7  35.1  ?     ?   837.175   -59.3751     838.166    -59.3751     39.5203    -59.3751     
1 1 1 31  3  8  f 1 189.5   8.6   ?     ?   180.743   122.071      293.22     122.071      122.285    122.071      
1 1 1 31  3  9  o 0 233.8   9.8   ?     ?   472.952   -117.327     179.828    -117.327     264.633    62.6729      
1 1 1 31  3  10 o 0 852.9   23.2  ?     ?   432.586   78.995       846.801    78.995       430.031    78.995       
1 1 1 31  3  11 f 1 81.2    11.3  ?     ?   59.0498   58.7263      48.7682    58.7263      7.60245    -121.274     
1 1 1 31  3  12 o 0 53      11.9  ?     ?   240.587   16.5034      14.7983    -163.497     242.652    -163.497     
1 1 1 31  3  13 o 0 113     10.5  ?     ?   216.632   11.3854      169.364    11.3854      30.8592    -168.615     
1 1 1 31  3  14 o 0 77.5    11.6  ?     ?   170.907   -119.686     124.349    -119.686     34.3826    60.3145      
1 1 1 31  3  15 o 0 164     12.8  ?     ?   279.771   -166.498     249.956    -166.498     8.75339    13.5018      
1 1 1 31  3  16 o 0 26.3    11.9  ?     ?   96.4314   95.9798      1.01632    95.9798      99.1804    -84.0202     
1 1 1 31  3  17 o 0 157.6   15.7  ?     ?   344.605   -104.681     236.974    -104.681     112.964    75.3192      
1 1 1 31  3  18 o 0 65.1    18.5  ?     ?   144.445   151.911      178.872    151.911      35.4737    151.911      
1 1 1 31  3  19 o 0 99.8    17.9  ?     ?   141.8     -84.508      286.036    -84.508      149.622    -84.508      
1 1 1 31  3  20 o 0 144.2   22    ?     ?   268.743   -168.839     287.093    -168.839     29.3113    -168.839     
1 1 1 31  3  21 o 0 -15.1   23    ?     ?   202.509   111.789      82.4401    -68.2106     286.423    -68.2106     
1 1 1 31  3  22 o 0 59.5    27.5  ?     ?   177.132   105.744      133.842    105.744      50.8934    -74.2563     
1 1 1 31  3  23 o 0 19.7    29.1  ?     ?   179.787   115.773      28.8249    115.773      150.941    -64.2268     
1 1 1 31  3  24 o 0 15.7    26.1  ?     ?   190.84    126.108      8.47126    126.108      174.411    -53.892      
1 1 1 -31 5  25 < 0 15.9    9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 5  24 o 0 19.1    9.7   ?     ?   152.919   -118.855     24.4013    -118.855     109.334    61.145       
1 1 1 -31 5  23 o 0 -4.7    7.7   ?     ?   49.9775   87.0418      23.8709    -92.9582     68.6711    -92.9582     
1 1 1 -31 5  22 o 0 35.7    7.9   ?     ?   56.1629   -64.5625     110.983    -64.5625     57.1787    -64.5625     
1 1 1 -31 5  21 o 0 106.5   7.7   ?     ?   246.537   -129.557     218.307    -129.557     18.6367    50.4428      
1 1 1 -31 5  20 o 0 10.8    7.4   ?     ?   103.835   126.88       17.108     -53.1195     109.987    -53.1195     
1 1 1 -31 5  19 o 0 6.2     6.7   ?     ?   34.7369   -45.5228     12.9196    134.477      44.025     134.477      
1 1 1 -31 5  18 f 1 55.8    5.3   ?     ?   268.333   -149.457     69.9295    -149.456     172.943    30.5435      
1 1 1 -31 5  17 o 0 353     11.9  ?     ?   387.186   110.822      483.6      110.822      122.845    110.822      
1 1 1 -31 5  16 o 0 104     4.9   ?     ?   160.572   168.005      254.43     168.005      100.987    168.005      
1 1 1 -31 5  15 o 0 65.1    5.1   ?     ?   366.263   24.9653      17.0667    -155.035     376.144    -155.035     
1 1 1 -31 5  14 o 0 31.8    3.5   ?     ?   66.8675   -108.41      3.6625     -108.41      54.8357    71.5904      
1 1 1 -31 5  13 o 0 219.2   5.7   ?     ?   382.679   -146.755     248.97     -146.755     88.1793    33.2446      
1 1 1 -31 5  12 o 0 116.8   4     ?     ?   356.391   -5.35327     90.029     -5.35327     223.29     174.647      
1 1 1 -31 5  11 o 0 216.6   5.4   ?     ?   376.675   89.0004      244.627    89.0004      88.5527    -90.9996     
1 1 1 -31 5  10 o 0 1462.2  26.1  ?     ?   894.989   109.879      808.292    109.879      4.7687     -70.121      
1 1 1 -31 5  9  o 0 51.8    2.4   ?     ?   172.015   -129.92      7.04363    -129.92      150.036    50.0801      
1 1 1 -31 5  8  o 0 558.9   10.8  ?     ?   407.664   170.249      594.381    170.249      215.822    170.249      
1 1 1 -31 5  7  o 0 2392.3  41.1  ?     ?   835.087   -176.181     1294.71    -176.181     536.38     -176.181     
1 1 1 -31 5  6  o 0 322.5   8.8   ?     ?   376.159   91.4244      364.337    91.4244      21.4369    91.4244      
1 1 1 -31 5  5  o 0 391.8   11.6  ?     ?   387.382   60.7143      435.953    60.7143      81.6097    60.7143      
1 1 1 -31 5  4  o 0 254.8   10.2  ?     ?   107.026   179.466      354.352    179.466      254.861    179.466      
1 1 1 -31 5  3  o 0 551.7   16.2  ?     ?   683.453   -75.6478     344.021    -75.6478     292.997    104.352      
1 1 1 -31 5  2  o 0 177     4.7   ?     ?   156.158   -147.666     271.358    -147.666     125.477    -147.666     
1 1 1 -31 5  1  o 0 433.1   10.5  ?     ?   260.239   -114.346     573.24     -114.346     329.655    -114.346     
1 1 1 31  5  0  o 0 2984.4  52.4  ?     ?   983.077   -175.364     1422.2     -175.364     501.034    -175.364     
1 1 1 31  5  1  o 0 1185    22.4  ?     ?   587.263   151.972      906.058    151.972      354.867    151.972      
1 1 1 31  5  2  o 0 132.5   4.2   ?     ?   252.511   95.0329      169.864    95.0329      67.4679    -84.9671     
1 1 1 31  5  3  o 0 72.4    3.6   ?     ?   235.415   -141.925     43.0454    -141.925     178.46     38.0747      
1 1 1 31  5  4  o 0 178.3   5.2   ?     ?   82.6869   -129.054     203.608    -129.054     126.762    -129.054     
1 1 1 31  5  5  o 0 483.7   10.7  ?     ?   707.217   -90.4598     268.481    -90.4598     389.011    89.5402      
1 1 1 31  5  6  o 0 119.4   5.7   ?     ?   369.778   -82.8358     67.7348    -82.8358     276.021    97.1642      
1 1 1 31  5  7  o 0 619.2   13.9  ?     ?   554.142   -171.562     527.469    -171.562     12.5969    -171.562     
1 1 1 31  5  8  o 0 325.1   9.3   ?     ?   397.269   119.302      372.335    119.302      1.82626    -60.6978     
1 1 1 31  5  9  o 0 181.3   7.8   ?     ?   320.427   -119.379     223.871    -119.379     77.4586    60.6213      
1 1 1 31  5  10 o 0 106.9   8.7   ?     ?   50.5735   147.136      69.4325    147.136      21.9701    147.136      
1 1 1 31  5  11 o 0 109.4   9.7   ?     ?   351.05    -177.812     81.7272    -177.812     240.039    2.1878       
1 1 1 31  5  12 o 0 300.5   12.2  ?     ?   531.216   116.628      243.207    116.628      242.199    -63.3717     
1 1 1 31  5  13 o 0 399.5   13.9  ?     ?   481.73    129.498      405.312    129.498      37.136     -50.5018     
1 1 1 31  5  14 o 0 117.2   12    ?     ?   314.345   68.2809      164.861    68.2809      159.79     -111.719     
1 1 1 31  5  15 o 0 93.3    13.6  ?     ?   115.184   -73.6713     217.613    -73.6713     99.1986    -73.6713     
1 1 1 31  5  16 o 0 102.2   15.6  ?     ?   163.054   157.719      258.689    157.719      94.8244    157.719      
1 1 1 31  5  17 o 0 403.1   19.8  ?     ?   390.781   132.261      567.206    132.261      183.185    132.261      
1 1 1 31  5  18 f 1 60.4    16.5  ?     ?   269.578   -152.649     81.0012    -152.649     177.087    27.3513      
1 1 1 31  5  19 o 0 16.8    18.9  ?     ?   97.7033   -75.3702     23.9997    -75.3702     68.8088    104.63       
1 1 1 31  5  20 o 0 134.5   30.3  ?     ?   132.657   119.711      352.866    119.711      226.627    119.711      
1 1 1 31  5  21 o 0 52.5    23.8  ?     ?   123.557   172.625      155.197    172.625      27.5422    172.625      
1 1 1 31  5  22 o 0 159     37.3  ?     ?   170.216   -110.601     393.195    -110.601     224.565    -110.601     
1 1 1 31  5  23 o 0 8.1     25.3  ?     ?   226.8     -116.23      43.8519    63.7696      262.068    63.7696      
1 1 1 -31 7  24 < 0 30.8    10    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 7  23 o 0 40.7    7.7   ?     ?   117.043   -128.803     149.891    -128.803     49.0082    -128.803     
1 1 1 -31 7  22 o 0 40.4    8     ?     ?   176.005   -75.8577     99.3114    -75.8577     55.8178    104.142      
1 1 1 -31 7  21 o 0 45.7    8.1   ?     ?   165.36    74.3311      122.44     74.3311      28.0597    -105.669     
1 1 1 -31 7  20 o 0 94      6.8   ?     ?   166.63    90.3124      252.953    90.3124      94.3437    90.3124      
1 1 1 -31 7  19 o 0 7.9     5.6   ?     ?   85.4008   -24.8028     24.8408    155.197      106.347    155.197      
1 1 1 -31 7  18 o 0 610.1   13.8  ?     ?   642.35    -81.8232     521.857    -81.8232     43.4405    98.1768      
1 1 1 -31 7  17 o 0 40.1    4.7   ?     ?   166.762   -143.745     88.6313    -143.745     58.9325    36.255       
1 1 1 -31 7  16 o 0 75.1    4.7   ?     ?   201.753   13.4437      165.878    13.4437      18.8215    -166.556     
1 1 1 -31 7  15 o 0 273.2   6.8   ?     ?   373.333   10.2407      388.596    10.2407      43.962     10.2407      
1 1 1 -31 7  14 o 0 149.6   5     ?     ?   340.266   -60.1619     212.047    -60.1619     109.919    119.838      
1 1 1 -31 7  13 o 0 260.4   6.5   ?     ?   388.408   -150.828     339.155    -150.828     37.671     29.1724      
1 1 1 -31 7  12 o 0 339.1   7.6   ?     ?   330.812   152.007      498.436    152.007      175.258    152.007      
1 1 1 -31 7  11 o 0 1218.5  22.1  ?     ?   784.811   67.5288      755.39     67.5288      71.9496    67.5288      
1 1 1 -31 7  10 o 0 1.5     2.1   ?     ?   286.606   109.709      235.148    -70.2911     484.055    -70.2911     
1 1 1 -31 7  9  o 0 317.5   7.5   ?     ?   476.68    54.8229      296.704    54.8229      119.569    -125.177     
1 1 1 -31 7  8  o 0 432.9   8.5   ?     ?   445.996   3.66943      449.423    3.66943      57.9693    3.66943      
1 1 1 -31 7  7  o 0 4.6     1.6   ?     ?   186.294   50.1336      150.291    -129.866     318.052    -129.866     
1 1 1 -31 7  6  f 1 889.3   24.3  ?     ?   732.234   153.483      582.241    153.483      83.2951    -26.5174     
1 1 1 -31 7  5  o 0 557.3   17.5  ?     ?   474.334   -160.466     538.192    -160.466     107.677    -160.466     
1 1 1 -31 7  4  f 1 427.5   13.9  ?     ?   438.971   78.0116      440.013    78.0116      38.2338    78.0116      
1 1 1 -31 7  3  o 0 724.2   27.8  ?     ?   217.948   35.5969      860.715    35.5969      661.688    35.5969      
1 1 1 -31 7  2  o 0 1939.2  65.7  ?     ?   887.493   159.778      1060.1     159.778      237.84     159.778      
1 1 1 -31 7  1  o 0 210.9   5.4   ?     ?   78.5704   8.09074      239.365    8.09074      166.422    8.09074      
1 1 1 31  7  0  o 0 1051.1  19.4  ?     ?   453.445   -8.19111     943.311    -8.19111     520.496    -8.19111     
1 1 1 31  7  1  o 0 412.9   8.9   ?     ?   566.929   -92.3518     319.472    -92.3518     209.896    87.6482      
1 1 1 31  7  2  o 0 864     16.9  ?     ?   767.49    -95.8672     539.921    -95.8672     177.492    84.1328      
1 1 1 31  7  3  o 0 440.5   11.3  ?     ?   470.238   -172.046     436.857    -172.046     2.24331    -172.046     
1 1 1 31  7  4  f 1 8       4.6   ?     ?   249.727   130.879      191.547    -49.121      423.623    -49.121      
1 1 1 31  7  5  o 0 395.7   9.8   ?     ?   330.461   -100.381     496.962    -100.381     191.445    -100.381     
1 1 1 31  7  6  f 1 552     13.5  ?     ?   471.842   -171.736     543.264    -171.736     105.006    -171.736     
1 1 1 31  7  7  o 0 340     11.8  ?     ?   623.735   -151.089     194.853    -151.089     380.983    28.9111      
1 1 1 31  7  8  o 0 404.4   12.1  ?     ?   432.043   177.415      442.669    177.415      52.666     177.415      
1 1 1 31  7  9  o 0 169.8   7.6   ?     ?   301.038   115.136      228.391    115.136      42.8397    -64.8642     
1 1 1 31  7  10 o 0 562.7   15.1  ?     ?   481.376   77.9978      562.976    77.9978      126.512    77.9978      
1 1 1 31  7  11 o 0 367     12.3  ?     ?   265.97    -5.09675     531.163    -5.09675     290.705    -5.09675     
1 1 1 31  7  12 o 0 352.3   13.5  ?     ?   360.593   46.3311      508.695    46.3311      141.851    46.3311      
1 1 1 31  7  13 o 0 81.8    10    ?     ?   257.755   141.04       121.777    141.04       139.427    -38.9601     
1 1 1 31  7  14 o 0 524.4   18.1  ?     ?   407.236   79.4         674.233    79.4         270.527    79.4         
1 1 1 31  7  15 o 0 443.9   18.8  ?     ?   310.358   79.9905      680.367    79.9905      379.309    79.9905      
1 1 1 31  7  16 o 0 16.7    16    ?     ?   99.4712   -132.624     15.7041    -132.624     77.8823    47.3765      
1 1 1 31  7  17 o 0 43.4    17.6  ?     ?   169.284   -47.136      89.0312    -47.136      69.911     132.864      
1 1 1 31  7  18 o 0 167.9   19    ?     ?   316.543   54.9626      286.213    54.9626      11.7204    -125.037     
1 1 1 31  7  19 o 0 -3.4    23.1  ?     ?   137.737   36.8605      16.0768    -143.139     155.862    -143.139     
1 1 1 31  7  20 o 0 267.5   26.3  ?     ?   245.779   -84.8395     513.881    -84.8395     264.367    -84.8395     
1 1 1 31  7  21 o 0 29.9    25.2  ?     ?   99.4399   -56.0162     92.7103    -56.0162     2.08602    123.984      
1 1 1 31  7  22 o 0 21.9    24.2  ?     ?   51.3871   -137.356     75.643     -137.356     27.6793    -137.356     
1 1 1 -31 9  22 < 0 51.5    8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 9  21 o 0 108.3   8.7   ?     ?   224.707   -36.2503     246.872    -36.2503     55.8199    -36.2503     
1 1 1 -31 9  20 o 0 59.3    7.6   ?     ?   133.363   -44.3885     186.767    -44.3885     70.8852    -44.3885     
1 1 1 -31 9  19 o 0 126.8   7.8   ?     ?   184.058   -27.5384     309.54     -27.5384     144.492    -27.5384     
1 1 1 -31 9  18 o 0 16.8    6.1   ?     ?   15.8244   -29.6772     11.0807    -29.6772     3.75097    150.323      
1 1 1 -31 9  17 o 0 64.9    5.4   ?     ?   115.327   83.5687      204.81     83.5687      96.497     83.5687      
1 1 1 -31 9  16 o 0 29.9    4.3   ?     ?   200.377   -57.1898     31.2845    -57.1898     143.656    122.81       
1 1 1 -31 9  15 o 0 24.7    4.2   ?     ?   132.421   39.6284      42.2311    39.6284      73.3662    -140.372     
1 1 1 -31 9  14 o 0 41.3    3.8   ?     ?   181.09    154.579      84.0562    154.579      74.7205    -25.4207     
1 1 1 -31 9  13 o 0 92.2    4.1   ?     ?   134.093   148.539      244.583    148.539      123.081    148.539      
1 1 1 -31 9  12 o 0 246.8   6.4   ?     ?   286.763   -100.339     419.604    -100.34      157.888    -100.34      
1 1 1 -31 9  11 o 0 54.9    3     ?     ?   331.265   68.2522      2.86899    -111.748     312.415    -111.748     
1 1 1 -31 9  10 o 0 144.9   4.4   ?     ?   267.521   103.305      246.972    103.305      9.05238    -76.6954     
1 1 1 -31 9  9  o 0 108.9   3.5   ?     ?   198.182   -123.19      221.924    -123.19      31.1561    -123.19      
1 1 1 -31 9  8  o 0 497.9   10.1  ?     ?   346.855   -63.6494     660.475    -63.6494     324.813    -63.6494     
1 1 1 -31 9  7  o 0 236.6   5.5   ?     ?   317.119   -89.7777     315.353    -89.7777     42.2311    -89.7777     
1 1 1 -31 9  6  o 0 54.7    2.4   ?     ?   219.541   122.606      39.4626    122.606      150.453    -57.3941     
1 1 1 -31 9  5  o 0 395.7   8.5   ?     ?   318.53    133.976      505.327    133.976      228.693    133.976      
1 1 1 -31 9  4  o 0 171.3   4.9   ?     ?   320.083   -163.028     209.395    -163.028     67.1366    16.9718      
1 1 1 -31 9  3  o 0 5.8     2.1   ?     ?   51.3707   122.952      37.6463    -57.0485     82.1626    -57.0485     
1 1 1 -31 9  2  o 0 69.6    3.3   ?     ?   261.352   -69.7661     40.8834    -69.7661     186.186    110.234      
1 1 1 -31 9  1  o 0 757     20.9  ?     ?   603.679   -107.641     601.868    -107.641     76.2347    -107.641     
1 1 1 31  9  0  o 0 217.4   5.9   ?     ?   349.936   -134.658     263.352    -134.658     44.0679    45.3422      
1 1 1 31  9  1  o 0 208.8   6.5   ?     ?   458.847   122.76       169.159    122.76       234.38     -57.2395     
1 1 1 31  9  2  o 0 548.1   11.7  ?     ?   759.519   -166.954     303.509    -166.954     364.949    13.0459      
1 1 1 31  9  3  o 0 181.2   6     ?     ?   304.73    6.35775      239.47     6.35775      28.8197    -173.642     
1 1 1 31  9  4  o 0 43.7    4.8   ?     ?   172.279   151.744      24.3307    151.744      128.668    -28.2562     
1 1 1 31  9  5  o 0 8.1     5.3   ?     ?   210.485   115.926      139.335    -64.0744     326.178    -64.0744     
1 1 1 31  9  6  o 0 11.4    7.3   ?     ?   241.318   39.4515      142.74     -140.549     356.762    -140.549     
1 1 1 31  9  7  o 0 40.3    6.8   ?     ?   173.067   161.031      12.6126    161.031      140.673    -18.9687     
1 1 1 31  9  8  o 0 151.8   8.1   ?     ?   125.441   165.013      346.563    165.013      221.343    165.013      
1 1 1 31  9  9  o 0 682.5   16.9  ?     ?   422.83    -58.6178     791.719    -58.6178     370.596    -58.6178     
1 1 1 31  9  10 o 0 4.7     8.5   ?     ?   152.226   -178.463     90.8787    1.53676      239.433    1.53676      
1 1 1 31  9  11 o 0 57.7    10.8  ?     ?   329.847   114.686      5.13555    114.686      315.716    -65.3137     
1 1 1 31  9  12 o 0 46.7    10.5  ?     ?   94.6969   -24.3001     123.877    -24.3001     33.6382    -24.3001     
1 1 1 31  9  13 o 0 46.8    12.3  ?     ?   202.874   -169.756     90.2259    -169.756     97.4945    10.2435      
1 1 1 31  9  14 o 0 76.7    14.4  ?     ?   162.936   174.893      205.854    174.893      55.7919    174.893      
1 1 1 31  9  15 o 0 40.8    18.1  ?     ?   96.9864   73.0365      102.473    73.0365      13.2745    73.0365      
1 1 1 31  9  16 o 0 61.6    18.4  ?     ?   277.675   -157.694     72.0172    -157.694     184.155    22.306       
1 1 1 31  9  17 o 0 179     23.1  ?     ?   361.377   -108.733     257.644    -108.733     102.069    71.2668      
1 1 1 31  9  18 o 0 46.3    25.2  ?     ?   233.914   -101.485     39.3148    -101.485     193.742    78.5148      
1 1 1 31  9  19 o 0 25.8    26.4  ?     ?   21.423    -77.7552     38.2059    -77.7552     18.1506    -77.7552     
1 1 1 31  9  20 o 0 -4.8    28.5  ?     ?   102.051   28.1245      36.3942    28.1245      57.1998    -151.875     
1 1 1 -31 11 20 < 0 57.1    10    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 11 19 o 0 50.3    9.4   ?     ?   210.413   -25.2469     108.385    -25.2469     66.4852    154.753      
1 1 1 -31 11 18 o 0 56.9    7.8   ?     ?   171.126   -52.6897     156.299    -52.6897     12.9415    -52.6897     
1 1 1 -31 11 17 o 0 27.7    7     ?     ?   144.929   -58.9381     69.4412    -58.9381     54.7817    121.062      
1 1 1 -31 11 16 f 1 122.4   10.8  ?     ?   135.009   -142.204     327.688    -142.204     207.786    -142.204     
1 1 1 -31 11 15 o 0 9       5.1   ?     ?   117.977   127.103      28.76      -52.8971     137.59     -52.8971     
1 1 1 -31 11 14 o 0 22.2    5.8   ?     ?   157.687   133.165      24.1636    133.165      121.429    -46.8351     
1 1 1 -31 11 13 o 0 129.6   5.8   ?     ?   298.891   170.548      212.382    170.548      43.859     -9.45208     
1 1 1 -31 11 12 o 0 81.9    4.4   ?     ?   338.586   127.664      81.5581    127.664      208.341    -52.3365     
1 1 1 -31 11 11 o 0 54.8    4.5   ?     ?   165.43    -39.6975     135.839    -39.6975     6.79374    140.302      
1 1 1 -31 11 10 o 0 146.8   5     ?     ?   200.479   -63.7968     322.242    -63.7968     148.917    -63.7968     
1 1 1 -31 11 9  o 0 1.3     3     ?     ?   97.5043   101.152      68.2157    -78.8483     153.023    -78.8483     
1 1 1 -31 11 8  o 0 178.1   5.7   ?     ?   241.606   1.02058      342.435    1.02058      125.726    1.02058      
1 1 1 -31 11 7  o 0 165.8   5.4   ?     ?   331.281   80.0812      251.62     80.0812      47.0358    -99.9188     
1 1 1 -31 11 6  o 0 92.1    4     ?     ?   247.847   168.328      161.905    168.328      66.3804    -11.6725     
1 1 1 -31 11 5  o 0 287     7.5   ?     ?   344.883   42.3622      415.492    42.3622      96.5087    42.3622      
1 1 1 -31 11 4  o 0 489.1   11.6  ?     ?   622.989   -13.0797     404.908    -13.0797     173.424    166.92       
1 1 1 -31 11 3  o 0 19.1    3.1   ?     ?   125.108   36.2505      8.68111    -143.749     125.197    -143.749     
1 1 1 -31 11 2  o 0 201.8   7.9   ?     ?   304.957   113.835      328.453    113.835      43.6485    113.835      
1 1 1 -31 11 1  o 0 513.5   16.2  ?     ?   456.332   173.818      582.814    173.818      155.64     173.818      
1 1 1 31  11 0  o 0 485.2   11.6  ?     ?   468.547   -175.801     551.458    -175.801     106.649    -175.801     
1 1 1 31  11 1  o 0 335.3   9.8   ?     ?   388.761   143.228      451.559    143.228      82.2029    143.228      
1 1 1 31  11 2  o 0 20.6    4.3   ?     ?   119.969   -38.7381     0.273315   141.262      114.3      141.262      
1 1 1 31  11 3  o 0 54.8    5.7   ?     ?   197.404   116.915      99.8576    116.915      87.7691    -63.0847     
1 1 1 31  11 4  o 0 124.3   6.4   ?     ?   289.532   109.382      205.422    109.382      69.6568    -70.6176     
1 1 1 31  11 5  o 0 85.2    6.2   ?     ?   146.352   -28.8629     212.817    -28.8629     73.8868    -28.8629     
1 1 1 31  11 6  o 0 63.4    6.9   ?     ?   208.988   -67.2167     130.508    -67.2167     64.3196    112.783      
1 1 1 31  11 7  o 0 25.4    7.1   ?     ?   147.673   -19.9848     27.746     -19.9848     109.685    160.015      
1 1 1 31  11 8  o 0 45.7    9.2   ?     ?   175.148   10.5798      94.811     10.5798      67.835     -169.42      
1 1 1 31  11 9  o 0 31.6    8.5   ?     ?   66.4005   52.5124      68.6123    52.5124      8.64471    52.5124      
1 1 1 31  11 10 o 0 121.2   11.6  ?     ?   232.034   -112.373     259.579    -112.373     50.6727    -112.373     
1 1 1 31  11 11 o 0 165.4   13.3  ?     ?   189.521   -159.577     374.104    -159.577     203.44     -159.577     
1 1 1 31  11 12 o 0 2.2     13    ?     ?   78.0536   -27.3579     17.009     152.642      87.6262    152.642      
1 1 1 31  11 13 o 0 19.1    9.4   ?     ?   151.258   -83.847      6.16242    -83.847      141.722    96.153       
1 1 1 31  11 14 o 0 196.8   20.1  ?     ?   292.289   -67.9666     348.971    -67.9666     64.62      -67.9666     
1 1 1 31  11 15 o 0 43.8    19.4  ?     ?   83.3971   -129.061     134.295    -129.061     52.9971    -129.061     
1 1 1 31  11 16 f 1 15.2    24.8  ?     ?   159.016   -143.135     17.7497    -143.135     131.928    36.8653      
1 1 1 31  11 17 o 0 57.7    22.9  ?     ?   76.2022   39.5317      179.068    39.5317      109.637    39.5317      
1 1 1 31  11 18 o 0 -6.7    27.2  ?     ?   57.5857   78.0899      48.8299    78.0899      2.71889    -101.91      
1 1 1 31  11 19 < 0 -13.1   28.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 13 16 < 1 27.9    7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 13 15 o 0 28.9    8     ?     ?   74.3878   -173.191     115.663    -173.191     54.6687    -173.191     
1 1 1 -31 13 14 o 0 93.6    7.7   ?     ?   221.615   -37.5552     208.88     -37.5552     26.0112    -37.5552     
1 1 1 -31 13 13 o 0 18.5    6.7   ?     ?   73.4953   17.5775      46.083     17.5775      15.8647    -162.422     
1 1 1 -31 13 12 o 0 24.6    7.2   ?     ?   79.2852   116.557      72.3308    116.557      3.55592    116.557      
1 1 1 -31 13 11 o 0 13.2    5.2   ?     ?   43.2516   77.9367      11.6718    77.9367      27.4329    -102.063     
1 1 1 -31 13 10 o 0 83      5.5   ?     ?   237.247   -131.979     161.35     -131.979     54.5921    48.0211      
1 1 1 -31 13 9  o 0 39      4.4   ?     ?   170.997   -130.674     85.0512    -130.674     70.396     49.326       
1 1 1 -31 13 8  o 0 156.3   6.1   ?     ?   274.411   -24.0223     282.017    -24.0223     31.121     -24.0223     
1 1 1 -31 13 7  o 0 347.1   9     ?     ?   599.093   -20.261      272.858    -20.261      234.411    159.739      
1 1 1 -31 13 6  f 1 133.2   5.9   ?     ?   223.011   -39.3323     274.302    -39.3323     83.5862    -39.3323     
1 1 1 -31 13 5  o 0 197.3   6.7   ?     ?   390.877   119.218      252.016    119.218      81.995     -60.7818     
1 1 1 -31 13 4  o 0 291.9   9.3   ?     ?   432.723   -121.003     350.521    -121.003     17.4615    58.9969      
1 1 1 -31 13 3  o 0 20.2    4.9   ?     ?   25.5091   139.86       13.7614    139.86       8.00556    -40.1396     
1 1 1 -31 13 2  o 0 13.7    5     ?     ?   186.896   -16.6678     46.0438    163.332      205.996    163.332      
1 1 1 -31 13 1  f 1 125.4   6.6   ?     ?   225.486   29.8109      260.497    29.8109      66.0376    29.8109      
1 1 1 31  13 0  o 0 245.4   10.2  ?     ?   355.764   24.8357      361.179    24.8357      49.9635    24.8357      
1 1 1 31  13 1  f 1 89.1    7.1   ?     ?   127.781   -17.914      246.967    -17.914      134.556    -17.914      
1 1 1 31  13 2  o 0 117     7.2   ?     ?   154.464   -171.816     296.473    -171.816     161.272    -171.816     
1 1 1 31  13 3  o 0 61.4    7.9   ?     ?   105.893   139.801      178.771    139.801      86.1132    139.801      
1 1 1 31  13 4  o 0 85      8.9   ?     ?   296.595   -160.229     123.181    -160.229     136.149    19.7708      
1 1 1 31  13 5  o 0 66.8    7.5   ?     ?   53.8442   158.872      176.487    158.872      129.052    158.872      
1 1 1 31  13 6  f 1 0       8.9   ?     ?   49.6074   89.3881      21.1865    -90.6119     65.0436    -90.6119     
1 1 1 31  13 7  o 0 13.6    9.7   ?     ?   110.435   -34.824      3.65416    145.176      105.28     145.176      
1 1 1 31  13 8  o 0 2.6     8.7   ?     ?   76.4987   -101.136     28.8112    78.864       101.519    78.864       
1 1 1 31  13 9  o 0 -5.3    11.7  ?     ?   172.948   123.713      90.5674    -56.2873     254.458    -56.2873     
1 1 1 31  13 10 o 0 23.3    14    ?     ?   164.19    114.317      19.7181    114.317      136.504    -65.6827     
1 1 1 31  13 11 o 0 -33.2   15.1  ?     ?   56.9262   -156.067     28.6651    23.9331      80.8023    23.9331      
1 1 1 31  13 12 o 0 110     17.3  ?     ?   195.538   107.655      266.164    107.655      91.5703    107.655      
1 1 1 31  13 13 o 0 20.1    22    ?     ?   87.1673   115.508      61.9264    115.508      15.5311    -64.4923     
1 1 1 31  13 14 o 0 63.8    19.3  ?     ?   237.444   133.245      111.779    133.245      95.371     -46.7554     
1 1 1 -31 15 12 < 0 35.3    8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 15 11 < 0 161     10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -31 15 10 o 0 115.4   8.5   ?     ?   205.909   97.6795      260.993    97.6795      95.627     97.6795      
1 1 1 -31 15 9  o 0 11.2    8.3   ?     ?   29.3821   79.0998      20.3282    79.0998      3.42062    -100.9       
1 1 1 -31 15 8  o 0 42.1    6.7   ?     ?   190.288   -46.376      94.4587    -46.376      59.9164    133.624      
1 1 1 -31 15 7  o 0 -4      6.9   ?     ?   26.2876   -136.141     10.719     43.8586      32.1624    43.8586      
1 1 1 -31 15 6  o 0 6.9     7.1   ?     ?   80.8293   -117.423     10.38      62.5773      77.5204    62.5773      
1 1 1 -31 15 5  o 0 80.1    8.5   ?     ?   245.528   -5.32731     154.482    -5.32731     50.3912    174.673      
1 1 1 -31 15 4  o 0 67.4    8     ?     ?   170.025   1.16919      178.798    1.16919      36.3474    1.16919      
1 1 1 -31 15 3  o 0 27      7.6   ?     ?   84.6027   160.153      80.327     160.153      7.67368    160.153      
1 1 1 -31 15 2  o 0 47.3    7.9   ?     ?   228.18    -64.5437     74.2124    -64.5437     122.358    115.456      
1 1 1 -31 15 1  o 0 53.3    8.8   ?     ?   169.595   146.733      135.806    146.733      10.6898    -33.2669     
1 1 1 31  15 0  o 0 183.2   11.2  ?     ?   261.551   123.368      343.714    123.368      112.133    123.368      
1 1 1 31  15 1  o 0 34.8    9.9   ?     ?   215.433   95.5447      41.0241    95.5447      149.766    -84.4553     
1 1 1 31  15 2  o 0 46.1    9.5   ?     ?   92.7051   -94.7874     153.644    -94.7874     71.5604    -94.7874     
1 1 1 31  15 3  o 0 -4.4    10.3  ?     ?   74.3628   -101.451     24.3772    78.5485      88.8072    78.5485      
1 1 1 31  15 4  o 0 135.4   13    ?     ?   255.597   -119.139     268.445    -119.139     47.2218    -119.139     
1 1 1 31  15 5  o 0 8.5     9.8   ?     ?   103.58    -73.3465     3.96099    106.653      93.478     106.653      
1 1 1 31  15 6  o 0 6.6     11.4  ?     ?   57.185    107.824      5.36371    107.824      43.9618    -72.1761     
1 1 1 31  15 7  o 0 59.5    12.5  ?     ?   209.381   132.569      133.008    132.569      44.8181    -47.4312     
1 1 1 31  15 8  o 0 -10.9   16.3  ?     ?   51.2814   22.9031      0.196604   22.9031      43.2337    -157.097     
1 1 1 31  15 9  o 0 -3.1    16.3  ?     ?   94.4277   -159.951     9.91106    -159.951     69.9776    20.049       
1 1 1 31  15 10 < 0 77.5    16.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 31  15 11 < 0 90.6    17.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 0  26 < 1 11.4    16.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 0  25 o 0 -4.4    10.6  ?     ?   81.6377   180          13.6566    180          59.1772    1.61928e-15  
1 1 1 -32 0  24 o 0 26.1    9.7   ?     ?   31.0815   0            37.7149    0            9.30358    0            
1 1 1 -32 0  23 f 1 3.4     10    ?     ?   45.359    180          9.86593    180          34.6556    1.99755e-15  
1 1 1 -32 0  22 f 1 38.4    8.4   ?     ?   30.1405   0            51.744     0            22.0763    0            
1 1 1 -32 0  21 o 0 0       7.9   ?     ?   108.153   0            11.3348    0            87.1985    180          
1 1 1 -32 0  20 f 1 19.8    6.2   ?     ?   133.02    0            69.1112    0            52.3251    180          
1 1 1 -32 0  19 o 0 29.7    6.4   ?     ?   23.337    180          21.9021    180          0.0302195  5.08548e-12  
1 1 1 -32 0  18 o 0 11.9    5.9   ?     ?   230.27    180          47.2774    180          174.684    1.89904e-15  
1 1 1 -32 0  17 o 0 -2.6    5.5   ?     ?   212.125   0            6.37449    0            203.405    180          
1 1 1 -32 0  16 o 0 1459.4  36.8  ?     ?   686.791   0            807.678    0            199.662    0            
1 1 1 -32 0  15 o 0 1652.1  41    ?     ?   719.751   0            865.62     0            225.945    0            
1 1 1 -32 0  14 o 0 270.8   9.2   ?     ?   163.526   0            321.701    0            176.678    0            
1 1 1 -32 0  13 f 1 16.1    4.6   ?     ?   472.304   180          60.4819    180          372.119    1.14045e-15  
1 1 1 -32 0  12 o 0 76.8    4.7   ?     ?   133.485   180          100.421    180          21.9026    3.21709e-14  
1 1 1 -32 0  11 o 0 51.1    3.9   ?     ?   0.0992958 180          0.0552163  180          0.0373535  1.03722e-14  
1 1 1 -32 0  10 o 0 754.2   20.7  ?     ?   490.562   180          586.088    180          138.68     180          
1 1 1 -32 0  9  o 0 3.6     2.5   ?     ?   223.831   180          5.84773    180          199.162    2.06022e-16  
1 1 1 -32 0  8  o 0 366.8   12.5  ?     ?   397.947   180          411.738    180          41.0268    180          
1 1 1 -32 0  7  o 0 65.1    3.4   ?     ?   369.69    180          159.635    180          185.942    6.02399e-15  
1 1 1 -32 0  6  o 0 704.4   17.9  ?     ?   538.271   180          574.818    180          70.0935    180          
1 1 1 -32 0  5  o 0 1886.3  45.8  ?     ?   1179.43   0            943.159    0            165.865    180          
1 1 1 -32 0  4  f 1 273.8   7.7   ?     ?   280.083   180          373.766    180          94.351     180          
1 1 1 -32 0  3  o 0 443.9   12.1  ?     ?   667.554   0            484.129    0            172.059    180          
1 1 1 -32 0  1  o 0 632.4   24.2  ?     ?   782.034   180          580.04     180          191.918    2.12068e-14  
1 1 1 32  0  0  f 1 415.1   23.1  ?     ?   398.358   -6.46917e-14 470.361    0            74.3642    3.44489e-13  
1 1 1 32  0  1  o 0 265.6   11.5  ?     ?   314.967   180          374.434    180          62.391     180          
1 1 1 32  0  2  o 0 4352.9  106.5 ?     ?   1491.87   0            1529.59    0            49.2535    0            
1 1 1 32  0  3  o 0 512.9   15.4  ?     ?   670.301   0            525.974    0            148.075    180          
1 1 1 32  0  4  f 1 3161.3  110.7 ?     ?   1373.53   180          1240.42    180          79.6233    1.09311e-13  
1 1 1 32  0  5  o 0 510     15.5  ?     ?   267.3     180          497.323    180          241.562    180          
1 1 1 32  0  6  o 0 182     8.2   ?     ?   487.436   0            297.517    0            169.035    180          
1 1 1 32  0  7  o 0 838.9   24.4  ?     ?   797.733   0            640.17     0            123.31     180          
1 1 1 32  0  8  o 0 356.4   13.5  ?     ?   318.174   0            414.92     0            114.542    0            
1 1 1 32  0  9  o 0 788.1   23.7  ?     ?   563.664   180          619.455    180          87.8781    180          
1 1 1 32  0  10 o 0 27.8    9.4   ?     ?   43.7862   0            11.7901    0            29.4393    180          
1 1 1 32  0  11 o 0 83.8    11.4  ?     ?   58.7955   0            53.8785    0            2.18175    180          
1 1 1 32  0  12 o 0 105.5   13.9  ?     ?   263.626   180          200.913    180          49.8032    2.83063e-14  
1 1 1 32  0  13 f 1 183.6   15.9  ?     ?   22.446    0            52.2559    0            31.3109    0            
1 1 1 32  0  14 o 0 683.1   28.4  ?     ?   626.872   0            584.104    0            4.22045    0            
1 1 1 32  0  15 o 0 123.1   16.7  ?     ?   208.2     0            227.782    0            34.289     0            
1 1 1 32  0  16 o 0 127.2   22.4  ?     ?   187.27    180          266.021    180          70.3998    180          
1 1 1 32  0  17 o 0 152.9   25.2  ?     ?   215.925   180          301.02     180          80.5085    180          
1 1 1 32  0  18 o 0 51.3    20.8  ?     ?   4.2332    180          6.08959    180          1.86177    180          
1 1 1 32  0  19 o 0 5.4     30.5  ?     ?   206.582   0            62.9566    0            137.047    180          
1 1 1 32  0  20 f 1 161.1   32.3  ?     ?   194.233   180          299.264    180          110.729    180          
1 1 1 32  0  21 o 0 15.8    41.6  ?     ?   124.475   180          68.2213    180          52.226     9.16572e-15  
1 1 1 32  0  22 f 1 44      37.6  ?     ?   124.667   180          109.236    180          21.4572    3.57212e-14  
1 1 1 32  0  23 f 1 -36.9   44.1  ?     ?   79.232    180          33.941     180          46.3225    5.14122e-15  
1 1 1 -32 2  26 < 0 65.7    10.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 2  25 o 0 125.4   9.8   ?     ?   264.566   -126.423     259.653    -126.423     25.1537    -126.423     
1 1 1 -32 2  24 o 0 42.4    8.5   ?     ?   176.165   -118.596     109.129    -118.596     50.5488    61.4038      
1 1 1 -32 2  23 o 0 29.1    6.8   ?     ?   152.37    148.659      69.962     148.659      72.6593    -31.3412     
1 1 1 -32 2  22 o 0 205.4   8.3   ?     ?   234.793   -152.351     420.139    -152.351     191.99     -152.351     
1 1 1 -32 2  21 o 0 37.8    5.5   ?     ?   193.867   -147.67      67.9793    -147.67      107.337    32.3302      
1 1 1 -32 2  20 o 0 33.4    5.2   ?     ?   56.9215   145.363      73.1614    145.363      21.6338    145.363      
1 1 1 -32 2  19 o 0 365.5   9.4   ?     ?   284.32    -151.651     597.808    -151.65      339.003    -151.65      
1 1 1 -32 2  18 o 0 103.9   5.2   ?     ?   168.297   -1.13532     264.778    -1.13532     106.278    -1.13532     
1 1 1 -32 2  17 o 0 302.5   7.8   ?     ?   347.045   30.3973      453.213    30.3973      118.026    30.3973      
1 1 1 -32 2  16 o 0 88.3    4.4   ?     ?   238.436   81.9853      151.547    81.9853      84.6927    -98.0147     
1 1 1 -32 2  15 o 0 69.9    3.9   ?     ?   302.144   -178.441     33.7188    -178.441     233.389    1.55921      
1 1 1 -32 2  14 o 0 214     5.5   ?     ?   356.247   -170.755     255.065    -170.755     59.3144    9.24507      
1 1 1 -32 2  13 o 0 145.7   5.4   ?     ?   329.46    -39.7914     164.7      -39.7914     127.927    140.209      
1 1 1 -32 2  12 o 0 164.4   5.1   ?     ?   344.317   -23.0653     172.933    -23.0653     141.272    156.935      
1 1 1 -32 2  11 o 0 407.8   8.3   ?     ?   352.701   -85.1773     490.598    -85.1773     166.962    -85.1773     
1 1 1 -32 2  10 o 0 687.3   13.1  ?     ?   604.282   -162.656     530.48     -162.656     18.7366    17.3443      
1 1 1 -32 2  9  f 1 931.6   22    ?     ?   552.63    -143.762     758.234    -143.762     251.055    -143.762     
1 1 1 -32 2  8  o 0 2250.8  50.1  ?     ?   821.184   -143.979     1256.17    -143.979     503.25     -143.979     
1 1 1 -32 2  7  o 0 850.6   22.5  ?     ?   771.834   104.224      509.829    104.224      209.87     -75.7763     
1 1 1 -32 2  6  o 0 370.3   9.2   ?     ?   385.817   77.5634      415.771    77.5634      54.8029    77.5634      
1 1 1 -32 2  5  o 0 2619.6  63.2  ?     ?   1162.33   14.3872      1109.35    14.3872      18.594     14.3872      
1 1 1 -32 2  4  o 0 618.3   13.5  ?     ?   331.084   146.258      705.185    146.258      393.646    146.258      
1 1 1 -32 2  3  o 0 1853.1  37.4  ?     ?   762.342   -161.99      1129.33    -161.99      410.242    -161.99      
1 1 1 -32 2  2  o 0 1008.9  19.4  ?     ?   763.887   -144.664     671.489    -144.664     88.7844    35.3358      
1 1 1 -32 2  1  o 0 826.2   18.9  ?     ?   675.94    47.2059      617.505    47.2059      56.5633    -132.794     
1 1 1 32  2  0  o 0 1878.1  36.5  ?     ?   1055.88   91.9628      923.092    91.9628      130.348    -88.0372     
1 1 1 32  2  1  o 0 252.5   6.1   ?     ?   104.534   100.913      374.168    100.913      269.685    100.913      
1 1 1 32  2  2  o 0 1200    25.9  ?     ?   713.458   -68.9452     813.884    -68.9452     135.441    -68.9452     
1 1 1 32  2  3  o 0 2164.1  38.3  ?     ?   1221.15   63.0689      866.441    63.0689      296.417    -116.931     
1 1 1 32  2  4  o 0 1289.3  25.9  ?     ?   752.321   92.3661      836.215    92.3661      119.014    92.3661      
1 1 1 32  2  5  o 0 2608.2  54.2  ?     ?   1281.63   179.149      1011.2     179.149      211.529    -0.850875    
1 1 1 32  2  6  o 0 370.7   13.2  ?     ?   559.327   -147.178     276.802    -147.178     257.005    32.8222      
1 1 1 32  2  7  o 0 304.9   11.2  ?     ?   521.198   -120.003     231.149    -120.003     266.217    59.9973      
1 1 1 32  2  8  o 0 135.5   7     ?     ?   237.862   133.351      182.197    133.351      41.7008    -46.6494     
1 1 1 32  2  9  f 1 549.3   16.9  ?     ?   356.85    -4.58109     630.853    -4.58109     293.595    -4.58109     
1 1 1 32  2  10 o 0 184.5   8.9   ?     ?   306.163   -3.57522     237.823    -3.57522     57.34      176.425      
1 1 1 32  2  11 o 0 84.8    9.3   ?     ?   382.575   -89.9799     14.1506    90.0201      377.787    90.0201      
1 1 1 32  2  12 o 0 89.7    10    ?     ?   260.494   -103.259     77.3047    -103.259     169.633    76.7413      
1 1 1 32  2  13 o 0 208.4   10.6  ?     ?   397.263   -104.398     226.825    -104.398     140.745    75.6016      
1 1 1 32  2  14 o 0 348.3   14.6  ?     ?   227.934   -169.981     548.741    -169.981     336.782    -169.981     
1 1 1 32  2  15 o 0 218.4   13.5  ?     ?   455.198   94.6973      199.178    94.6973      222.34     -85.3027     
1 1 1 32  2  16 o 0 58.9    14    ?     ?   135.336   -100.647     119.809    -100.647     21.0313    79.353       
1 1 1 32  2  17 o 0 52.4    14.8  ?     ?   162.292   -52.5292     115.381    -52.5292     49.7086    127.471      
1 1 1 32  2  18 o 0 188     19.2  ?     ?   308.353   71.3499      335.132    71.3499      28.4333    71.3499      
1 1 1 32  2  19 o 0 5.2     18.5  ?     ?   183.174   -61.8666     48.9267    118.133      225.508    118.133      
1 1 1 32  2  20 o 0 204.3   22.1  ?     ?   347.872   -157.923     330.794    -157.923     3.64212    22.0766      
1 1 1 32  2  21 o 0 35.6    25.1  ?     ?   162.038   169.554      66.472     169.554      89.5897    -10.4458     
1 1 1 32  2  22 o 0 29      25.5  ?     ?   75.5917   5.49353      93.7882    5.49353      14.7449    5.49353      
1 1 1 32  2  23 o 0 -19.4   33.5  ?     ?   143.085   76.5267      5.38407    76.5267      138.085    -103.473     
1 1 1 32  2  24 o 0 57.1    35.8  ?     ?   120.211   -6.83848     161.268    -6.83848     45.7239    -6.83848     
1 1 1 32  2  25 o 0 -49.8   31    ?     ?   87.8032   -24.2735     14.8914    -24.2735     68.9804    155.727      
1 1 1 -32 4  25 < 0 7.5     7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 4  24 o 0 32.5    9.1   ?     ?   122.939   0.280656     109.611    0.280656     1.42005    0.280656     
1 1 1 -32 4  23 o 0 41.8    7.6   ?     ?   183.826   -14.4597     95.2105    -14.4597     74.1124    165.54       
1 1 1 -32 4  22 o 0 168.8   8.2   ?     ?   313.853   -141.338     281.776    -141.338     20.6927    38.6619      
1 1 1 -32 4  21 o 0 287.3   10    ?     ?   331.738   -143.777     454.014    -143.777     133.325    -143.777     
1 1 1 -32 4  20 o 0 62.6    7     ?     ?   79.277    125.317      180.525    125.317      109.829    125.317      
1 1 1 -32 4  19 o 0 177.2   6.6   ?     ?   207.388   58.7836      383.758    58.7836      197.725    58.7836      
1 1 1 -32 4  18 o 0 13.2    5.1   ?     ?   46.8929   58.1191      5.86166    -121.881     49.3989    -121.881     
1 1 1 -32 4  17 o 0 59.8    4.5   ?     ?   203.12    145.727      112.258    145.727      81.216     -34.2732     
1 1 1 -32 4  16 f 1 99.9    5.4   ?     ?   287.117   29.7436      154.447    29.7436      122.728    -150.256     
1 1 1 -32 4  15 o 0 28      4     ?     ?   198.428   -9.3705      22.8075    170.63       218.293    170.63       
1 1 1 -32 4  14 o 0 126.5   5.4   ?     ?   156.778   -79.6976     227.374    -79.6976     89.5711    -79.6976     
1 1 1 -32 4  13 o 0 54      3     ?     ?   202.16    -65.539      22.6578    -65.539      154.707    114.461      
1 1 1 -32 4  12 o 0 1119.2  20.5  ?     ?   732.543   1.02705      756.404    1.02705      109.579    1.02705      
1 1 1 -32 4  11 o 0 334.9   8     ?     ?   579.843   111.934      222.771    111.934      303.229    -68.0663     
1 1 1 -32 4  10 o 0 719.2   14.8  ?     ?   336.372   92.5911      786.233    92.5911      479.421    92.5911      
1 1 1 -32 4  9  o 0 1041.6  31.5  ?     ?   407.634   0.475088     968.439    0.475088     590.234    0.475088     
1 1 1 -32 4  8  o 0 131.2   4     ?     ?   220.248   -135.26      173.858    -135.26      26.0304    44.7399      
1 1 1 -32 4  7  o 0 1259.2  22.2  ?     ?   574.889   142.826      952.343    142.826      428.433    142.826      
1 1 1 -32 4  6  o 0 542.3   10    ?     ?   567.725   11.1236      439.527    11.1236      79.7826    -168.876     
1 1 1 -32 4  5  o 0 711.6   14.1  ?     ?   363.883   -65.3492     750.18     -65.3492     411.813    -65.3492     
1 1 1 -32 4  4  o 0 884.7   17.4  ?     ?   883.602   -80.5145     434.239    -80.5145     389.835    99.4855      
1 1 1 -32 4  3  o 0 943.7   18.3  ?     ?   652.225   172.238      685.478    172.238      75.6048    172.238      
1 1 1 -32 4  2  o 0 1314.7  23.4  ?     ?   771.116   -120.712     820.444    -120.712     97.753     -120.712     
1 1 1 -32 4  1  f 1 2345.6  41.4  ?     ?   946.508   100.992      1185.76    100.992      292.372    100.992      
1 1 1 32  4  0  o 0 2359.4  42    ?     ?   992.331   129.163      1155.19    129.163      222.667    129.163      
1 1 1 32  4  1  f 1 755.8   16.1  ?     ?   645.414   169.996      552.784    169.996      57.913     -10.0039     
1 1 1 32  4  2  o 0 67.9    4     ?     ?   129.819   159.186      53.3629    159.186      69.0293    -20.8142     
1 1 1 32  4  3  o 0 215.1   5.8   ?     ?   53.8667   -169.346     194.73     -169.346     143.883    -169.346     
1 1 1 32  4  4  o 0 76.2    4     ?     ?   154.05    82.632       73.5399    82.632       72.0076    -97.368      
1 1 1 32  4  5  o 0 148.2   5.6   ?     ?   275.529   172.051      186.109    172.051      70.9592    -7.94881     
1 1 1 32  4  6  o 0 1370.8  28    ?     ?   725.508   150.824      909.708    150.824      232.734    150.824      
1 1 1 32  4  7  o 0 455.2   11.1  ?     ?   379.258   170.631      518.362    170.631      164.596    170.631      
1 1 1 32  4  8  o 0 75.1    6.7   ?     ?   384.538   -8.166       43.847     171.834      402.241    171.834      
1 1 1 32  4  9  o 0 540     13.5  ?     ?   500.86    -49.1426     521.286    -49.1426     48.2463    -49.1426     
1 1 1 32  4  10 o 0 345.6   11.5  ?     ?   345.48    13.9394      437.277    13.9394      111.589    13.9394      
1 1 1 32  4  11 o 0 532.6   15.1  ?     ?   369.89    106.863      633.197    106.863      292.57     106.863      
1 1 1 32  4  12 o 0 849.2   20.8  ?     ?   671.323   118.71       648.381    118.71       31.9521    118.71       
1 1 1 32  4  13 o 0 246.2   11.5  ?     ?   302.615   98.0846      362.137    98.0846      82.7867    98.0846      
1 1 1 32  4  14 o 0 109.3   11.5  ?     ?   159.559   -119.31      200.359    -119.31      53.6419    -119.31      
1 1 1 32  4  15 o 0 315.5   14.2  ?     ?   389.265   -132.184     439.963    -132.184     37.5987    -132.184     
1 1 1 32  4  16 f 1 220     17.4  ?     ?   366.983   -29.1019     325.462    -29.1019     47.3322    150.898      
1 1 1 32  4  17 o 0 23.7    19.1  ?     ?   81.4532   172.607      34.8583    172.607      45.6523    -7.39303     
1 1 1 32  4  18 o 0 41      20.5  ?     ?   90.7955   -140.344     103.729    -140.344     16.728     -140.344     
1 1 1 32  4  19 o 0 19.3    22.1  ?     ?   186.479   -120.216     2.40316    59.7836      180.639    59.7836      
1 1 1 32  4  20 o 0 179.2   23.8  ?     ?   212.152   139.92       397.163    139.92       193.982    139.92       
1 1 1 32  4  21 o 0 1.6     24.6  ?     ?   109.346   140.822      13.2802    140.822      99.5902    -39.1782     
1 1 1 32  4  22 o 0 -12     30.7  ?     ?   208.169   -152.95      51.521     27.0503      259.148    27.0503      
1 1 1 32  4  23 o 0 9.9     26.8  ?     ?   77.474    -174.058     56.1546    -174.058     18.9074    5.94234      
1 1 1 -32 6  24 < 0 29      7.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 6  23 o 0 77.4    8.3   ?     ?   170.287   -162.271     219.084    -162.271     71.1346    -162.271     
1 1 1 -32 6  22 o 0 4.2     6.3   ?     ?   112.417   -140.666     39.3687    39.3335      139.456    39.3335      
1 1 1 -32 6  21 o 0 14.7    6.3   ?     ?   31.1224   74.0805      14.0026    74.0805      15.6029    -105.919     
1 1 1 -32 6  20 o 0 28.2    5.1   ?     ?   104.548   -130.57      80.594     -130.57      19.1543    49.4296      
1 1 1 -32 6  19 o 0 199.4   7.1   ?     ?   343.997   -128.516     304.461    -128.516     0.921964   51.4839      
1 1 1 -32 6  18 o 0 278.1   9.1   ?     ?   434.504   -140.024     346.278    -140.024     39.7733    39.976       
1 1 1 -32 6  17 f 1 165.2   7.7   ?     ?   296.728   119.863      291.045    119.863      24.632     119.863      
1 1 1 -32 6  16 o 0 32.3    4     ?     ?   165.407   107.23       50.7307    107.23       102.106    -72.7699     
1 1 1 -32 6  15 o 0 115     4.9   ?     ?   160.292   -145.924     277.065    -145.924     125.201    -145.924     
1 1 1 -32 6  14 o 0 243.7   6.2   ?     ?   375.214   171.762      326.874    171.762      37.7333    -8.238       
1 1 1 -32 6  13 o 0 106.2   4.8   ?     ?   298.733   171.801      145.9      171.801      146.501    -8.19941     
1 1 1 -32 6  12 f 1 95.3    3.6   ?     ?   237.975   59.5318      132.228    59.5318      76.5434    -120.468     
1 1 1 -32 6  11 o 0 1041.3  19.3  ?     ?   529.106   71.2349      862.942    71.2349      402.246    71.2349      
1 1 1 -32 6  10 o 0 870.7   16.2  ?     ?   780.418   -42.0545     542.74     -42.0545     140.766    137.945      
1 1 1 -32 6  9  o 0 38.6    2.7   ?     ?   165.802   -90.3231     12.1658    89.6769      158.164    89.6769      
1 1 1 -32 6  8  f 1 221.5   5     ?     ?   107.071   -89.4124     299.683    -89.4124     202.42     -89.4124     
1 1 1 -32 6  7  o 0 16      1.6   ?     ?   312.64    175.962      192.5      -4.03848     476.319    -4.03848     
1 1 1 -32 6  6  o 0 1171.3  30.5  ?     ?   785.674   123.263      733.576    123.263      17.4378    123.263      
1 1 1 -32 6  5  f 1 5.7     4.1   ?     ?   160.521   80.417       129.519    -99.583      278.906    -99.583      
1 1 1 -32 6  4  o 0 124.9   8.8   ?     ?   329.855   47.5102      104.014    47.5102      194.321    -132.49      
1 1 1 -32 6  3  o 0 338.4   13.9  ?     ?   488.12    -111.058     293.388    -111.058     149.329    68.9416      
1 1 1 -32 6  2  o 0 839.6   25.9  ?     ?   676.521   -114.389     585.93     -114.389     29.1457    65.6113      
1 1 1 -32 6  1  o 0 82      3     ?     ?   357.418   -129.997     6.42198    50.0032      332.041    50.0032      
1 1 1 32  6  0  o 0 75.4    5.7   ?     ?   172.067   98.2357      63.8659    98.2357      93.3847    -81.7643     
1 1 1 32  6  1  o 0 2160.6  38.5  ?     ?   909.753   -161.022     1134.8     -161.022     302.108    -161.022     
1 1 1 32  6  2  o 0 179.3   5.2   ?     ?   219.696   -115.399     261.708    -115.399     60.3724    -115.399     
1 1 1 32  6  3  o 0 697.8   14.2  ?     ?   532.056   -158.371     605.185    -158.371     117.147    -158.371     
1 1 1 32  6  4  o 0 139.4   5     ?     ?   222.391   -144.66      190.799    -144.66      13.3057    35.3401      
1 1 1 32  6  5  f 1 601.4   13.9  ?     ?   473.573   -139.815     586.048    -139.815     137.318    -139.815     
1 1 1 32  6  6  o 0 146.2   6.4   ?     ?   272.795   85.1691      189.346    85.1691      64.6728    -94.8309     
1 1 1 32  6  7  o 0 1840    34.7  ?     ?   769.956   164.646      1145.15    164.646      428.696    164.646      
1 1 1 32  6  8  f 1 90.4    7.3   ?     ?   172.431   148.799      103.811    148.799      57.2706    -31.2007     
1 1 1 32  6  9  o 0 476.3   12.8  ?     ?   613.618   82.0788      369.835    82.0788      187.648    -97.9212     
1 1 1 32  6  10 o 0 37.6    7.3   ?     ?   253.511   -100.097     53.5127    79.9025      283.331    79.9025      
1 1 1 32  6  11 o 0 185.9   9.7   ?     ?   86.5892   -47.8767     304.39     -47.8767     225.417    -47.8767     
1 1 1 32  6  12 f 1 165.6   9.5   ?     ?   199.768   -66.7545     295.375    -66.7545     112.826    -66.7545     
1 1 1 32  6  13 o 0 100.5   10.8  ?     ?   177.619   -148.451     225.468    -148.451     43.812     -148.451     
1 1 1 32  6  14 o 0 147.3   13.7  ?     ?   308.203   141.663      246.618    141.663      61.7937    -38.3372     
1 1 1 32  6  15 o 0 134.7   14.7  ?     ?   363.99    -171.183     168.793    -171.183     193.745    8.81699      
1 1 1 32  6  16 o 0 294.1   17.2  ?     ?   365.084   169.172      444.958    169.172      89.2416    169.172      
1 1 1 32  6  17 f 1 -8.1    17.7  ?     ?   254.324   -80.971      132.474    99.029       373.983    99.029       
1 1 1 32  6  18 o 0 248.8   21    ?     ?   323.395   -43.1483     417.946    -43.1483     113.125    -43.1483     
1 1 1 32  6  19 o 0 241.5   23.6  ?     ?   211.852   -95.288      494.74     -95.288      294.616    -95.288      
1 1 1 32  6  20 o 0 69.2    25.8  ?     ?   183.518   -115.862     160.605    -115.862     27.6782    64.138       
1 1 1 32  6  21 o 0 90.3    30.1  ?     ?   88.5956   162.203      273.173    162.203      185.984    162.203      
1 1 1 32  6  22 o 0 60      26.1  ?     ?   116.793   -157.273     178.719    -157.273     67.0512    -157.273     
1 1 1 32  6  23 o 0 43.5    29.5  ?     ?   117.97    173.112      131.21     173.112      20.5477    173.112      
1 1 1 -32 8  23 < 0 122.2   10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 8  22 o 0 121.7   9.3   ?     ?   291.394   -40.0446     220.807    -40.0446     27.6747    139.955      
1 1 1 -32 8  21 o 0 27.9    7.8   ?     ?   71.9284   -11.9403     104.276    -11.9403     42.3888    -11.9403     
1 1 1 -32 8  20 o 0 -8.7    7.3   ?     ?   57.858    -66.274      35.3253    113.726      87.3948    113.726      
1 1 1 -32 8  19 o 0 21.2    5.7   ?     ?   160.752   -46.6166     21.3004    -46.6166     129.961    133.383      
1 1 1 -32 8  18 f 1 17.3    4.9   ?     ?   123.293   72.5237      18.0349    72.5237      98.8541    -107.476     
1 1 1 -32 8  17 o 0 135     5.9   ?     ?   268.736   71.9537      251.796    71.9537      16.0875    71.9537      
1 1 1 -32 8  16 o 0 47.8    4.5   ?     ?   236.881   26.7905      68.1072    26.7905      139.709    -153.21      
1 1 1 -32 8  15 o 0 81.8    5.3   ?     ?   261.095   72.8584      145.869    72.8584      84.2769    -107.142     
1 1 1 -32 8  14 o 0 42.9    3.4   ?     ?   85.0619   176.771      105.284    176.771      27.7709    176.771      
1 1 1 -32 8  13 o 0 15.4    2.9   ?     ?   182.41    -122.101     55.5764    57.8993      225.907    57.8993      
1 1 1 -32 8  12 o 0 181.4   5.1   ?     ?   274.673   38.4853      322.068    38.4853      63.7545    38.4853      
1 1 1 -32 8  11 o 0 283.5   7.4   ?     ?   276.857   75.2216      463.123    75.2216      196.365    75.2216      
1 1 1 -32 8  10 o 0 167.7   4.7   ?     ?   242.916   58.2948      311.389    58.2948      75.8861    58.2948      
1 1 1 -32 8  9  o 0 210.9   5.5   ?     ?   209.457   138.295      346.791    138.295      165.916    138.295      
1 1 1 -32 8  8  o 0 73.7    2.8   ?     ?   275.181   82.1836      60.1908    82.1836      178.688    -97.8164     
1 1 1 -32 8  7  o 0 53.4    2.5   ?     ?   179.25    93.1759      27.0078    93.1759      127.983    -86.8241     
1 1 1 -32 8  6  o 0 281.7   10.3  ?     ?   448.225   148.075      273.376    148.075      115.865    -31.9246     
1 1 1 -32 8  5  o 0 178.4   7.6   ?     ?   411.885   114.832      157.23     114.832      201.84     -65.1684     
1 1 1 -32 8  4  o 0 518.5   15.8  ?     ?   444.03    -33.4446     532.347    -33.4446     143.925    -33.4446     
1 1 1 -32 8  3  o 0 290.2   11.5  ?     ?   266.018   -117.794     415.353    -117.794     181.952    -117.794     
1 1 1 -32 8  2  o 0 2029.7  55.6  ?     ?   844.502   110.166      1130.94    110.166      372.273    110.166      
1 1 1 -32 8  1  o 0 349.2   8.2   ?     ?   494.208   -168.619     307.992    -168.619     136.944    11.3814      
1 1 1 32  8  0  o 0 592.8   14.5  ?     ?   373.458   -141.744     648.299    -141.744     309.656    -141.744     
1 1 1 32  8  1  o 0 575     11.8  ?     ?   461.727   48.5418      564.813    48.5418      145.603    48.5418      
1 1 1 32  8  2  o 0 602.2   12.4  ?     ?   381.599   -82.2572     666.281    -82.2572     326.727    -82.2572     
1 1 1 32  8  3  o 0 140.1   6     ?     ?   198.478   -19.3075     222.82     -19.3075     46.1125    -19.3075     
1 1 1 32  8  4  o 0 455.4   10.5  ?     ?   414.412   -19.1583     503.622    -19.1583     134.604    -19.1583     
1 1 1 32  8  5  o 0 29.9    5     ?     ?   169.945   107.533      41.2733    -72.4672     192.566    -72.4672     
1 1 1 32  8  6  o 0 469.4   12.7  ?     ?   464.632   70.483       477.468    70.4829      64.1074    70.4829      
1 1 1 32  8  7  o 0 156.2   7.7   ?     ?   268.837   101.667      237.056    101.667      3.94002    -78.3327     
1 1 1 32  8  8  o 0 161.5   8.9   ?     ?   125.03    136.094      292.047    136.094      180.141    136.094      
1 1 1 32  8  9  o 0 36.3    7.6   ?     ?   203.737   140.065      13.1841    -39.9353     195.16     -39.9353     
1 1 1 32  8  10 o 0 222.9   11.2  ?     ?   332.974   164.323      342.854    164.323      7.89858    164.323      
1 1 1 32  8  11 o 0 106.1   10.4  ?     ?   147.013   113.431      245.627    113.431      98.1847    113.431      
1 1 1 32  8  12 o 0 82.5    11.4  ?     ?   96.1807   -104.068     212.828    -104.068     118.383    -104.068     
1 1 1 32  8  13 o 0 255.1   13.4  ?     ?   463.119   -147.403     295.001    -147.403     150.382    32.5971      
1 1 1 32  8  14 o 0 54.7    13.6  ?     ?   153.868   120.79       138.293    120.79       9.02127    -59.2095     
1 1 1 32  8  15 o 0 59.3    13.7  ?     ?   187.87    152.822      141.242    152.822      33.282     -27.1776     
1 1 1 32  8  16 o 0 53.4    16.4  ?     ?   248.121   -134.765     74.084     -134.765     156.028    45.2351      
1 1 1 32  8  17 o 0 17      20.8  ?     ?   139.281   -88.5068     19.2193    -88.5068     110.319    91.4932      
1 1 1 32  8  18 f 1 63.5    18.6  ?     ?   64.5479   69.6006      200.813    69.6006      135.724    69.6006      
1 1 1 32  8  19 o 0 38.3    21.8  ?     ?   176.049   -73.4304     62.9806    -73.4304     113.759    106.57       
1 1 1 32  8  20 o 0 48.4    27.4  ?     ?   240.807   -3.13329     49.0374    -3.13329     178.058    176.867      
1 1 1 32  8  21 o 0 70.7    28.9  ?     ?   100.236   -60.7049     213.581    -60.7049     120.995    -60.7049     
1 1 1 32  8  22 < 0 47.7    28    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 10 21 < 0 85.8    9.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 10 20 o 0 170.8   9.9   ?     ?   215.682   -31.1142     364.394    -31.1142     183.787    -31.1142     
1 1 1 -32 10 19 o 0 18.1    6.8   ?     ?   57.3519   -78.1505     50.8966    -78.1505     2.46938    -78.1505     
1 1 1 -32 10 18 o 0 108.8   6.8   ?     ?   238.761   -130.216     231.646    -130.216     25.2975    -130.216     
1 1 1 -32 10 17 o 0 51.4    5.7   ?     ?   146.227   -137.529     151.546    -137.529     21.2239    -137.529     
1 1 1 -32 10 16 o 0 115.7   6.4   ?     ?   189.611   -160.875     277.587    -160.875     101.093    -160.875     
1 1 1 -32 10 15 f 1 17.6    4.1   ?     ?   122.228   109.185      20.4989    109.185      94.0053    -70.8148     
1 1 1 -32 10 14 o 0 117.6   5.2   ?     ?   230.231   165.832      244.429    165.832      45.1118    165.832      
1 1 1 -32 10 13 o 0 188.8   6     ?     ?   271.497   150.502      340.619    150.502      105.788    150.502      
1 1 1 -32 10 12 o 0 21.7    3.3   ?     ?   16.3253   15.7018      10.3029    15.7018      3.86848    -164.298     
1 1 1 -32 10 11 o 0 23.4    2.9   ?     ?   166.134   151.936      19.7943    151.936      125.418    -28.0642     
1 1 1 -32 10 10 o 0 164.9   4.7   ?     ?   337.921   116.511      244.8      116.511      60.0568    -63.4886     
1 1 1 -32 10 9  o 0 59.2    2.9   ?     ?   187.407   -121.456     130.011    -121.456     40.0679    58.5439      
1 1 1 -32 10 8  o 0 0.1     2.3   ?     ?   161.922   -18.056      136.833    161.944      287.101    161.944      
1 1 1 -32 10 7  o 0 23.8    2.3   ?     ?   129.666   117.015      11.8283    117.015      109.11     -62.9854     
1 1 1 -32 10 6  o 0 77.6    3.1   ?     ?   242.319   102.221      116.002    102.221      115.072    -77.7789     
1 1 1 -32 10 5  o 0 19      2.3   ?     ?   125.053   44.6209      28.8965    -135.379     148.634    -135.379     
1 1 1 -32 10 4  o 0 90.6    3.6   ?     ?   250.244   -72.6617     144.281    -72.6617     96.1993    107.338      
1 1 1 -32 10 3  o 0 79.5    3.8   ?     ?   149.778   166.782      170.553    166.782      26.16      166.782      
1 1 1 -32 10 2  o 0 456.3   15.5  ?     ?   189.694   148.687      735.8      148.687      552.425    148.687      
1 1 1 -32 10 1  o 0 102.6   4.3   ?     ?   252.206   -169.639     172.603    -169.639     71.7645    10.3611      
1 1 1 32  10 0  o 0 574.5   12.7  ?     ?   480.659   159.538      625.869    159.538      154.47     159.538      
1 1 1 32  10 1  o 0 249.4   7.3   ?     ?   297.294   -144.612     405.931    -144.612     114.084    -144.612     
1 1 1 32  10 2  o 0 253     7.3   ?     ?   322.139   -95.7323     390.562    -95.7323     74.1394    -95.7323     
1 1 1 32  10 3  o 0 481.3   11.2  ?     ?   398.187   -123.733     607.132    -123.733     215.934    -123.733     
1 1 1 32  10 4  o 0 127.1   6.7   ?     ?   263.331   -68.5081     220.444    -68.5081     38.2107    111.492      
1 1 1 32  10 5  o 0 396.3   10.3  ?     ?   435.37    -67.6916     477.5      -67.6916     50.1269    -67.6916     
1 1 1 32  10 6  o 0 69      7     ?     ?   245.515   -117.336     92.3597    -117.336     148.391    62.6637      
1 1 1 32  10 7  o 0 188     8.9   ?     ?   328.008   173.9        295.146    173.9        20.4065    -6.10036     
1 1 1 32  10 8  o 0 60.1    7.9   ?     ?   213.324   -89.7295     106.388    -89.7295     98.4347    90.2705      
1 1 1 32  10 9  o 0 138.5   9.9   ?     ?   239.512   -108.348     286.634    -108.348     61.0548    -108.348     
1 1 1 32  10 10 o 0 20.1    9.8   ?     ?   90.8248   -147.31      13.0636    -147.31      72.2312    32.6901      
1 1 1 32  10 11 o 0 44.5    10.3  ?     ?   144.9     27.5859      116.263    27.5859      15.9824    -152.414     
1 1 1 32  10 12 o 0 57      12.7  ?     ?   192.703   -107.301     128.83     -107.301     47.031     72.6987      
1 1 1 32  10 13 o 0 174.7   15.9  ?     ?   362.785   -111.413     254.048    -111.413     75.608     68.5865      
1 1 1 32  10 14 o 0 45      15.6  ?     ?   150.511   -111.169     109.395    -111.169     27.9121    68.8314      
1 1 1 32  10 15 f 1 35.8    17.1  ?     ?   141.328   102.72       81.2094    102.72       58.7333    -77.2798     
1 1 1 32  10 16 o 0 -43.5   19.5  ?     ?   55.2016   -142.82      24.6233    37.1796      79.1007    37.1796      
1 1 1 32  10 17 o 0 197.8   26.5  ?     ?   220.808   -60.423      419.44     -60.423      210.158    -60.423      
1 1 1 32  10 18 o 0 37.4    27.1  ?     ?   151.646   19.1771      85.0446    19.1771      54.7621    -160.823     
1 1 1 32  10 19 o 0 28.8    29.4  ?     ?   104.988   126.294      98.4986    126.294      3.63962    126.294      
1 1 1 32  10 20 < 0 16      26.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 12 18 < 0 -2.9    7.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 12 17 o 0 -1.4    6.6   ?     ?   74.7637   108.848      23.0589    -71.1522     84.5809    -71.1522     
1 1 1 -32 12 16 o 0 123.8   7.4   ?     ?   253.15    125.499      248.25     125.499      38.431     125.499      
1 1 1 -32 12 15 o 0 23.8    5.6   ?     ?   167.825   100.807      38.2093    100.807      103.998    -79.1928     
1 1 1 -32 12 14 o 0 32.4    5.3   ?     ?   136.981   24.6112      89.1709    24.6112      30.3864    -155.389     
1 1 1 -32 12 13 o 0 90.4    5.8   ?     ?   133.295   15.8628      256.533    15.8628      135.166    15.8628      
1 1 1 -32 12 12 o 0 244.7   7.8   ?     ?   288.226   57.7184      407.646    57.7184      143.217    57.7184      
1 1 1 -32 12 11 o 0 42.1    4.5   ?     ?   175.689   -6.2773      93.4674    -6.2773      67.6562    173.723      
1 1 1 -32 12 10 o 0 127.4   5.1   ?     ?   236.426   -57.1941     254.431    -57.1941     53.3605    -57.1941     
1 1 1 -32 12 9  o 0 69.5    4.6   ?     ?   114.937   -58.503      202.428    -58.503      104.075    -58.503      
1 1 1 -32 12 8  o 0 366.1   9.5   ?     ?   476.779   -97.7067     403.946    -97.7067     2.8061     82.2933      
1 1 1 -32 12 7  o 0 345.8   9.8   ?     ?   434.624   -105.5       417.359    -105.5       44.6302    -105.5       
1 1 1 -32 12 6  o 0 52.8    3.7   ?     ?   160.5     -171.827     131.281    -171.827     6.49874    8.17328      
1 1 1 -32 12 5  o 0 88.2    4.5   ?     ?   215.699   85.9463      191.156    85.9463      5.19583    85.9463      
1 1 1 -32 12 4  o 0 343.1   9.1   ?     ?   417.711   -39.0938     434.694    -39.0938     73.1916    -39.0938     
1 1 1 -32 12 3  o 0 128.1   5.2   ?     ?   89.8922   -85.9505     333.347    -85.9505     255.288    -85.9505     
1 1 1 -32 12 2  o 0 136.8   6.6   ?     ?   210.506   95.9773      298.802    95.9773      115.473    95.9773      
1 1 1 -32 12 1  o 0 9.9     4.3   ?     ?   47.4403   92.8708      14.7626    -87.1292     57.238     -87.1292     
1 1 1 32  12 0  o 0 32.3    4.6   ?     ?   84.2981   -96.5519     67.0965    -96.5519     9.70961    83.4481      
1 1 1 32  12 1  o 0 117.1   6.1   ?     ?   261.196   -33.5746     218.489    -33.5746     19.6523    146.425      
1 1 1 32  12 2  o 0 71.7    6.3   ?     ?   56.5204   104.815      178.501    104.815      128.239    104.815      
1 1 1 32  12 3  o 0 295.3   9.1   ?     ?   453.781   149.125      355.468    149.125      48.0142    -30.8752     
1 1 1 32  12 4  o 0 200.2   8.2   ?     ?   399.005   165.186      264.69     165.186      89.8915    -14.8137     
1 1 1 32  12 5  o 0 16.1    7.1   ?     ?   330.32    111.172      141.72     -68.8279     434.977    -68.8279     
1 1 1 32  12 6  o 0 236.6   9.5   ?     ?   316.453   34.9938      387.429    34.9938      105.823    34.9938      
1 1 1 32  12 7  o 0 153     10.4  ?     ?   316.23    74.9108      250.732    74.9108      30.1537    -105.089     
1 1 1 32  12 8  o 0 206.1   11.6  ?     ?   331.192   85.5269      327.026    85.5269      33.5279    85.5269      
1 1 1 32  12 9  o 0 42.3    10.8  ?     ?   134.153   154.213      115.817    154.213      3.77861    -25.7873     
1 1 1 32  12 10 o 0 124.4   13.9  ?     ?   198.129   -158.85      298.747    -158.85      114.165    -158.85      
1 1 1 32  12 11 o 0 -2.4    14.8  ?     ?   84.4804   22.1251      19.6006    -157.875     100.793    -157.875     
1 1 1 32  12 12 o 0 52.4    15.4  ?     ?   119.715   52.6932      165.356    52.6932      49.9163    52.6932      
1 1 1 32  12 13 o 0 -25.3   19.9  ?     ?   136.865   -55.7468     50.1769    124.253      177.124    124.253      
1 1 1 32  12 14 o 0 -10.2   11.9  ?     ?   89.1769   150.942      34.2067    -29.0576     114.787    -29.0576     
1 1 1 32  12 15 o 0 19.4    21.5  ?     ?   126.865   64.7923      52.8141    64.7923      59.7033    -115.208     
1 1 1 32  12 16 o 0 21.5    21.7  ?     ?   62.587    80.003       88.5048    80.003       33.2029    80.003       
1 1 1 32  12 17 < 0 30.8    28    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 14 14 < 0 27.8    8     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 14 13 < 0 25.1    6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 14 12 o 0 103.3   8.1   ?     ?   230.409   176.307      221.538    176.307      34.3191    176.307      
1 1 1 -32 14 11 f 1 20.9    7.5   ?     ?   171.259   94.1515      21.0144    94.1515      119.568    -85.8485     
1 1 1 -32 14 10 o 0 26.4    5.5   ?     ?   94.8647   -116.524     84.7208    -116.524     5.68557    -116.524     
1 1 1 -32 14 9  o 0 137.2   7.1   ?     ?   323.33    -116.535     213.29     -116.535     57.8064    63.4652      
1 1 1 -32 14 8  o 0 48.7    5.5   ?     ?   164.188   -36.8131     127.121    -36.8131     14.3043    143.187      
1 1 1 -32 14 7  o 0 44      5.3   ?     ?   201.939   -1.72309     85.4795    -1.72309     89.4079    178.277      
1 1 1 -32 14 6  o 0 72.5    5.9   ?     ?   157.185   89.6965      194.791    89.6965      53.2212    89.6965      
1 1 1 -32 14 5  o 0 126.6   6.7   ?     ?   132.379   20.8741      331.603    20.8741      211.839    20.8741      
1 1 1 -32 14 4  o 0 5.8     5.4   ?     ?   42.2631   -78.9599     12.4816    101.04       50.8713    101.04       
1 1 1 -32 14 3  f 1 5       5.6   ?     ?   45.6839   81.0771      15.3674    -98.9229     57.2264    -98.9229     
1 1 1 -32 14 2  o 0 47.1    6.7   ?     ?   125.387   97.5759      139.108    97.5759      25.3054    97.5759      
1 1 1 -32 14 1  o 0 94.3    8.5   ?     ?   167.316   73.0245      240.484    73.0245      88.2232    73.0245      
1 1 1 32  14 0  o 0 171.8   10.4  ?     ?   240.449   60.1046      341.787    60.1046      117.898    60.1046      
1 1 1 32  14 1  o 0 68.9    6.9   ?     ?   182.076   -22.3832     171.879    -22.3832     2.27724    -22.3832     
1 1 1 32  14 2  o 0 36.3    8     ?     ?   61.3447   -58.9876     104.056    -58.9876     46.9159    -58.9876     
1 1 1 32  14 3  f 1 37.2    8.5   ?     ?   61.7811   142.602      118.568    142.602      60.3169    142.602      
1 1 1 32  14 4  o 0 8       8.1   ?     ?   3.77341   -87.8361     0.0766681  92.1639      3.61318    92.1639      
1 1 1 32  14 5  o 0 52.8    8.9   ?     ?   123.68    -172.111     165.626    -172.111     49.8611    -172.111     
1 1 1 32  14 6  o 0 24.8    8.9   ?     ?   108.26    -46.1377     60.7622    -46.1377     40.3927    133.862      
1 1 1 32  14 7  o 0 52.8    14.5  ?     ?   64.5889   175.094      171.495    175.094      113.304    175.094      
1 1 1 32  14 8  o 0 14.9    13    ?     ?   44.314    90.2791      21.2323    90.2791      18.5872    -89.7209     
1 1 1 32  14 9  o 0 52.1    15.6  ?     ?   187.234   65.1987      121.416    65.1987      42.813     -114.801     
1 1 1 32  14 10 o 0 75.9    16.7  ?     ?   189.373   52.4179      190.38     52.4179      27.0181    52.4179      
1 1 1 32  14 11 f 1 22.5    15.6  ?     ?   76.2731   -73.2276     70.9604    -73.2276     5.08898    -73.2276     
1 1 1 32  14 12 o 0 8.7     17    ?     ?   106.803   153.793      32.2623    153.793      59.3021    -26.2075     
1 1 1 32  14 13 < 0 81      20.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 16 7  < 0 33      8.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 16 6  < 0 7.7     8.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 16 5  < 0 5.5     7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 16 4  < 0 13.2    8.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -32 16 3  o 0 39.9    8.4   ?     ?   163.845   15.0308      106.356    15.0308      25.0585    -164.969     
1 1 1 -32 16 2  o 0 39.3    8.8   ?     ?   149.69    16.5753      113.862    16.5753      6.59463    -163.425     
1 1 1 -32 16 1  o 0 59.2    9.5   ?     ?   141.868   164.335      178.88     164.335      64.3931    164.335      
1 1 1 32  16 0  o 0 85.9    10.9  ?     ?   204.375   155.972      205.584    155.972      35.9136    155.972      
1 1 1 32  16 1  o 0 179     12    ?     ?   232.027   117.333      360.605    117.333      167.957    117.333      
1 1 1 32  16 2  o 0 143.6   13    ?     ?   187.192   88.5717      333.705    88.5717      178.33     88.5717      
1 1 1 32  16 3  < 0 13.4    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 32  16 4  < 0 33.8    13.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 32  16 5  < 0 102.7   15.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 32  16 6  < 0 20.1    11.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 32  16 7  < 0 118.6   19.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 1  26 < 0 -8.7    9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 1  25 f 1 19.9    7.6   ?     ?   63.3403   166.739      77.5364    166.739      21.0855    166.739      
1 1 1 -33 1  24 f 1 57.1    7.3   ?     ?   164.926   -83.144      166.541    -83.144      16.2475    -83.144      
1 1 1 -33 1  23 o 0 -2.6    6.7   ?     ?   102.58    -76.0649     59.474     103.935      155.499    103.935      
1 1 1 -33 1  22 o 0 289.9   9.4   ?     ?   264.607   -56.9919     520.736    -56.9919     263.632    -56.9919     
1 1 1 -33 1  21 o 0 31.5    4.9   ?     ?   123.498   -54.0782     83.3067    -54.0782     28.3514    125.922      
1 1 1 -33 1  20 f 1 72.1    5.4   ?     ?   83.1718   35.4357      213.335    35.4357      137.684    35.4357      
1 1 1 -33 1  19 o 0 190.5   6.3   ?     ?   303.505   -114.724     336.355    -114.724     60.2231    -114.724     
1 1 1 -33 1  18 o 0 17.6    4.1   ?     ?   79.8616   -154.755     8.91124    -154.755     66.2529    25.245       
1 1 1 -33 1  17 o 0 49      4.1   ?     ?   214.171   -41.2929     71.1045    -41.2929     135.584    138.707      
1 1 1 -33 1  16 o 0 237.3   6.3   ?     ?   423.361   26.1396      279.541    26.1396      139.524    -153.86      
1 1 1 -33 1  15 o 0 294.8   6.7   ?     ?   496.506   62.8724      258.614    62.8724      179.836    -117.128     
1 1 1 -33 1  14 o 0 150.2   4.6   ?     ?   157.987   90.3617      242.132    90.3617      102.888    90.3617      
1 1 1 -33 1  13 o 0 77.4    3.9   ?     ?   148.729   -105.601     92.6866    -105.601     39.2285    74.3994      
1 1 1 -33 1  12 f 1 150     4.9   ?     ?   301.15    137.231      174.89     137.231      100.907    -42.7693     
1 1 1 -33 1  11 o 0 25.2    3     ?     ?   89.7411   37.5156      34.0325    -142.484     116.238    -142.484     
1 1 1 -33 1  10 o 0 77.5    2.8   ?     ?   265.171   -161.997     39.5021    -161.997     207.554    18.0028      
1 1 1 -33 1  9  o 0 70.7    2.7   ?     ?   291.617   85.2461      6.96011    85.2461      258.781    -94.7539     
1 1 1 -33 1  8  o 0 205.2   5.4   ?     ?   622.56    59.7658      8.56831    59.7658      561.051    -120.234     
1 1 1 -33 1  7  o 0 145.2   5     ?     ?   442.312   132.452      57.789     132.452      353.752    -47.5477     
1 1 1 -33 1  6  o 0 900.8   20.7  ?     ?   751.418   107.088      565.421    107.088      136.028    -72.912      
1 1 1 -33 1  5  o 0 1115    24.9  ?     ?   420.168   -17.7964     1001.21    -17.7964     607.813    -17.7964     
1 1 1 -33 1  4  o 0 770.2   19.7  ?     ?   701.507   177.692      515.409    177.692      143.166    -2.30766     
1 1 1 -33 1  3  o 0 421.9   10.3  ?     ?   495.305   -105.479     384.31     -105.479     81.8204    74.5212      
1 1 1 -33 1  2  o 0 169.8   4.4   ?     ?   244.489   63.9825      242.645    63.9825      12.0421    63.9825      
1 1 1 -33 1  1  f 1 1843.4  33.2  ?     ?   940.308   6.98671      1010.02    6.98671      69.5471    6.98671      
1 1 1 33  1  0  o 0 2250.5  46.6  ?     ?   916.657   0.763143     1245.9     0.763143     332.628    0.763143     
1 1 1 33  1  1  f 1 336.7   7.5   ?     ?   211.264   136.576      495.97     136.576      294.658    136.576      
1 1 1 33  1  2  o 0 363.4   9.4   ?     ?   377.827   -15.0105     420.398    -15.0105     61.6316    -15.0105     
1 1 1 33  1  3  o 0 1671.2  29.8  ?     ?   986.759   79.0138      836.334    79.0138      101.939    -100.986     
1 1 1 33  1  4  o 0 1318    27.8  ?     ?   1031.62   162.611      594.163    162.611      387.836    -17.389      
1 1 1 33  1  5  o 0 598.7   14.1  ?     ?   589.189   173.715      479.615    173.715      81.6557    -6.28488     
1 1 1 33  1  6  o 0 300.7   9.8   ?     ?   633.564   92.5319      125.989    92.5319      477.769    -87.4681     
1 1 1 33  1  7  o 0 886.1   23.4  ?     ?   711.644   -48.6786     602.502    -48.6786     75.6117    131.321      
1 1 1 33  1  8  o 0 1474.2  31    ?     ?   752.483   -95.7268     952.385    -95.7268     245.079    -95.7268     
1 1 1 33  1  9  o 0 526.1   13.2  ?     ?   600.133   68.3634      407.395    68.3634      156.124    -111.637     
1 1 1 33  1  10 o 0 131     8.2   ?     ?   181.636   -168.739     194.663    -168.739     21.8677    -168.739     
1 1 1 33  1  11 o 0 34.1    8.7   ?     ?   141.015   -103.599     33.747     76.4009      167.623    76.4009      
1 1 1 33  1  12 f 1 12      9.5   ?     ?   153.504   106.919      104.362    -73.0812     250.469    -73.0812     
1 1 1 33  1  13 o 0 57.1    9.4   ?     ?   157.402   18.1959      42.9358    18.1959      102.562    -161.804     
1 1 1 33  1  14 o 0 472.1   15.6  ?     ?   598.749   8.7613       385.301    8.7613       171.018    -171.239     
1 1 1 33  1  15 o 0 121.9   13.4  ?     ?   342.781   115.71       124.007    115.71       193.192    -64.2902     
1 1 1 33  1  16 o 0 88.2    13.9  ?     ?   144.57    -115.253     207.305    -115.253     56.9382    -115.253     
1 1 1 33  1  17 o 0 171     15.9  ?     ?   242.197   -32.4778     353.836    -32.4778     107.563    -32.4778     
1 1 1 33  1  18 o 0 161.6   18.6  ?     ?   247.45    15.3056      339.013    15.3056      92.9501    15.3056      
1 1 1 33  1  19 o 0 245.7   19.7  ?     ?   285.379   -117.102     459.222    -117.102     184.135    -117.102     
1 1 1 33  1  20 f 1 461.1   26.8  ?     ?   471.039   -162.799     565.451    -162.799     110.236    -162.799     
1 1 1 33  1  21 o 0 41.7    25.6  ?     ?   163.654   -175.573     89.3308    -175.573     75.9595    4.42683      
1 1 1 33  1  22 o 0 -9      30.4  ?     ?   85.7396   93.5448      29.3131    93.5448      60.3807    -86.4552     
1 1 1 33  1  23 o 0 64.8    32.7  ?     ?   115.152   -176.508     186.684    -176.508     71.1503    -176.508     
1 1 1 33  1  24 f 1 50      33.1  ?     ?   114.003   -115.161     148.741    -115.161     38.5122    -115.161     
1 1 1 33  1  25 < 1 -9.4    28.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 3  25 f 1 79.3    9.2   ?     ?   206.473   -127.953     199.328    -127.953     17.6552    -127.953     
1 1 1 -33 3  24 o 0 10.8    8.8   ?     ?   124.58    -31.1556     0.060634   -31.1556     110.031    148.844      
1 1 1 -33 3  23 o 0 11.5    6.5   ?     ?   147.829   -149.544     25.6516    30.4563      162.365    30.4563      
1 1 1 -33 3  22 o 0 234.5   9.4   ?     ?   238.276   -126.353     458.591    -126.353     228.067    -126.353     
1 1 1 -33 3  21 o 0 72.3    6.1   ?     ?   167.973   58.8297      199.784    58.8297      36.7995    58.8297      
1 1 1 -33 3  20 o 0 61.1    4.9   ?     ?   232.061   31.7894      114.263    31.7894      93.4191    -148.211     
1 1 1 -33 3  19 o 0 5.9     4.9   ?     ?   40.086    117.441      18.4771    -62.5595     54.5585    -62.5595     
1 1 1 -33 3  18 f 1 197.2   6.5   ?     ?   169.625   -81.1912     439.008    -81.1912     280.195    -81.1912     
1 1 1 -33 3  17 o 0 55.4    4.3   ?     ?   283.593   54.0557      38.4114    54.0557      232.551    -125.944     
1 1 1 -33 3  16 o 0 114.5   4.7   ?     ?   151.299   -79.4687     259.547    -79.4687     111.218    -79.4687     
1 1 1 -33 3  15 o 0 868.3   16.7  ?     ?   719.285   -94.1648     663.04     -94.1648     47.5399    85.8352      
1 1 1 -33 3  14 o 0 100.3   5.1   ?     ?   319.491   -98.1908     92.5608    -98.1908     188.989    81.8092      
1 1 1 -33 3  13 f 1 1046.3  22.3  ?     ?   757.871   -64.8823     681.169    -64.8823     11.2139    -64.8823     
1 1 1 -33 3  12 f 1 226.3   5.6   ?     ?   412.023   -0.743736    230.559    -0.743735    135.945    179.256      
1 1 1 -33 3  11 o 0 178.7   5.2   ?     ?   375.874   -68.7519     173.483    -68.7519     168.197    111.248      
1 1 1 -33 3  10 o 0 330.7   8.1   ?     ?   499.655   -66.1366     286.411    -66.1366     170.206    113.863      
1 1 1 -33 3  9  o 0 1870    32.9  ?     ?   992.454   -106.897     936.579    -106.897     14.1646    -106.897     
1 1 1 -33 3  8  o 0 3886.7  70.4  ?     ?   1269.39   -178.943     1480.53    -178.943     326.633    -178.943     
1 1 1 -33 3  7  o 0 1573.9  28.1  ?     ?   537.286   143.34       1164.24    143.34       673.884    143.34       
1 1 1 -33 3  6  o 0 1037.5  26.7  ?     ?   984.306   119.095      457.327    119.095      444.248    -60.9047     
1 1 1 -33 3  5  f 1 446.5   9.4   ?     ?   347.295   -99.1029     523.36     -99.1029     198.35     -99.1029     
1 1 1 -33 3  4  o 0 2037.4  35.7  ?     ?   977.214   103.223      1013.5     103.223      101.033    103.223      
1 1 1 -33 3  3  o 0 1636.1  29    ?     ?   960.339   -127.071     828.87     -127.071     70.1528    52.929       
1 1 1 -33 3  2  o 0 87.6    2.5   ?     ?   408.579   -4.60671     32.48      175.393      415.849    175.393      
1 1 1 -33 3  1  o 0 2515.7  44.9  ?     ?   1098.59   97.3875      1126.6     97.3875      93.714     97.3875      
1 1 1 33  3  0  o 0 714     16.2  ?     ?   767.812   141.601      412.002    141.601      310.449    -38.3992     
1 1 1 33  3  1  o 0 627.2   12.6  ?     ?   633.44    -172.917     460.535    -172.917     136.557    7.08291      
1 1 1 33  3  2  o 0 728.9   14    ?     ?   594.443   98.0497      581.149    98.0497      19.9289    98.0497      
1 1 1 33  3  3  o 0 3353.6  59.4  ?     ?   1309.7    113.437      1274.52    113.437      36.3853    113.437      
1 1 1 33  3  4  o 0 2588.7  44.9  ?     ?   1067.99   -124.889     1193.88    -124.889     183.226    -124.889     
1 1 1 33  3  5  f 1 819     18.5  ?     ?   744.107   -133.673     515.684    -133.673     192.555    46.3269      
1 1 1 33  3  6  o 0 275.7   10.8  ?     ?   248.295   98.4171      398.798    98.4171      166.685    98.4171      
1 1 1 33  3  7  o 0 491.1   18.9  ?     ?   329.993   -167.593     592.074    -167.593     283.652    -167.593     
1 1 1 33  3  8  o 0 188.9   8.2   ?     ?   273.739   -101.238     257.487    -101.238     1.81596    -101.238     
1 1 1 33  3  9  o 0 496.3   12.9  ?     ?   441.414   -116.177     529.34     -116.177     111.492    -116.177     
1 1 1 33  3  10 o 0 531.9   13.9  ?     ?   461.361   -16.7978     547.025    -16.7978     111.032    -16.7978     
1 1 1 33  3  11 o 0 656.9   18.5  ?     ?   596.77    -116.343     544.086    -116.343     18.6265    63.6568      
1 1 1 33  3  12 f 1 30.1    10    ?     ?   73.4954   -111.858     14.92      68.1422      82.9406    68.1422      
1 1 1 33  3  13 f 1 27.7    10.6  ?     ?   189.332   -57.4262     45.505     122.574      221.696    122.574      
1 1 1 33  3  14 o 0 157.2   13.8  ?     ?   368.719   -112.823     170.044    -112.823     170.052    67.1769      
1 1 1 33  3  15 o 0 321.9   15.5  ?     ?   417.315   -124.688     423.372    -124.688     9.40215    55.312       
1 1 1 33  3  16 o 0 356.2   15.5  ?     ?   455.183   -40.4857     445.301    -40.4857     16.3142    139.514      
1 1 1 33  3  17 o 0 63.7    15.9  ?     ?   187.377   127.515      151.374    127.515      34.508     -52.4853     
1 1 1 33  3  18 f 1 47.2    14.5  ?     ?   299.743   131.936      13.2768    131.936      276.518    -48.0644     
1 1 1 33  3  19 o 0 26.6    27.2  ?     ?   80.912    -148.505     63.077     -148.505     14.5673    31.4952      
1 1 1 33  3  20 o 0 -8.9    21.1  ?     ?   148.948   148.403      39.7435    -31.597      182.989    -31.597      
1 1 1 33  3  21 o 0 88.6    25.9  ?     ?   178.014   116.873      230.886    116.873      46.3326    116.873      
1 1 1 33  3  22 o 0 11      24.4  ?     ?   146.495   -100.139     14.2997    -100.139     137.593    79.8614      
1 1 1 33  3  23 o 0 22.5    33.4  ?     ?   113.137   102.878      86.2723    102.878      23.8631    -77.1216     
1 1 1 33  3  24 o 0 41.4    32.1  ?     ?   58.7526   -28.3798     136.417    -28.3798     80.4265    -28.3798     
1 1 1 -33 5  25 < 0 22.4    10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 5  24 o 0 15.9    8.3   ?     ?   36.1432   -56.0615     43.0922    -56.0615     11.7312    -56.0615     
1 1 1 -33 5  23 o 0 146.7   9.6   ?     ?   226.453   -145.755     327.316    -145.755     128.977    -145.755     
1 1 1 -33 5  22 o 0 178.6   9.8   ?     ?   295.497   -116.669     320.054    -116.669     49.2268    -116.669     
1 1 1 -33 5  21 o 0 173.6   8.1   ?     ?   171.91    -128.906     411.324    -128.906     246.514    -128.906     
1 1 1 -33 5  20 f 1 19.4    6.8   ?     ?   187.748   -42.2459     14.4473    137.754      189.673    137.754      
1 1 1 -33 5  19 o 0 319.5   9.3   ?     ?   339.721   111.596      478.977    111.596      177.758    111.596      
1 1 1 -33 5  18 o 0 168     7.3   ?     ?   244.179   177.463      338.191    177.463      120.46     177.463      
1 1 1 -33 5  17 f 1 68      5.4   ?     ?   202.51    113.533      146.398    113.533      41.4139    -66.467      
1 1 1 -33 5  16 o 0 29.4    4     ?     ?   122.768   -175.948     37.9652    -175.948     78.2172    4.05157      
1 1 1 -33 5  15 o 0 6.6     3.8   ?     ?   72.8302   179.17       44.2922    -0.830377    113.771    -0.830377    
1 1 1 -33 5  14 o 0 429.5   9.9   ?     ?   434.61    -119.97      514.914    -119.97      89.7271    -119.97      
1 1 1 -33 5  13 f 1 87.7    4.3   ?     ?   16.5144   64.9825      29.279     64.9825      14.794     64.9825      
1 1 1 -33 5  12 o 0 461.1   9.4   ?     ?   444.248   112.096      481.001    112.096      90.756     112.096      
1 1 1 -33 5  11 f 1 236     5.7   ?     ?   114.145   -119.237     355.41     -119.237     254.882    -119.237     
1 1 1 -33 5  10 o 0 214.3   5.2   ?     ?   151.437   31.6352      346.301    31.6352      212.852    31.6352      
1 1 1 -33 5  9  o 0 1649.5  29    ?     ?   897.847   -22.7164     904.152    -22.7164     91.8661    -22.7164     
1 1 1 -33 5  8  o 0 558.5   10.5  ?     ?   429.822   23.655       576.024    23.655       185.29     23.655       
1 1 1 -33 5  7  o 0 352.7   7     ?     ?   364.344   -7.08847     418.305    -7.08847     85.646     -7.08847     
1 1 1 -33 5  6  o 0 2306.1  45.6  ?     ?   1032.49   73.7207      1076.56    73.7207      143.847    73.7207      
1 1 1 -33 5  5  o 0 2044.6  50.9  ?     ?   879.145   -14.2861     1096.44    -14.2861     299.448    -14.2861     
1 1 1 -33 5  4  o 0 3.9     4.1   ?     ?   42.0464   -107.083     34.1495    72.9171      72.3868    72.9171      
1 1 1 -33 5  3  o 0 90.7    6.5   ?     ?   227.913   50.5691      86.6399    50.5691      121.199    -129.431     
1 1 1 -33 5  2  o 0 1034.2  21.9  ?     ?   847.688   -162.277     575.716    -162.277     199.167    17.7234      
1 1 1 -33 5  1  o 0 102.5   3     ?     ?   220.766   -169.208     116.209    -169.208     86.011     10.792       
1 1 1 33  5  0  f 1 669.8   13    ?     ?   607.235   137.618      516.229    137.618      44.1222    -42.3817     
1 1 1 33  5  1  o 0 544.5   11.2  ?     ?   280.034   -131.347     666.77     -131.347     409.254    -131.347     
1 1 1 33  5  2  o 0 495.9   10.4  ?     ?   202.651   -31.3147     659.103    -31.3147     472.49     -31.3147     
1 1 1 33  5  3  o 0 288.7   7.3   ?     ?   359.838   -171.975     338.706    -171.975     6.98966    -171.975     
1 1 1 33  5  4  o 0 787.3   15.9  ?     ?   593.563   121.458      627.252    121.458      79.6747    121.458      
1 1 1 33  5  5  o 0 168.7   9.5   ?     ?   315.193   129.529      195.67     129.529      95.2069    -50.4709     
1 1 1 33  5  6  o 0 723.2   15.1  ?     ?   426.419   90.6347      735.698    90.6347      331.584    90.6347      
1 1 1 33  5  7  o 0 1075.6  23.8  ?     ?   849.057   -173.827     633.042    -173.827     161.573    6.17268      
1 1 1 33  5  8  o 0 272.6   8.3   ?     ?   188.258   119.981      423.05     119.981      247.036    119.981      
1 1 1 33  5  9  o 0 2380.8  44.1  ?     ?   863.651   115.161      1324.94    115.161      518.641    115.161      
1 1 1 33  5  10 o 0 122.5   8.7   ?     ?   319.207   -2.38806     131.111    -2.38806     160.114    177.612      
1 1 1 33  5  11 f 1 760.4   18    ?     ?   598.711   118.272      633.599    118.272      85.9202    118.272      
1 1 1 33  5  12 o 0 160.4   10.4  ?     ?   227.274   -134.778     274.932    -134.778     66.904     -134.778     
1 1 1 33  5  13 f 1 114.4   11.8  ?     ?   97.1061   -152.189     189.914    -152.189     100.886    -152.189     
1 1 1 33  5  14 o 0 580     17.5  ?     ?   356.994   -134.649     776.706    -134.649     410.507    -134.649     
1 1 1 33  5  15 o 0 43.3    13.1  ?     ?   166.38    -46.0333     79.1061    -46.0333     87.8343    133.967      
1 1 1 33  5  16 o 0 41.3    13.7  ?     ?   166.967   66.931       80.7251    66.931       83.1909    -113.069     
1 1 1 33  5  17 f 1 51.6    13.4  ?     ?   103.565   -28.6765     156.357    -28.6765     57.2461    -28.6765     
1 1 1 33  5  18 o 0 114.5   18.2  ?     ?   229.917   -89.6648     255.241    -89.6648     36.8031    -89.6648     
1 1 1 33  5  19 o 0 21.1    19.3  ?     ?   204.201   36.985       11.406     -143.015     205.876    -143.015     
1 1 1 33  5  20 f 1 63.7    19.8  ?     ?   149.251   -25.4402     179.335    -25.4402     25.292     -25.4402     
1 1 1 33  5  21 o 0 -23.5   26.8  ?     ?   81.4935   -66.9777     0.261541   -66.9777     83.4417    113.022      
1 1 1 33  5  22 o 0 -16.9   23.9  ?     ?   69.1948   8.01275      8.85151    8.01275      57.885     -171.987     
1 1 1 33  5  23 o 0 75.5    36.5  ?     ?   245.45    62.7713      106.085    62.7713      125.697    -117.229     
1 1 1 -33 7  23 < 0 262.2   12.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 7  22 o 0 9.6     7.4   ?     ?   72.4125   -66.3642     10.3243    -66.3642     52.0337    113.636      
1 1 1 -33 7  21 o 0 31.9    6.6   ?     ?   53.948    -76.4928     103.816    -76.4928     56.2213    -76.4928     
1 1 1 -33 7  20 o 0 182.8   8.2   ?     ?   328.681   -141.34      286.127    -141.34      23.6163    38.6604      
1 1 1 -33 7  19 o 0 44.2    5.4   ?     ?   154.894   -119.991     117.933    -119.991     28.4326    60.009       
1 1 1 -33 7  18 o 0 33      4.8   ?     ?   37.7311   162.069      59.8937    162.069      26.728     162.069      
1 1 1 -33 7  17 o 0 217.6   6.7   ?     ?   337.891   83.7248      337.953    83.7248      40.7797    83.7248      
1 1 1 -33 7  16 o 0 45.8    4.1   ?     ?   81.279    -56.7718     125.371    -56.7718     53.5233    -56.7718     
1 1 1 -33 7  15 f 1 279.2   8.6   ?     ?   343.23    -169.654     416.783    -169.654     101.405    -169.654     
1 1 1 -33 7  14 o 0 176     5.1   ?     ?   404.983   -175.421     201.33     -175.421     178.165    4.57902      
1 1 1 -33 7  13 o 0 5.7     3.3   ?     ?   73.5479   -147.077     47.597     32.9229      117.031    32.9229      
1 1 1 -33 7  12 o 0 169.4   4.9   ?     ?   359.144   140.856      219.248    140.856      128.251    -39.144      
1 1 1 -33 7  11 o 0 543.5   10.7  ?     ?   521.859   -23.974      553.108    -23.974      44.8698    -23.974      
1 1 1 -33 7  10 o 0 226.4   5.5   ?     ?   476.362   -76.7004     181.882    -76.7004     231.495    103.3        
1 1 1 -33 7  9  o 0 75.2    3.6   ?     ?   274.271   -59.0013     64.762     -59.0013     174.579    120.999      
1 1 1 -33 7  8  o 0 23.8    1.7   ?     ?   108.26    109.88       34.861     -70.1204     128.995    -70.1204     
1 1 1 -33 7  7  o 0 552.3   16.2  ?     ?   380.484   -59.9046     610.705    -59.9046     278.315    -59.9046     
1 1 1 -33 7  6  o 0 482.6   14.5  ?     ?   446.491   -17.5944     497.948    -17.5944     106.239    -17.5944     
1 1 1 -33 7  5  o 0 497.2   14.9  ?     ?   329.086   -77.5494     587.063    -77.5494     291.091    -77.5494     
1 1 1 -33 7  4  o 0 86.2    6     ?     ?   302.621   -33.6055     43.0001    -33.6055     230.089    146.395      
1 1 1 -33 7  3  o 0 535.9   22.9  ?     ?   594.179   -151.078     417.611    -151.078     120.167    28.9221      
1 1 1 -33 7  2  o 0 694.3   24.8  ?     ?   622.686   -45.628      532.193    -45.628      32.8217    134.372      
1 1 1 -33 7  1  f 1 522.8   11.6  ?     ?   579.86    -61.1313     417.599    -61.1313     112.396    118.869      
1 1 1 33  7  0  o 0 867.6   16.3  ?     ?   637.24    -82.6091     659.099    -82.6091     76.3622    -82.6091     
1 1 1 33  7  1  f 1 807.7   16    ?     ?   516.753   78.0627      715.068    78.0627      239.413    78.0627      
1 1 1 33  7  2  o 0 14.3    3.9   ?     ?   108.307   0.260631     66.1768    -179.739     165.468    -179.739     
1 1 1 33  7  3  o 0 56      4.3   ?     ?   260.754   140.972      14.2045    -39.0283     253.43     -39.0283     
1 1 1 33  7  4  o 0 598.9   13.1  ?     ?   572.981   -94.5432     499.767    -94.5432     26.1025    85.4568      
1 1 1 33  7  5  o 0 492.3   12.4  ?     ?   413.82    -105.526     531.087    -105.526     151.302    -105.526     
1 1 1 33  7  6  o 0 614.3   15.5  ?     ?   557.841   66.4299      541.22     66.4299      40.1511    66.4299      
1 1 1 33  7  7  o 0 112     8.2   ?     ?   254.316   -12.0818     146.21     -12.0818     82.0201    167.918      
1 1 1 33  7  8  o 0 336.2   10.4  ?     ?   339.503   31.6459      432.382    31.6459      128.115    31.6459      
1 1 1 33  7  9  o 0 50.5    7.6   ?     ?   134.056   64.1438      52.1472    64.1438      68.826     -115.856     
1 1 1 33  7  10 o 0 245.7   11.1  ?     ?   242.637   -127.474     392.814    -127.474     174.363    -127.474     
1 1 1 33  7  11 o 0 7.2     8.8   ?     ?   32.4675   163.693      19.715     -16.3068     52.6276    -16.3068     
1 1 1 33  7  12 o 0 21.6    10.5  ?     ?   190.023   -27.1732     56.6057    152.827      248.599    152.827      
1 1 1 33  7  13 o 0 274.5   12.6  ?     ?   541.824   -109.839     241.577    -109.839     294.273    70.1615      
1 1 1 33  7  14 o 0 260.4   13.7  ?     ?   343.211   -163.098     414.48     -163.098     82.1461    -163.098     
1 1 1 33  7  15 f 1 -1.1    15.2  ?     ?   52.2809   158.506      13.2557    -21.4936     62.638     -21.4936     
1 1 1 33  7  16 o 0 321.8   19.1  ?     ?   302.499   -82.6634     539.008    -82.6634     256.224    -82.6634     
1 1 1 33  7  17 o 0 61.9    16.1  ?     ?   177.415   -47.0307     154.764    -47.0307     10.7695    132.969      
1 1 1 33  7  18 o 0 32.4    20.1  ?     ?   172.155   -114.429     49.7111    -114.429     125.104    65.571       
1 1 1 33  7  19 o 0 112.5   27.1  ?     ?   211.576   -106.393     257.08     -106.393     42.0443    -106.393     
1 1 1 33  7  20 o 0 80.9    28.5  ?     ?   137.413   -32.8213     228.926    -32.8213     94.9128    -32.8213     
1 1 1 33  7  21 o 0 -22.6   29    ?     ?   108.071   121.894      6.66466    121.894      95.7698    -58.1064     
1 1 1 33  7  22 o 0 34.1    31.1  ?     ?   127.958   170.105      102.674    170.105      16.359     -9.89495     
1 1 1 -33 9  22 < 0 38.2    8.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 9  21 o 0 61.9    8.1   ?     ?   98.6641   159.703      221.741    159.703      138.699    159.703      
1 1 1 -33 9  20 o 0 36.7    7.2   ?     ?   104.194   132.573      133.088    132.573      44.6275    132.573      
1 1 1 -33 9  19 o 0 321.1   10.1  ?     ?   328.413   156.482      490.527    156.482      205.048    156.482      
1 1 1 -33 9  18 o 0 16.6    5.2   ?     ?   72.2279   -82.1181     36.2109    -82.1181     28.5577    97.8819      
1 1 1 -33 9  17 o 0 4       4.6   ?     ?   53.5821   -88.0224     26.6863    91.9776      76.5132    91.9776      
1 1 1 -33 9  16 o 0 97.3    6.5   ?     ?   170.4     -124.006     254.657    -124.006     100.219    -124.006     
1 1 1 -33 9  15 f 1 142.9   5.6   ?     ?   297.242   159.357      241.247    159.357      19.2816    -20.6434     
1 1 1 -33 9  14 o 0 28.7    7.7   ?     ?   183.327   173.63       32.651     173.63       127.127    -6.36977     
1 1 1 -33 9  13 o 0 59.8    3.7   ?     ?   191.816   -71.9834     136.16     -71.9834     31.6811    108.017      
1 1 1 -33 9  12 o 0 85.7    3.9   ?     ?   272.568   25.4589      137.802    25.4589      108.571    -154.541     
1 1 1 -33 9  11 o 0 549.8   11.9  ?     ?   480.824   93.6881      601.373    93.6881      163.796    93.6881      
1 1 1 -33 9  10 o 0 198.7   5.1   ?     ?   190.457   130.143      409.403    130.143      232.012    130.143      
1 1 1 -33 9  9  o 0 149.6   4.1   ?     ?   67.0164   -92.7992     322.925    -92.7992     260.139    -92.7992     
1 1 1 -33 9  8  o 0 521.4   11.1  ?     ?   396.601   152.541      634.942    152.541      254.728    152.541      
1 1 1 -33 9  7  o 0 619.7   12.8  ?     ?   393.419   73.4838      735.723    73.4838      356.692    73.4838      
1 1 1 -33 9  6  o 0 168.7   5.3   ?     ?   335.776   -169.131     201.717    -169.131     86.0763    10.869       
1 1 1 -33 9  5  o 0 288.4   7.8   ?     ?   530.373   -125.204     216.959    -125.204     239.456    54.7958      
1 1 1 -33 9  4  o 0 185.5   6     ?     ?   434.181   -12.1447     155.065    -12.1447     219.911    167.855      
1 1 1 -33 9  3  o 0 122.2   4.5   ?     ?   226.738   -30.097      192.792    -30.097      3.64355    149.903      
1 1 1 -33 9  2  f 1 142.4   6.5   ?     ?   257.938   175.586      211.983    175.586      13.239     -4.41409     
1 1 1 -33 9  1  o 0 708.1   16.8  ?     ?   582.877   143.26       578.253    143.26       70.7532    143.26       
1 1 1 33  9  0  o 0 144.2   4.2   ?     ?   122.382   -174.764     255.787    -174.764     148.135    -174.764     
1 1 1 33  9  1  o 0 349.2   9.8   ?     ?   347.278   53.8505      440.008    53.8505      134.181    53.8505      
1 1 1 33  9  2  f 1 31.5    3.6   ?     ?   191.21    -145.122     24.6232    34.8785      194.007    34.8785      
1 1 1 33  9  3  o 0 361.9   9.4   ?     ?   434.952   27.044       386.483    27.044       3.00171    27.044       
1 1 1 33  9  4  o 0 200.3   7     ?     ?   337.544   88.3597      255.582    88.3597      42.0181    -91.6403     
1 1 1 33  9  5  o 0 183     6.3   ?     ?   336.253   102.805      229.913    102.805      66.4254    -77.195      
1 1 1 33  9  6  o 0 259.5   10.8  ?     ?   280.245   138.975      439.977    138.975      161.347    138.975      
1 1 1 33  9  7  o 0 309.7   11    ?     ?   196.746   165.603      572.519    165.603      377.158    165.603      
1 1 1 33  9  8  o 0 781     17.5  ?     ?   393.873   -129.413     900.739    -129.413     510.316    -129.413     
1 1 1 33  9  9  o 0 358.2   13    ?     ?   350.212   -133.312     525.027    -133.312     184.693    -133.312     
1 1 1 33  9  10 o 0 44.3    9.1   ?     ?   257.407   170.836      21.1216    170.836      228.358    -9.16392     
1 1 1 33  9  11 o 0 215.9   12.2  ?     ?   233.007   -132.708     431.768    -132.708     210.407    -132.708     
1 1 1 33  9  12 o 0 241.8   13.8  ?     ?   350.855   -103.632     381.248    -103.632     57.4022    -103.632     
1 1 1 33  9  13 o 0 235.8   14    ?     ?   422.748   163.503      307.918    163.503      80.6901    -16.4965     
1 1 1 33  9  14 o 0 14.2    16.1  ?     ?   63.5747   -83.8257     12.7097    -83.8257     45.6838    96.1743      
1 1 1 33  9  15 f 1 63.3    18.8  ?     ?   157.469   127.806      168.389    127.806      22.473     127.806      
1 1 1 33  9  16 o 0 -16.9   22.8  ?     ?   84.9945   -100.808     11.7321    79.1919      96.3231    79.1919      
1 1 1 33  9  17 o 0 10.9    26    ?     ?   76.7209   38.3178      48.5702    38.3178      27.9023    -141.682     
1 1 1 33  9  18 o 0 155.5   27.9  ?     ?   173.809   97.1414      382.674    97.1414      216.33     97.1414      
1 1 1 33  9  19 o 0 163.1   26.3  ?     ?   216.5     138.252      359.717    138.252      158.221    138.252      
1 1 1 33  9  20 o 0 12.5    27    ?     ?   9.10821   114.891      19.8103    114.891      11.4859    114.891      
1 1 1 -33 11 19 < 0 2.3     7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 11 18 o 0 62.4    6.9   ?     ?   244.481   -175.956     119.182    -175.956     84.0459    4.04433      
1 1 1 -33 11 17 o 0 13.1    5.7   ?     ?   48.8845   -20.638      25.2154    -20.638      15.7295    159.362      
1 1 1 -33 11 16 o 0 40      5.4   ?     ?   180.272   134.505      94.1016    134.505      60.3247    -45.4952     
1 1 1 -33 11 15 o 0 64.8    5     ?     ?   121.309   108.189      203.989    108.189      96.9099    108.189      
1 1 1 -33 11 14 o 0 28.8    4.3   ?     ?   63.4326   -51.0703     87.0613    -51.0703     28.6279    -51.0703     
1 1 1 -33 11 13 o 0 32.8    4     ?     ?   118.605   -31.6493     93.0981    -31.6493     16.2131    148.351      
1 1 1 -33 11 12 o 0 31.6    4     ?     ?   84.9008   -43.1579     84.2364    -43.1579     11.6109    -43.1579     
1 1 1 -33 11 11 o 0 85.5    4.1   ?     ?   274.636   -54.305      139.72     -54.305      94.8109    125.695      
1 1 1 -33 11 10 o 0 76.9    4.2   ?     ?   193.4     -96.7853     178.425    -96.7853     12.1797    -96.7853     
1 1 1 -33 11 9  f 1 76.7    3.7   ?     ?   285.117   -176.726     110.918    -176.726     136.001    3.27429      
1 1 1 -33 11 8  o 0 141.2   4.7   ?     ?   266.637   -144.494     264.563    -144.494     33.5328    -144.494     
1 1 1 -33 11 7  o 0 132.4   4.5   ?     ?   313.649   -168.667     203.089    -168.667     77.055     11.3334      
1 1 1 -33 11 6  o 0 9.7     2.5   ?     ?   191.031   104.066      82.7361    -75.9339     254.163    -75.9339     
1 1 1 -33 11 5  o 0 18.3    2.7   ?     ?   118.257   72.3505      4.62881    72.3505      101.942    -107.649     
1 1 1 -33 11 4  o 0 120.8   4.9   ?     ?   252.884   -109.754     231.112    -109.754     2.35562    -109.754     
1 1 1 -33 11 3  o 0 376.9   11.4  ?     ?   533.249   153.829      361.333    153.829      130.865    -26.1713     
1 1 1 -33 11 2  o 0 876.4   28    ?     ?   523.122   161.206      828.009    161.206      343.768    161.206      
1 1 1 -33 11 1  o 0 284.4   8.9   ?     ?   376.32    -98.0373     386.395    -98.0373     37.1949    -98.0373     
1 1 1 33  11 0  o 0 645.3   15.4  ?     ?   457.235   -60.8502     711.997    -60.8502     281.08     -60.8502     
1 1 1 33  11 1  o 0 845.5   17.2  ?     ?   502.121   -7.97856     840.785    -7.97856     367.169    -7.97856     
1 1 1 33  11 2  o 0 271.8   8.1   ?     ?   428.322   -40.9243     329.79     -40.9243     74.3995    139.076      
1 1 1 33  11 3  o 0 22      5.1   ?     ?   82.2337   106.282      12.0534    106.282      65.5511    -73.7178     
1 1 1 33  11 4  o 0 1.2     5.6   ?     ?   58.2734   99.6706      38.3796    -80.3294     92.4347    -80.3294     
1 1 1 33  11 5  o 0 115.9   6.7   ?     ?   204.918   -11.6952     262.438    -11.6952     72.5013    -11.6952     
1 1 1 33  11 6  o 0 49.7    7.6   ?     ?   229.442   -171.926     71.8917    -171.926     140.52     8.07413      
1 1 1 33  11 7  o 0 47.4    8.5   ?     ?   156.169   168.317      120.81     168.317      19.9352    -11.683      
1 1 1 33  11 8  o 0 64.8    9.7   ?     ?   226.152   -90.9892     128.24     -90.9892     75.1504    89.0108      
1 1 1 33  11 9  f 1 14.5    9.4   ?     ?   134.352   -118.136     15.1724    61.8636      136.771    61.8636      
1 1 1 33  11 10 o 0 22.9    11.5  ?     ?   147.146   40.5894      19.3634    40.5894      112.735    -139.411     
1 1 1 33  11 11 o 0 379.2   17    ?     ?   334.715   -1.28253     557.13     -1.28253     255.065    -1.28253     
1 1 1 33  11 12 o 0 176.9   13.7  ?     ?   290.21    -61.5222     328.642    -61.5222     55.1448    -61.5222     
1 1 1 33  11 13 o 0 328.1   20.9  ?     ?   377.233   -84.1323     463.837    -84.1323     97.3551    -84.1323     
1 1 1 33  11 14 o 0 22.1    11.1  ?     ?   153.95    96.6657      22.3656    96.6657      127.587    -83.3343     
1 1 1 33  11 15 o 0 303.3   24.9  ?     ?   191.276   112.458      597.318    112.458      418.238    112.458      
1 1 1 33  11 16 o 0 72.8    24.5  ?     ?   155.91    146.048      189.994    146.048      47.8931    146.048      
1 1 1 33  11 17 o 0 -1.9    23.4  ?     ?   108.899   82.6401      22.3616    82.6401      74.9889    -97.3599     
1 1 1 33  11 18 o 0 -17.3   25.5  ?     ?   175.185   5.56294      28.833     -174.437     184.748    -174.437     
1 1 1 -33 13 16 < 0 48      8     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 13 15 < 0 13.9    6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 13 14 o 0 34.6    7.9   ?     ?   141.534   -11.1294     106.029    -11.1294     9.88464    168.871      
1 1 1 -33 13 13 o 0 111.9   7.7   ?     ?   228.543   140.653      241.92     140.653      53.6336    140.653      
1 1 1 -33 13 12 o 0 92.2    6     ?     ?   173.806   168.585      237.897    168.585      91.6914    168.585      
1 1 1 -33 13 11 o 0 91.3    5.7   ?     ?   125.871   129.488      263.219    129.488      154.296    129.488      
1 1 1 -33 13 10 o 0 157.3   7.1   ?     ?   184.52    -151.645     349.912    -151.645     183.551    -151.645     
1 1 1 -33 13 9  o 0 11.4    3.8   ?     ?   45.5686   10.1465      6.12046    10.1465      35.2234    -169.853     
1 1 1 -33 13 8  f 1 125.7   5.7   ?     ?   235.302   -42.8755     253.781    -42.8755     39.5503    -42.8755     
1 1 1 -33 13 7  o 0 45.1    4.5   ?     ?   72.7628   -90.2902     140.556    -90.2902     74.2935    -90.2902     
1 1 1 -33 13 6  o 0 274.5   9     ?     ?   494.311   134.966      269.72     134.966      182.636    -45.0339     
1 1 1 -33 13 5  f 1 22.5    4.1   ?     ?   135.094   130.884      35.1855    130.884      79.7944    -49.1155     
1 1 1 -33 13 4  f 1 362.4   10.7  ?     ?   405.813   -55.6312     448.933    -55.6312     102.168    -55.6312     
1 1 1 -33 13 3  o 0 330.4   10    ?     ?   325.238   22.6075      480.726    22.6075      203.262    22.6075      
1 1 1 -33 13 2  f 1 161.2   7.3   ?     ?   150.569   111.496      374.198    111.496      244.69     111.496      
1 1 1 -33 13 1  f 1 73.6    6.5   ?     ?   116.591   130.025      212.429    130.025      111.885    130.025      
1 1 1 33  13 0  o 0 31.3    5.7   ?     ?   121.571   -154.55      80.3139    -154.55      26.2058    25.4496      
1 1 1 33  13 1  f 1 17.7    6.1   ?     ?   134.314   -108.831     8.35828    -108.831     109.997    71.169       
1 1 1 33  13 2  f 1 123.9   8.4   ?     ?   310.903   156.327      194.431    156.327      79.5728    -23.6731     
1 1 1 33  13 3  o 0 27.8    6.3   ?     ?   213.3     114.532      12.5974    114.532      174.377    -65.4681     
1 1 1 33  13 4  f 1 18.3    6.8   ?     ?   119.842   162.573      16.1918    162.573      89.3267    -17.4268     
1 1 1 33  13 5  f 1 91.9    8.7   ?     ?   168.549   130.926      233.286    130.926      85.0464    130.926      
1 1 1 33  13 6  o 0 -3.8    9.2   ?     ?   120.607   129.479      65.5048    -50.5207     179.886    -50.5207     
1 1 1 33  13 7  o 0 78.1    10.8  ?     ?   256.998   107.934      136.021    107.934      107.228    -72.0664     
1 1 1 33  13 8  f 1 69      11.4  ?     ?   189.915   82.1422      167.169    82.1422      14.4238    -97.8578     
1 1 1 33  13 9  o 0 27.2    11.4  ?     ?   122.274   47.0027      64.0064    47.0027      51.9765    -132.997     
1 1 1 33  13 10 o 0 17.4    15.5  ?     ?   63.027    50.9388      38.4165    50.9388      19.1622    -129.061     
1 1 1 33  13 11 o 0 5.7     15.4  ?     ?   124.058   -26.1365     10.4883    153.864      123.393    153.864      
1 1 1 33  13 12 o 0 36.2    19.6  ?     ?   104.138   79.4404      105.483    79.4404      13.0772    79.4404      
1 1 1 33  13 13 o 0 91.9    22.4  ?     ?   163.33    -144.275     242.192    -144.275     99.8238    -144.275     
1 1 1 33  13 14 o 0 -21.6   21.5  ?     ?   81.8242   -136.847     8.66778    -136.847     62.4471    43.1534      
1 1 1 33  13 15 < 0 11.7    15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 15 11 < 1 7.9     10.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 15 10 < 0 26.2    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 15 9  < 0 92.9    8.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -33 15 8  o 0 19.4    7.4   ?     ?   80.7761   -52.535      67.2679    -52.535      2.20087    -52.535      
1 1 1 -33 15 7  o 0 29.6    6.2   ?     ?   113.844   70.3056      97.0999    70.3056      5.09252    70.3056      
1 1 1 -33 15 6  o 0 55.5    6.7   ?     ?   184.274   92.741       139.335    92.741       10.3519    -87.259      
1 1 1 -33 15 5  o 0 9.2     8.1   ?     ?   106.126   73.9742      0.113736   -106.026     86.7197    -106.026     
1 1 1 -33 15 4  o 0 157.2   9.9   ?     ?   201.284   167.941      337.896    167.941      170.772    167.941      
1 1 1 -33 15 3  o 0 8.4     7     ?     ?   67.7805   -26.983      1.59334    153.017      58.0788    153.017      
1 1 1 -33 15 2  o 0 72.2    13.1  ?     ?   133.711   -26.0571     209.529    -26.0571     97.7389    -26.0571     
1 1 1 -33 15 1  o 0 44.9    8.4   ?     ?   145.601   -176.861     129.205    -176.861     7.13425    -176.861     
1 1 1 33  15 0  o 0 16.6    8.6   ?     ?   108.986   59.1271      28.4708    59.1271      65.3647    -120.873     
1 1 1 33  15 1  o 0 111.8   10    ?     ?   177.425   35.2251      281.658    35.2251      128.856    35.2251      
1 1 1 33  15 2  o 0 41.7    10.4  ?     ?   190.374   22.8533      89.1204    22.8533      74.812     -157.147     
1 1 1 33  15 3  o 0 67.6    10.9  ?     ?   193.242   -39.5259     164.992    -39.5259     1.31643    140.474      
1 1 1 33  15 4  o 0 41      11.9  ?     ?   137.234   -5.70364     125.813    -5.70364     9.3614     -5.70364     
1 1 1 33  15 5  o 0 50.8    11.4  ?     ?   174.631   28.2039      133.477    28.2039      14.4986    -151.796     
1 1 1 33  15 6  o 0 28.8    12.3  ?     ?   174.272   163.468      48.4061    163.468      98.9912    -16.5324     
1 1 1 33  15 7  o 0 10.3    12.3  ?     ?   77.6271   147.394      34.4187    147.394      31.2338    -32.6058     
1 1 1 33  15 8  o 0 7.6     14.4  ?     ?   57.9419   -47.5416     33.4656    -47.5416     15.4041    132.458      
1 1 1 33  15 9  < 0 17.2    17.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 33  15 10 < 0 60.1    18.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 0  26 < 0 19.2    14.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 0  25 o 0 30.1    12.9  ?     ?   71.2431   0            90.5025    0            27.4364    0            
1 1 1 -34 0  24 o 0 118.7   13.8  ?     ?   132.386   0            247.074    0            127.262    0            
1 1 1 -34 0  23 o 0 -3.2    9.7   ?     ?   104.19    180          13.9135    180          83.4338    1.17011e-15  
1 1 1 -34 0  22 o 0 73.1    10    ?     ?   90.3183   0            182.239    0            94.6588    0            
1 1 1 -34 0  21 o 0 1.2     7.1   ?     ?   4.44743   180          0.478023   180          3.53437    9.49009e-16  
1 1 1 -34 0  20 f 1 38.1    6.5   ?     ?   109.97    180          111.466    180          11.6688    180          
1 1 1 -34 0  19 o 0 43.3    6.6   ?     ?   317.047   180          149.442    180          138.313    7.5813e-15   
1 1 1 -34 0  18 o 0 218.9   8.9   ?     ?   458.981   180          343.339    180          87.5425    2.75193e-14  
1 1 1 -34 0  17 o 0 5.8     4.8   ?     ?   112.408   0            11.9595    0            96.2307    180          
1 1 1 -34 0  16 o 0 44.2    5.4   ?     ?   157.925   180          117.531    180          38.3512    2.15034e-14  
1 1 1 -34 0  15 o 0 103.2   6.4   ?     ?   118.546   0            150.134    0            45.7573    0            
1 1 1 -34 0  14 f 1 145.5   6.4   ?     ?   71.9629   0            143.056    0            78.9428    0            
1 1 1 -34 0  13 o 0 451.1   12.9  ?     ?   312.189   0            453.683    0            177.668    0            
1 1 1 -34 0  12 o 0 814.1   21.3  ?     ?   609.676   0            613.598    0            59.9379    0            
1 1 1 -34 0  11 o 0 2061.2  51.1  ?     ?   859.967   0            981.214    0            196.136    0            
1 1 1 -34 0  10 o 0 67      5.2   ?     ?   77.5138   0            54.7239    0            16.3816    180          
1 1 1 -34 0  9  o 0 1356.6  51.1  ?     ?   973.915   0            782.017    0            102.314    180          
1 1 1 -34 0  8  o 0 1180.1  29.6  ?     ?   401.305   180          732.823    180          366.975    180          
1 1 1 -34 0  7  o 0 259.1   8.1   ?     ?   33.8428   180          91.74      180          60.7758    180          
1 1 1 -34 0  6  o 0 4.5     2     ?     ?   19.6599   0            0.792183   0            17.4925    180          
1 1 1 -34 0  5  o 0 3123    75.1  ?     ?   1129.94   0            1203.67    0            149.639    0            
1 1 1 -34 0  4  o 0 1025.3  25.5  ?     ?   910.546   180          691.753    180          159.925    3.03506e-14  
1 1 1 -34 0  3  o 0 707.7   18.2  ?     ?   821.95    0            576.157    0            194.565    180          
1 1 1 -34 0  2  o 0 151.2   5.3   ?     ?   295.631   0            255.529    0            22.3124    180          
1 1 1 -34 0  1  o 0 1273.4  32.4  ?     ?   827.996   0            776.207    0            3.61083    180          
1 1 1 34  0  0  o 0 647.3   21.8  ?     ?   714.479   -6.47005e-14 554.397    0            119.816    180          
1 1 1 34  0  1  o 0 237.2   10.9  ?     ?   610.822   180          336.055    180          241.359    9.7697e-15   
1 1 1 34  0  2  o 0 342.1   14.5  ?     ?   538.453   0            404.262    0            105.532    180          
1 1 1 34  0  3  o 0 414.6   28.9  ?     ?   269.373   180          442.196    180          186.826    180          
1 1 1 34  0  4  o 0 131.2   6     ?     ?   856.83    180          250.928    180          562.193    3.13182e-15  
1 1 1 34  0  5  o 0 240.9   9     ?     ?   420.655   0            339.653    0            59.8174    180          
1 1 1 34  0  6  o 0 555.7   17.4  ?     ?   743.34    0            517.139    0            188.985    180          
1 1 1 34  0  7  o 0 397     14.3  ?     ?   130.557   0            376.834    0            254.442    0            
1 1 1 34  0  8  o 0 24.2    8.6   ?     ?   180.571   180          39.3613    180          129.824    2.1274e-15   
1 1 1 34  0  9  o 0 591.3   20.6  ?     ?   617.2     0            532.444    0            45.2451    180          
1 1 1 34  0  10 o 0 147.8   12.8  ?     ?   226.956   0            240.128    0            24.9034    0            
1 1 1 34  0  11 o 0 688.6   22.4  ?     ?   220.114   180          584.488    180          376.17     180          
1 1 1 34  0  12 o 0 25.9    13    ?     ?   78.6322   180          19.1087    180          53.578     2.50253e-15  
1 1 1 34  0  13 o 0 141.6   13.5  ?     ?   304.188   0            255.739    0            24.6098    180          
1 1 1 34  0  14 f 1 -32.6   16.6  ?     ?   26.3759   180          0.898971   180          23.6634    2.66564e-16  
1 1 1 34  0  15 o 0 384.6   23.6  ?     ?   441.607   180          487.125    180          26.9878    180          
1 1 1 34  0  16 o 0 50.3    21.2  ?     ?   89.1663   0            75.2073    0            17.2907    180          
1 1 1 34  0  17 o 0 298.3   22.3  ?     ?   311.55    0            424.363    0            108.36     0            
1 1 1 34  0  18 o 0 3.1     26.1  ?     ?   174.517   0            46.1478    0            126.983    180          
1 1 1 34  0  19 o 0 203.5   31.8  ?     ?   228.638   180          341.132    180          121.226    180          
1 1 1 34  0  20 f 1 456.3   34.3  ?     ?   551.763   180          513.981    180          18.1544    1.98654e-13  
1 1 1 34  0  21 o 0 112.9   37.3  ?     ?   213.003   180          242.262    180          19.9311    180          
1 1 1 34  0  22 o 0 30.3    38.5  ?     ?   48.0705   180          49.3087    180          0.89221    3.87784e-13  
1 1 1 34  0  23 o 0 -31.2   36.4  ?     ?   32.2848   180          13.0269    180          18.6402    4.90373e-15  
1 1 1 -34 2  25 o 0 7.6     8.9   ?     ?   113.714   -131.708     0.187458   -131.708     99.5801    48.2915      
1 1 1 -34 2  24 o 0 -10.3   6.8   ?     ?   62.3693   63.107       36.8236    -116.893     92.0557    -116.893     
1 1 1 -34 2  23 o 0 -19     6.6   ?     ?   101.931   57.8412      78.4548    -122.159     172.907    -122.159     
1 1 1 -34 2  22 f 1 50.3    5.6   ?     ?   118.217   3.11719      167.825    3.11719      52.6574    3.11719      
1 1 1 -34 2  21 o 0 45.2    5.3   ?     ?   83.4794   23.9954      144.628    23.9954      66.2673    23.9954      
1 1 1 -34 2  20 o 0 10.6    4.9   ?     ?   113.33    -17.3241     29.1916    162.676      130.771    162.676      
1 1 1 -34 2  19 o 0 133.6   5.5   ?     ?   131.16    173.856      351.299    173.856      233.079    173.856      
1 1 1 -34 2  18 o 0 40.1    4.4   ?     ?   204.893   -6.12609     57.4578    -6.12609     133.628    173.874      
1 1 1 -34 2  17 o 0 47.4    4.8   ?     ?   87.1407   -117.899     102.247    -117.899     18.8989    -117.899     
1 1 1 -34 2  16 f 1 195     5.8   ?     ?   137.564   -157.181     419.664    -157.181     283.984    -157.181     
1 1 1 -34 2  15 o 0 221     6     ?     ?   240.6     72.7722      410.243    72.7722      172.378    72.7722      
1 1 1 -34 2  14 o 0 122     4     ?     ?   171.577   -68.4261     217.212    -68.4261     65.9223    -68.4261     
1 1 1 -34 2  13 o 0 236.3   6.7   ?     ?   398.57    -31.7185     254.968    -31.7185     95.7131    148.282      
1 1 1 -34 2  12 o 0 53.5    3.8   ?     ?   135.076   -83.7842     33.9696    -83.7842     85.6008    96.2158      
1 1 1 -34 2  11 o 0 434     9.6   ?     ?   341.701   -115.64      521.488    -115.64      210.839    -115.64      
1 1 1 -34 2  10 o 0 377.2   8.1   ?     ?   600.311   -105.566     255.683    -105.566     292.894    74.4338      
1 1 1 -34 2  9  o 0 55.6    2.5   ?     ?   368.472   -155.357     86.167     24.6433      428.571    24.6433      
1 1 1 -34 2  8  o 0 1018.4  19.5  ?     ?   655.665   139.813      728.864    139.813      133.045    139.813      
1 1 1 -34 2  7  o 0 5112.2  85.7  ?     ?   1655.16   106.087      1528.58    106.087      18.6498    106.087      
1 1 1 -34 2  6  o 0 2911.9  70.7  ?     ?   1146.09   81.3192      1229.84    81.3192      166.785    81.3192      
1 1 1 -34 2  5  o 0 57.6    3.4   ?     ?   23.4409   98.8461      8.63795    98.8461      13.1736    -81.1539     
1 1 1 -34 2  3  o 0 557.8   14.8  ?     ?   609.824   -117.783     416.116    -117.783     154.402    62.2171      
1 1 1 -34 2  2  o 0 1237.8  28.5  ?     ?   556.355   67.9755      964.936    67.9755      443.236    67.9755      
1 1 1 -34 2  1  o 0 571.2   15.6  ?     ?   536.126   76.0066      494.609    76.0066      9.1662     -103.993     
1 1 1 34  2  0  o 0 1911.8  40    ?     ?   1158.33   52.1699      792.448    52.1699      297.233    -127.83      
1 1 1 34  2  1  o 0 733.2   14.6  ?     ?   658.777   -171.781     526.444    -171.781     94.4159    8.21884      
1 1 1 34  2  2  o 0 728.7   14.5  ?     ?   824.104   90.9375      374.063    90.9375      403.859    -89.0625     
1 1 1 34  2  3  o 0 277.3   6.8   ?     ?   467.134   -167.634     239.847    -167.634     201.708    12.3662      
1 1 1 34  2  4  o 0 3935.2  73.7  ?     ?   1459.14   -112.479     1346.07    -112.479     34.6269    67.5211      
1 1 1 34  2  5  o 0 1113.8  22.2  ?     ?   769.048   -119.38      704.529    -119.38      23.6913    60.6201      
1 1 1 34  2  6  o 0 50.2    4.3   ?     ?   354.527   -99.2906     93.6974    80.7094      425.134    80.7094      
1 1 1 34  2  7  o 0 2160.6  44.4  ?     ?   1009.34   -73.3253     1068       -73.3253     124.512    -73.3253     
1 1 1 34  2  8  o 0 928.5   20.1  ?     ?   746.397   91.1856      605.578    91.1856      91.7173    -88.8144     
1 1 1 34  2  9  o 0 352.3   11.5  ?     ?   208.397   -57.2589     527.715    -57.2589     330.377    -57.2589     
1 1 1 34  2  10 o 0 257.8   11.6  ?     ?   472.706   -169.636     223.229    -169.636     223.689    10.364       
1 1 1 34  2  11 o 0 510.3   15.7  ?     ?   680.814   -151.685     333.972    -151.685     308.362    28.3146      
1 1 1 34  2  12 o 0 284.5   12.4  ?     ?   398.893   94.8245      333.351    94.8245      34.2016    -85.1755     
1 1 1 34  2  13 o 0 127.3   10    ?     ?   405.702   38.5935      77.3025    38.5935      295.369    -141.407     
1 1 1 34  2  14 o 0 72.8    11    ?     ?   187.795   -112.441     106.386    -112.441     67.0046    67.5592      
1 1 1 34  2  15 o 0 107.4   13.6  ?     ?   206.83    172.511      228.251    172.511      13.5109    172.511      
1 1 1 34  2  16 f 1 174     16    ?     ?   314.423   -16.0977     294.784    -16.0977     26.1437    163.902      
1 1 1 34  2  17 o 0 56.1    18.1  ?     ?   159.654   113.378      136.927    113.378      21.6867    -66.6216     
1 1 1 34  2  18 o 0 58.2    17.6  ?     ?   168.794   -34.3419     153.117    -34.3419     9.5068     145.658      
1 1 1 34  2  19 o 0 -10.9   22.8  ?     ?   171.836   -87.9361     55.4135    92.0639      220.609    92.0639      
1 1 1 34  2  20 o 0 79.3    23.4  ?     ?   272.755   81.716       127.451    81.716       135.384    -98.284      
1 1 1 34  2  21 o 0 141     24.4  ?     ?   127.117   102.802      400.007    102.802      267.934    102.802      
1 1 1 34  2  22 f 1 28.3    28.2  ?     ?   81.561    64.8214      91.7362    64.8214      6.5349     64.8214      
1 1 1 34  2  23 o 0 49      32.1  ?     ?   151.648   114.906      122.454    114.906      25.5442    -65.0935     
1 1 1 34  2  24 o 0 -18.3   27.4  ?     ?   46.8899   159.163      24.0256    159.163      20.7817    -20.837      
1 1 1 -34 4  25 < 0 46.9    8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 4  24 o 0 3.2     8.2   ?     ?   97.4058   -117.306     11.6454    62.694       96.6793    62.694       
1 1 1 -34 4  23 o 0 84.8    7.3   ?     ?   256.193   -138.8       168.993    -138.8       59.715     41.2002      
1 1 1 -34 4  22 o 0 19.2    6.7   ?     ?   131.635   -131.039     29.3249    -131.039     92.0232    48.9607      
1 1 1 -34 4  21 o 0 8       7     ?     ?   109.613   49.3546      32.2236    -130.645     137.12     -130.645     
1 1 1 -34 4  20 f 1 326.4   9.1   ?     ?   456.582   36.6494      383.469    36.6494      25.2362    -143.351     
1 1 1 -34 4  19 o 0 17.8    5.3   ?     ?   109.123   94.4168      15.328     94.4168      81.9483    -85.5832     
1 1 1 -34 4  18 o 0 297     7.8   ?     ?   283.126   -79.183      503.921    -79.183      250.141    -79.183      
1 1 1 -34 4  17 o 0 7.3     3.9   ?     ?   40.4749   70.4958      19.1797    -109.504     56.7145    -109.504     
1 1 1 -34 4  16 f 1 11.3    3.4   ?     ?   52.8064   176.747      18.1369    -3.25333     68.6146    -3.25333     
1 1 1 -34 4  15 o 0 106.7   4.1   ?     ?   205.603   -100.53      215.369    -100.53      14.7907    -100.53      
1 1 1 -34 4  14 f 1 349.1   8.9   ?     ?   422.598   -77.7843     430.37     -77.7843     12.9006    -77.7843     
1 1 1 -34 4  13 o 0 483.4   11.1  ?     ?   460.696   127.019      488.215    127.019      84.4154    127.019      
1 1 1 -34 4  12 o 0 18.6    2.7   ?     ?   105.518   -32.6211     46.4072    147.379      138.686    147.379      
1 1 1 -34 4  11 o 0 417.1   9.4   ?     ?   631.126   99.5768      284.06     99.5768      271.206    -80.4232     
1 1 1 -34 4  10 o 0 205.4   4.7   ?     ?   365.076   17.6189      221.905    17.6189      107.949    -162.381     
1 1 1 -34 4  9  o 0 1176.2  21.6  ?     ?   651.928   -30.2521     850.16     -30.2521     258.117    -30.2521     
1 1 1 -34 4  8  o 0 253.7   5.9   ?     ?   356.157   176.593      300.042    176.593      24.91      -3.40682     
1 1 1 -34 4  7  o 0 177.9   4.3   ?     ?   184.351   44.4077      262.61     44.4077      96.1434    44.4077      
1 1 1 -34 4  6  o 0 133.5   5.5   ?     ?   391.676   43.0428      77.0709    43.0428      277.965    -136.957     
1 1 1 -34 4  5  o 0 223.9   4.9   ?     ?   283.909   -42.1095     297.85     -42.1095     39.6129    -42.1095     
1 1 1 -34 4  4  o 0 775.1   14.6  ?     ?   686.902   63.0758      530.949    63.0758      95.7632    -116.924     
1 1 1 -34 4  3  o 0 910.9   16.8  ?     ?   563.433   107.868      738.588    107.868      223.122    107.868      
1 1 1 -34 4  2  o 0 1104.8  20.3  ?     ?   716.642   -24.7787     732.294    -24.7787     66.4155    -24.7787     
1 1 1 -34 4  1  f 1 1508.5  28    ?     ?   765.219   92.3907      927.752    92.3907      211.59     92.3907      
1 1 1 34  4  0  o 0 612.3   15.9  ?     ?   445.907   178.462      603.483    178.462      187.553    178.462      
1 1 1 34  4  1  f 1 165.2   4.7   ?     ?   479.994   52.1491      59.7062    52.1491      391.104    -127.851     
1 1 1 34  4  2  o 0 190.3   5.7   ?     ?   198.318   -4.28601     287.361    -4.28601     104.194    -4.28601     
1 1 1 34  4  3  o 0 651.7   13    ?     ?   376.641   -88.9765     697.79     -88.9765     349.506    -88.9765     
1 1 1 34  4  4  o 0 12.2    3.6   ?     ?   92.6597   -73.4346     61.5656    106.565      147.324    106.565      
1 1 1 34  4  5  o 0 44      4.1   ?     ?   215.208   56.292       33.0019    -123.708     232.282    -123.708     
1 1 1 34  4  6  o 0 229.1   7     ?     ?   380.341   58.1669      243.99     58.1669      108.236    -121.833     
1 1 1 34  4  7  o 0 1148.9  25.1  ?     ?   804.382   -171.969     715.569    -171.969     49.1957    8.03129      
1 1 1 34  4  8  o 0 200.3   8.5   ?     ?   442.576   -158.793     161.572    -158.793     253.839    21.2072      
1 1 1 34  4  9  o 0 386.5   11.6  ?     ?   477.225   127.796      378.067    127.796      69.2882    -52.2035     
1 1 1 34  4  10 o 0 205.9   9.5   ?     ?   383.05    31.2736      231.894    31.2736      119.071    -148.726     
1 1 1 34  4  11 o 0 58.2    8.4   ?     ?   219.569   40.1032      29.3003    40.1032      171.416    -139.897     
1 1 1 34  4  12 o 0 637     17.1  ?     ?   489.969   -35.9989     630.455    -35.9989     179.898    -35.9989     
1 1 1 34  4  13 o 0 169.1   11.7  ?     ?   368.915   -86.4825     189.773    -86.4825     148.346    93.5175      
1 1 1 34  4  14 f 1 689.4   20.7  ?     ?   547.026   -87.701      701.805    -87.701      134.967    -87.701      
1 1 1 34  4  15 o 0 222.9   14    ?     ?   291.374   26.5447      401.15     26.5447      107.278    26.5447      
1 1 1 34  4  16 f 1 166.7   15.9  ?     ?   296.78    -0.234736    293.108    -0.234736    6.32133    179.765      
1 1 1 34  4  17 o 0 128.2   18.5  ?     ?   338.584   135.324      186.71     135.324      145.722    -44.6763     
1 1 1 34  4  18 o 0 43.8    16.4  ?     ?   249.368   148.78       35.253     148.78       202.131    -31.2201     
1 1 1 34  4  19 o 0 299.5   25    ?     ?   326.868   -65.1449     489.854    -65.1449     179.438    -65.1449     
1 1 1 34  4  20 f 1 108.5   31.3  ?     ?   225.535   -55.0073     234.908    -55.0073     0.70792    -55.0073     
1 1 1 34  4  21 o 0 -0.2    27.9  ?     ?   81.2675   -11.3094     35.3051    -11.3094     48.6924    168.691      
1 1 1 34  4  22 o 0 -20.1   35    ?     ?   193.141   9.96701      38.7539    -170.033     230.236    -170.033     
1 1 1 34  4  23 o 0 7.5     33    ?     ?   123.762   37.8752      56.4296    37.8752      61.2224    -142.125     
1 1 1 -34 6  24 < 0 27.2    10    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 6  23 o 0 49.8    8.5   ?     ?   169.567   -142.985     143.166    -142.985     2.96802    37.0146      
1 1 1 -34 6  22 o 0 47      8     ?     ?   156.528   -66.0449     135.718    -66.0449     2.21525    113.955      
1 1 1 -34 6  21 o 0 63.1    11    ?     ?   112.453   -48.5202     207.272    -48.5202     104.954    -48.5202     
1 1 1 -34 6  20 o 0 207     9.3   ?     ?   259.587   -147.429     390.065    -147.429     143.065    -147.429     
1 1 1 -34 6  19 o 0 54.3    5.8   ?     ?   93.2024   -163.569     174.355    -163.569     88.4843    -163.569     
1 1 1 -34 6  18 o 0 131.2   6.9   ?     ?   207.181   -150.018     292.568    -150.018     110.338    -150.018     
1 1 1 -34 6  17 o 0 45.4    4.7   ?     ?   184.921   157.799      96.4431    157.799      67.0864    -22.2011     
1 1 1 -34 6  16 o 0 4.4     3.7   ?     ?   97.9631   -135.749     61.4221    44.2508      151.041    44.2508      
1 1 1 -34 6  15 o 0 70      4.6   ?     ?   144.719   176.119      186.932    176.119      53.4462    176.119      
1 1 1 -34 6  14 o 0 240     6.3   ?     ?   275.675   88.7399      416.128    88.7399      155.514    88.7399      
1 1 1 -34 6  13 o 0 76.7    3.6   ?     ?   208.755   84.5272      137.705    84.5272      64.6261    -95.4728     
1 1 1 -34 6  12 o 0 138.1   4.4   ?     ?   133.238   134.359      311.894    134.359      181.87     134.359      
1 1 1 -34 6  11 o 0 201.9   4.9   ?     ?   428.119   -93.6573     185.663    -93.6573     186.729    86.3427      
1 1 1 -34 6  10 o 0 711.1   13.4  ?     ?   463.499   -101.594     681.616    -101.594     276.056    -101.594     
1 1 1 -34 6  9  o 0 490.8   9.6   ?     ?   410.025   149.869      531.011    149.869      173.406    149.869      
1 1 1 -34 6  8  o 0 36.1    2.8   ?     ?   93.5111   24.7998      4.12459    -155.2       86.0907    -155.2       
1 1 1 -34 6  7  o 0 166.2   5     ?     ?   527.744   -65.9931     32.8746    -65.9931     441.72     114.007      
1 1 1 -34 6  6  o 0 29.7    3.8   ?     ?   79.6115   -11.8215     22.1656    168.179      94.0563    168.179      
1 1 1 -34 6  5  o 0 560.3   16.5  ?     ?   460.363   -140.954     551.472    -140.954     134.208    -140.954     
1 1 1 -34 6  4  o 0 350.2   11.5  ?     ?   451.472   -24.4876     346.626    -24.4876     63.9348    155.512      
1 1 1 -34 6  3  o 0 561.6   17.7  ?     ?   696.812   -146.669     356.943    -146.669     278.571    33.3306      
1 1 1 -34 6  2  o 0 377.5   13.1  ?     ?   370.325   -151.527     438.056    -151.527     95.3547    -151.527     
1 1 1 -34 6  1  o 0 221     5.6   ?     ?   372.735   -161.25      238.302    -161.25      107.372    18.7501      
1 1 1 34  6  0  o 0 808     17    ?     ?   631.264   -0.31859     616.368    -0.31859     28.37      -0.31859     
1 1 1 34  6  1  o 0 57.4    3     ?     ?   128.951   -84.7327     24.8916    -84.7327     95.4063    95.2673      
1 1 1 34  6  2  o 0 287.2   6.8   ?     ?   499.759   1.79196      229.108    1.79196      237.697    -178.208     
1 1 1 34  6  3  o 0 685.2   13.9  ?     ?   520.188   167.115      622.451    167.115      141.937    167.115      
1 1 1 34  6  4  o 0 558.1   12.9  ?     ?   482.842   125.267      542.036    125.267      95.7704    125.267      
1 1 1 34  6  5  o 0 210.1   6.7   ?     ?   321.372   113.697      265.173    113.697      31.9055    -66.3025     
1 1 1 34  6  6  o 0 75.6    5.7   ?     ?   216.853   61.1778      58.5317    61.1778      141.88     -118.822     
1 1 1 34  6  7  o 0 183.9   7.8   ?     ?   195.13    152.363      305.092    152.363      128.634    152.363      
1 1 1 34  6  8  o 0 97.2    7.3   ?     ?   156.588   23.2258      140.569    23.2258      0.873983   -156.774     
1 1 1 34  6  9  o 0 356.7   10.9  ?     ?   580.157   33.7676      267.055    33.7676      256.142    -146.232     
1 1 1 34  6  10 o 0 373.8   11.1  ?     ?   512.65    -123.36      346.286    -123.36      119.1      56.6399      
1 1 1 34  6  11 o 0 142.3   10.4  ?     ?   327.768   43.011       172.241    43.011       124.537    -136.989     
1 1 1 34  6  12 o 0 239.1   13.7  ?     ?   277.524   -116.198     421.184    -116.198     138.334    -116.198     
1 1 1 34  6  13 o 0 225     11    ?     ?   311.947   -98.4992     367.993    -98.4992     51.1967    -98.4992     
1 1 1 34  6  14 o 0 219.4   14.3  ?     ?   158.886   -87.2281     489.535    -87.2281     331.641    -87.2281     
1 1 1 34  6  15 o 0 285     14.1  ?     ?   408.251   -45.5067     392.875    -45.5067     4.23575    134.493      
1 1 1 34  6  16 o 0 69.6    16.5  ?     ?   221.773   -41.8357     147.683    -41.8357     61.6136    138.164      
1 1 1 34  6  17 o 0 75.5    18.7  ?     ?   180.579   -120.947     191.369    -120.947     21.2445    -120.947     
1 1 1 34  6  18 o 0 59.8    17.7  ?     ?   193.485   114.411      138.279    114.411      44.5102    -65.5895     
1 1 1 34  6  19 o 0 120.5   24.2  ?     ?   185.759   122.208      303.315    122.208      114.03     122.208      
1 1 1 34  6  20 o 0 47.2    23    ?     ?   167.894   36.982       103.049    36.982       68.1436    -143.018     
1 1 1 34  6  21 o 0 14.2    21.8  ?     ?   130.748   18.2891      33.7283    18.2891      91.5026    -161.711     
1 1 1 34  6  22 o 0 -18.2   28.1  ?     ?   110.179   -47.7263     14.8538    -47.7263     88.5053    132.274      
1 1 1 34  6  23 < 0 27.7    27.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 8  22 < 1 29      7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 8  21 o 0 224     8.9   ?     ?   360.41    -175.659     336.559    -175.659     29.647     -175.659     
1 1 1 -34 8  20 o 0 169.5   7.7   ?     ?   271.607   155.377      322.097    155.377      85.2055    155.377      
1 1 1 -34 8  19 o 0 120.2   6.7   ?     ?   234.024   156.658      257.759    156.658      47.1289    156.658      
1 1 1 -34 8  18 o 0 26.9    5.2   ?     ?   78.0903   179.431      84.0756    179.431      10.618     179.431      
1 1 1 -34 8  17 o 0 110.6   6     ?     ?   236.302   -92.8983     236.946    -92.8983     21.841     -92.8983     
1 1 1 -34 8  16 o 0 274.4   8.2   ?     ?   291.417   -158.152     450.37     -158.152     197.269    -158.152     
1 1 1 -34 8  15 o 0 43.6    3.8   ?     ?   294.507   154.959      10.1055    154.959      247.875    -25.0414     
1 1 1 -34 8  14 o 0 223.2   6.1   ?     ?   403.755   -120.004     293.887    -120.004     61.324     59.9956      
1 1 1 -34 8  13 f 1 89.5    3.7   ?     ?   249.812   -130.674     164.637    -130.674     63.6426    49.3264      
1 1 1 -34 8  12 o 0 290.8   7     ?     ?   445.184   137.938      336.432    137.938      78.1312    -42.062      
1 1 1 -34 8  11 o 0 50.3    2.6   ?     ?   185.919   57.4713      91.3257    57.4713      82.9678    -122.529     
1 1 1 -34 8  10 o 0 1.1     1.8   ?     ?   75.8058   -12.9227     67.36      167.077      140.14     167.077      
1 1 1 -34 8  9  f 1 140.8   4.6   ?     ?   286.063   135.918      225.471    135.918      52.1848    -44.0821     
1 1 1 -34 8  8  o 0 190.4   5.5   ?     ?   304.472   -24.1138     257.997    -24.1138     3.78353    155.886      
1 1 1 -34 8  7  o 0 1133.9  30.6  ?     ?   642.994   -21.0397     815.704    -21.0397     260.179    -21.0397     
1 1 1 -34 8  6  o 0 295.6   10.7  ?     ?   484.564   -118.25      264.461    -118.25      156.033    61.7496      
1 1 1 -34 8  5  o 0 1.8     5.2   ?     ?   191.748   -109.232     147.038    70.7678      312.643    70.7678      
1 1 1 -34 8  4  o 0 371.2   14    ?     ?   418.273   -82.2587     399.757    -82.2587     37.2389    -82.2587     
1 1 1 -34 8  3  o 0 29.2    6.4   ?     ?   421.23    123.17       190.331    -56.8303     556.543    -56.8303     
1 1 1 -34 8  2  o 0 496.2   18.2  ?     ?   576.138   12.8357      404.097    12.8357      98.1315    -167.164     
1 1 1 -34 8  1  o 0 1007.9  19.1  ?     ?   729.102   -59.0086     679.157    -59.0086     42.15      -59.0086     
1 1 1 34  8  0  o 0 715.5   14.4  ?     ?   455.454   -14.1494     697.195    -14.1494     295.875    -14.1494     
1 1 1 34  8  1  o 0 173.1   6.3   ?     ?   369.357   35.7179      182.266    35.7179      143.609    -144.282     
1 1 1 34  8  2  o 0 517.8   11.4  ?     ?   557.152   -145.578     446.009    -145.578     46.015     34.4224      
1 1 1 34  8  3  o 0 280.5   7.6   ?     ?   331.813   -41.4332     363.713    -41.4332     70.5166    -41.4332     
1 1 1 34  8  4  o 0 463.3   11.1  ?     ?   380.226   24.5515      533.52     24.5515      197.479    24.5515      
1 1 1 34  8  5  o 0 158.2   6.4   ?     ?   176.625   129.175      285.848    129.175      128.414    129.175      
1 1 1 34  8  6  o 0 624     15.5  ?     ?   531.907   28.9515      564.924    28.9515      91.104     28.9515      
1 1 1 34  8  7  o 0 215.7   7.5   ?     ?   84.6557   52.4281      339.248    52.4281      263.917    52.4281      
1 1 1 34  8  8  o 0 77.7    7.9   ?     ?   321.046   -98.2838     57.9747    -98.2838     264.099    81.7162      
1 1 1 34  8  9  f 1 96      9.2   ?     ?   229.046   -162.687     177.818    -162.687     52.6861    17.3132      
1 1 1 34  8  10 o 0 352.8   13.9  ?     ?   378.526   -174.803     483.625    -174.803     105.567    -174.803     
1 1 1 34  8  11 o 0 29.4    9.2   ?     ?   175.492   72.7975      16.8132    72.7975      154.897    -107.202     
1 1 1 34  8  12 o 0 24.6    11.5  ?     ?   60.6976   115.563      28.7997    115.563      29.3991    -64.4366     
1 1 1 34  8  13 f 1 52.8    11.7  ?     ?   185.3     -96.6727     113.787    -96.6727     64.1046    83.3273      
1 1 1 34  8  14 o 0 0.9     13.2  ?     ?   92.3462   2.91681      30.4348    -177.083     116.065    -177.083     
1 1 1 34  8  15 o 0 120.8   15.3  ?     ?   186.309   22.3374      297.33     22.3374      124.757    22.3374      
1 1 1 34  8  16 o 0 19.2    14.8  ?     ?   186.283   -30.3673     12.4287    149.633      185.569    149.633      
1 1 1 34  8  17 o 0 1.5     16    ?     ?   92.4293   -110.367     11.1695    69.6331      103.89     69.6331      
1 1 1 34  8  18 o 0 75.8    24.7  ?     ?   161.219   178.91       197.392    178.91       35.4611    178.91       
1 1 1 34  8  19 o 0 34.1    28.1  ?     ?   114.618   105.379      99.9727    105.38       10.5373    -74.6205     
1 1 1 34  8  20 o 0 60.5    28.8  ?     ?   184.038   31.8576      129.264    31.8576      41.0039    -148.142     
1 1 1 34  8  21 o 0 37.7    30.6  ?     ?   126.435   -170.697     109.755    -170.697     6.60485    9.3028       
1 1 1 -34 10 20 < 0 42.2    8.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 10 19 o 0 115.2   7.7   ?     ?   213.225   154.528      266.793    154.528      88.187     154.528      
1 1 1 -34 10 18 o 0 22.4    6.1   ?     ?   105.044   -119.142     65.1693    -119.142     24.6926    60.8581      
1 1 1 -34 10 17 o 0 95.3    7     ?     ?   240.81    44.3424      194.408    44.3424      18.0412    -135.658     
1 1 1 -34 10 16 o 0 42.7    6.7   ?     ?   99.3469   130.629      141.292    130.629      49.7463    130.629      
1 1 1 -34 10 15 o 0 36.3    4.6   ?     ?   130.465   68.8201      101.284    68.8201      19.096     -111.18      
1 1 1 -34 10 14 o 0 37      3.8   ?     ?   127.302   -103.92      103.737    -103.92      10.6568    76.0796      
1 1 1 -34 10 13 o 0 78.2    4     ?     ?   182.124   -150.044     191.293    -150.044     33.9546    -150.044     
1 1 1 -34 10 12 o 0 27.2    3     ?     ?   116.064   13.1165      57.9239    13.1165      42.2136    -166.883     
1 1 1 -34 10 11 o 0 121.2   4.2   ?     ?   261.111   70.862       230.081    70.862       4.0802     70.862       
1 1 1 -34 10 10 o 0 60.9    3     ?     ?   264.892   6.81432      86.6198    6.81432      144.145    -173.186     
1 1 1 -34 10 9  o 0 117     3.9   ?     ?   324.659   -16.9491     164.681    -16.9491     127.121    163.051      
1 1 1 -34 10 8  o 0 35.3    2.7   ?     ?   189.662   83.7681      47.9314    83.7681      123.485    -96.2319     
1 1 1 -34 10 7  o 0 54.1    2.9   ?     ?   229.005   -107.33      74.3513    -107.33      137.213    72.6705      
1 1 1 -34 10 6  f 1 13.4    2.2   ?     ?   214.608   -123.692     88.051     56.3084      288.259    56.3084      
1 1 1 -34 10 5  o 0 76.6    3.8   ?     ?   185.677   -136.594     167.927    -136.594     5.12546    43.4061      
1 1 1 -34 10 4  o 0 53      3     ?     ?   94.0808   -21.2429     89.1818    -21.2429     0.393104   158.757      
1 1 1 -34 10 3  o 0 29.2    2.2   ?     ?   181.206   90.3334      7.71209    -89.6666     180.805    -89.6666     
1 1 1 -34 10 2  f 1 46      2.9   ?     ?   83.2763   -21.8662     65.8292    -21.8662     14.3551    158.134      
1 1 1 -34 10 1  o 0 64.1    3.2   ?     ?   155.593   90.6586      125.137    90.6586      24.2712    -89.3414     
1 1 1 34  10 0  o 0 8.3     2.9   ?     ?   186.173   5.72513      122.859    -174.275     304.071    -174.275     
1 1 1 34  10 1  o 0 299.8   7.7   ?     ?   464.411   -34.6492     326.832    -34.6492     125.658    145.351      
1 1 1 34  10 2  f 1 92      4.7   ?     ?   201.432   -23.729      181.984    -23.729      15.4109    156.271      
1 1 1 34  10 3  o 0 19.4    4     ?     ?   95.4368   125.78       17.8359    -54.2195     110.904    -54.2195     
1 1 1 34  10 4  o 0 69.2    5.5   ?     ?   215.932   132.859      131.806    132.859      75.0565    -47.1406     
1 1 1 34  10 5  o 0 251.8   8.4   ?     ?   444.937   137.021      290.708    137.021      135.298    -42.9793     
1 1 1 34  10 6  f 1 227.3   8.8   ?     ?   464.434   146.82       233.563    146.82       212.952    -33.1797     
1 1 1 34  10 7  o 0 329.5   11    ?     ?   314.157   -169.582     511.373    -169.582     211.313    -169.582     
1 1 1 34  10 8  o 0 458.4   13.8  ?     ?   363.123   -102.832     629.097    -102.832     288.705    -102.832     
1 1 1 34  10 9  o 0 66.9    10    ?     ?   107.794   155.571      187.903    155.571      87.093     155.571      
1 1 1 34  10 10 o 0 280.5   12.9  ?     ?   316.958   -45.4616     459.589    -45.4616     171.356    -45.4616     
1 1 1 34  10 11 o 0 109.2   11.3  ?     ?   180.295   -69.4533     273.411    -69.4533     109.374    -69.4533     
1 1 1 34  10 12 o 0 154.3   15.2  ?     ?   478.481   -156.367     116.894    -156.367     316.816    23.6334      
1 1 1 34  10 13 o 0 47.7    13.3  ?     ?   211.832   156.09       85.1565    156.09       107.725    -23.9101     
1 1 1 34  10 14 o 0 84.8    18.9  ?     ?   206.522   -179.869     196.596    -179.869     6.5849     0.130709     
1 1 1 34  10 15 o 0 93.4    17.7  ?     ?   181.889   87.6479      240.404    87.6479      61.038     87.6479      
1 1 1 34  10 16 o 0 -23.8   23.5  ?     ?   160.172   153.702      51.0884    -26.2977     202.87     -26.2977     
1 1 1 34  10 17 o 0 95.5    27.1  ?     ?   223.189   65.6965      204.37     65.6965      1.47061    -114.304     
1 1 1 34  10 18 o 0 62.3    23.9  ?     ?   131.487   130.91       178.865    130.91       59.9531    130.91       
1 1 1 34  10 19 o 0 90.3    29.5  ?     ?   270.208   -124.567     134.135    -124.567     109.092    55.4333      
1 1 1 -34 12 17 < 1 10.2    5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 12 16 o 0 13.1    6     ?     ?   58.4257   86.296       37.7395    86.296       10.3058    -93.704      
1 1 1 -34 12 15 o 0 38.3    6.7   ?     ?   169.896   -27.8022     97.6784    -27.8022     42.9856    152.198      
1 1 1 -34 12 14 f 1 23.5    4.9   ?     ?   98.9651   -36.4283     72.4925    -36.4283     11.6727    143.572      
1 1 1 -34 12 13 f 1 172.7   6.6   ?     ?   191.225   144.73       376.798    144.73       209.354    144.73       
1 1 1 -34 12 12 o 0 105.4   5     ?     ?   201.475   -168.074     240.551    -168.074     57.5266    -168.074     
1 1 1 -34 12 11 o 0 64.1    4.8   ?     ?   203.362   -144.344     141.113    -144.344     44.9559    35.6565      
1 1 1 -34 12 10 o 0 7.1     3.5   ?     ?   115.353   -149.46      45.4291    30.5395      150.892    30.5395      
1 1 1 -34 12 9  o 0 59.3    4     ?     ?   195.545   -158.087     129.734    -158.087     35.9871    21.9129      
1 1 1 -34 12 8  f 1 166.7   5.5   ?     ?   314.854   -120.445     262.82     -120.445     6.9366     59.5554      
1 1 1 -34 12 7  o 0 111.3   4.9   ?     ?   292.579   100.98       181.304    100.98       67.2331    -79.0195     
1 1 1 -34 12 6  o 0 213.3   6.9   ?     ?   385.422   112.745      283.523    112.745      45.4662    -67.2554     
1 1 1 -34 12 5  o 0 7.7     2.9   ?     ?   16.1333   173.673      5.40548    -6.32661     19.2369    -6.32661     
1 1 1 -34 12 4  o 0 74.1    4.5   ?     ?   280.853   -138.018     108.044    -138.018     132.774    41.9817      
1 1 1 -34 12 3  o 0 175.7   6.5   ?     ?   393.846   170.571      221.772    170.571      117.103    -9.42888     
1 1 1 -34 12 2  o 0 349.5   12.5  ?     ?   273.102   166.957      556.117    166.957      320.426    166.957      
1 1 1 -34 12 1  o 0 325.2   11.3  ?     ?   381.354   -57.7911     442.428    -57.7911     112.466    -57.7911     
1 1 1 34  12 0  o 0 234.5   8     ?     ?   308.282   63.5292      389.587    63.5292      117.718    63.5292      
1 1 1 34  12 1  o 0 261.3   8.3   ?     ?   345.211   57.5438      397.97     57.5438      93.3147    57.5438      
1 1 1 34  12 2  o 0 154.5   6.8   ?     ?   418.486   90.9575      169.765    90.9575      199.677    -89.0425     
1 1 1 34  12 3  o 0 0.6     5.7   ?     ?   169.157   119.081      107.39     -60.9192     256.71     -60.9192     
1 1 1 34  12 4  o 0 24.4    6.1   ?     ?   203.584   104.677      1.71913    104.677      178.58     -75.3229     
1 1 1 34  12 5  o 0 44.4    7.4   ?     ?   186.119   55.6376      91.7984    55.6376      72.8825    -124.362     
1 1 1 34  12 6  o 0 -3.1    8     ?     ?   44.2264   -0.94677     25.1492    179.053      64.2287    179.053      
1 1 1 34  12 7  o 0 5.8     9     ?     ?   74.6267   55.6298      20.1313    -124.37      86.5324    -124.37      
1 1 1 34  12 8  f 1 155.3   12    ?     ?   311.139   -44.8411     254.565    -44.8411     23.0826    135.159      
1 1 1 34  12 9  o 0 70.3    10.7  ?     ?   153.134   -129.842     200.673    -129.842     53.4878    -129.842     
1 1 1 34  12 10 o 0 -1.9    11.7  ?     ?   31.8696   116.598      9.88719    -63.402      40.4228    -63.402      
1 1 1 34  12 11 o 0 51.8    12.9  ?     ?   247.477   8.83094      67.4703    8.83094      170.57     -171.169     
1 1 1 34  12 12 o 0 20      17.2  ?     ?   144.703   -57.7517     25.9208    -57.7517     108.034    122.248      
1 1 1 34  12 13 f 1 -11.6   19.8  ?     ?   24.6056   47.7717      0.0949472  -132.228     22.8871    -132.228     
1 1 1 34  12 14 f 1 8.6     14.4  ?     ?   148.409   78.276       12.7674    -101.724     146.706    -101.724     
1 1 1 34  12 15 o 0 54.3    22.8  ?     ?   117.625   -37.289      161.705    -37.289      58.0326    -37.289      
1 1 1 34  12 16 o 0 37.4    26.1  ?     ?   170.823   -96.6227     73.3373    -96.6227     76.6777    83.3773      
1 1 1 -34 14 13 < 0 15.9    7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 14 12 < 0 10.7    6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 14 11 o 0 1.9     5.7   ?     ?   105.309   49.7176      31.9681    -130.282     117.324    -130.282     
1 1 1 -34 14 10 o 0 1.4     5.2   ?     ?   66.9472   -172.028     25.1915    7.97181      79.7074    7.97181      
1 1 1 -34 14 9  o 0 -5      5.2   ?     ?   44.2995   -175.16      26.4926    4.83961      63.2785    4.83961      
1 1 1 -34 14 8  o 0 57.7    5.6   ?     ?   206.737   61.3328      127.394    61.3328      45.3056    -118.667     
1 1 1 -34 14 7  o 0 69.1    5.5   ?     ?   266.544   110.097      107.11     110.097      121.544    -69.9029     
1 1 1 -34 14 6  o 0 82.7    5.8   ?     ?   258.359   147.552      148.4      147.552      74.3492    -32.448      
1 1 1 -34 14 5  o 0 21.1    4.8   ?     ?   119.975   163.673      47.519     163.673      56.3924    -16.3274     
1 1 1 -34 14 4  o 0 31.2    5.1   ?     ?   122.835   -38.7071     86.9265    -38.7071     23.6212    141.293      
1 1 1 -34 14 3  o 0 145.5   7.1   ?     ?   220.431   14.5872      301.756    14.5872      102.65     14.5872      
1 1 1 -34 14 2  o 0 7.7     5.8   ?     ?   87.5254   10.3331      20.4061    -169.667     99.7165    -169.667     
1 1 1 -34 14 1  o 0 10.9    7     ?     ?   128.801   -60.5385     20.745     119.462      137.777    119.462      
1 1 1 34  14 0  o 0 1.1     6.8   ?     ?   19.1837   -21.8055     8.35018    158.195      26.2172    158.195      
1 1 1 34  14 1  o 0 115.7   8.7   ?     ?   234.474   -122.21      240.325    -122.21      21.8473    -122.21      
1 1 1 34  14 2  o 0 311.1   12    ?     ?   370.352   176.848      429.445    176.848      84.3481    176.848      
1 1 1 34  14 3  o 0 -3.7    9     ?     ?   85.5014   125.485      40.946     -54.5152     120.586    -54.5152     
1 1 1 34  14 4  o 0 -0.9    6.4   ?     ?   6.80482   -59.3468     3.3521     120.653      9.47212    120.653      
1 1 1 34  14 5  o 0 0.4     10    ?     ?   78.6945   149.631      22.4032    -30.3687     93.0909    -30.3687     
1 1 1 34  14 6  o 0 49.9    11.3  ?     ?   72.8923   20.1232      168.013    20.1232      102.646    20.1232      
1 1 1 34  14 7  o 0 92.3    13    ?     ?   273.59    81.2074      165.386    81.2074      74.3361    -98.7926     
1 1 1 34  14 8  o 0 18.9    14.4  ?     ?   92.3157   71.2957      46.8316    71.2957      33.8501    -108.704     
1 1 1 34  14 9  o 0 12.2    15.5  ?     ?   89.1616   -179.492     35.34      -179.492     41.3388    0.508366     
1 1 1 34  14 10 o 0 69.1    16    ?     ?   157.849   177.416      195.345    177.416      60.0631    177.416      
1 1 1 34  14 11 o 0 21.6    19.5  ?     ?   115.725   -140.864     65.6324    -140.864     33.3841    39.1361      
1 1 1 34  14 12 < 0 65      20.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 16 5  < 0 5.1     7.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 16 4  < 0 33.8    8.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 16 3  < 0 55.5    8.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 16 2  < 0 9.8     6.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -34 16 1  < 0 -10.3   9.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 34  16 0  < 0 19.6    10.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 34  16 1  < 0 59.5    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 34  16 2  < 0 144.9   12.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 34  16 3  < 0 109.7   13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 34  16 4  < 0 51.2    13    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 34  16 5  < 0 51.6    19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 1  25 < 0 17.7    8.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 1  24 o 0 13.7    7.3   ?     ?   90.8483   -24.4928     27.9241    -24.4928     52.535     155.507      
1 1 1 -35 1  23 o 0 54.5    6.3   ?     ?   99.0721   82.555       191.246    82.555       99.4474    82.555       
1 1 1 -35 1  22 o 0 -4.2    5.9   ?     ?   59.1534   27.8992      39.9461    -152.101     97.2687    -152.101     
1 1 1 -35 1  21 o 0 13.8    4.9   ?     ?   85.122    133.776      8.43011    133.776      74.2755    -46.224      
1 1 1 -35 1  20 f 1 43      4.6   ?     ?   99.3073   70.8785      124.184    70.8785      34.7576    70.8785      
1 1 1 -35 1  19 o 0 110     4.7   ?     ?   194.394   112.366      265.276    112.366      90.1667    112.366      
1 1 1 -35 1  18 o 0 17.3    3.7   ?     ?   171.466   130.001      25.0382    -49.9987     184.83     -49.9987     
1 1 1 -35 1  17 o 0 80.5    4.3   ?     ?   208.687   -136.054     167.524    -136.054     31.9042    43.9463      
1 1 1 -35 1  16 o 0 172.6   5.2   ?     ?   313.66    64.2971      266.997    64.2971      40.4669    -115.703     
1 1 1 -35 1  15 o 0 108.3   4.1   ?     ?   282.819   -36.525      165.123    -36.525      114.154    143.475      
1 1 1 -35 1  14 o 0 237.7   5.6   ?     ?   312.09    -88.5256     327.584    -88.5256     52.7574    -88.5256     
1 1 1 -35 1  13 o 0 16.6    2.9   ?     ?   197.986   148.168      101.635    -31.8319     275.578    -31.8319     
1 1 1 -35 1  12 o 0 150.5   5.9   ?     ?   108.099   140.974      219.13     140.974      123.592    140.974      
1 1 1 -35 1  11 o 0 329     9.1   ?     ?   533.324   -33.3035     254.674    -33.3035     229.35     146.696      
1 1 1 -35 1  10 o 0 1443.7  25.8  ?     ?   522.454   80.1673      1123.49    80.1673      646.937    80.1673      
1 1 1 -35 1  9  o 0 941.4   20.3  ?     ?   534.642   -81.0608     794.852    -81.0608     299.003    -81.0608     
1 1 1 -35 1  8  o 0 1188.6  26.6  ?     ?   814.857   -163.884     698.088    -163.884     40.8786    16.1158      
1 1 1 -35 1  7  o 0 154     4     ?     ?   285.627   7.02815      186.234    7.02815      73.7792    -172.972     
1 1 1 -35 1  6  o 0 1394.9  34.8  ?     ?   912.737   54.7755      739.263    54.7755      94.494     -125.224     
1 1 1 -35 1  5  o 0 592     15.6  ?     ?   748.453   14.9288      321.199    14.9288      373.681    -165.071     
1 1 1 -35 1  4  f 1 1656.1  36.3  ?     ?   749.911   126.567      1021.09    126.567      319.288    126.567      
1 1 1 -35 1  3  o 0 1281.6  32.5  ?     ?   981.435   5.92387      606.486    5.92387      309.651    -174.076     
1 1 1 -35 1  2  o 0 2125.7  37.2  ?     ?   997.859   70.7821      1038.54    70.7821      104.883    70.7821      
1 1 1 -35 1  1  o 0 999.3   25.8  ?     ?   812.606   -28.7427     581.811    -28.7427     180.139    151.257      
1 1 1 35  1  0  o 0 516     14.1  ?     ?   514.024   142.354      461.98     142.354      20.7828    -37.6456     
1 1 1 35  1  1  o 0 676.2   16.3  ?     ?   722.044   130.085      422.106    130.085      257.254    -49.9151     
1 1 1 35  1  2  o 0 1340.3  26.7  ?     ?   788.934   176.667      824.014    176.667      80.5339    176.667      
1 1 1 35  1  3  o 0 169.2   5.4   ?     ?   258.23    -154.328     234.532    -154.328     9.14705    25.6724      
1 1 1 35  1  4  f 1 1281.7  25    ?     ?   775.795   -130.166     798.997    -130.166     62.3816    -130.166     
1 1 1 35  1  5  o 0 2.4     3.2   ?     ?   272.219   -17.6657     237.932    162.334      495.264    162.334      
1 1 1 35  1  6  o 0 12      3.7   ?     ?   170.393   -4.63575     116.173    175.364      275.201    175.364      
1 1 1 35  1  7  o 0 118.4   7.3   ?     ?   227.434   -50.6906     150.259    -50.6906     61.9866    129.309      
1 1 1 35  1  8  o 0 678.2   18.5  ?     ?   455.944   36.7693      662.713    36.7693      237.448    36.7693      
1 1 1 35  1  9  o 0 293.8   11.7  ?     ?   427.91    60.3065      309.034    60.3065      95.5401    -119.693     
1 1 1 35  1  10 o 0 777.7   18.2  ?     ?   862.872   171.393      406.455    171.393      408.138    -8.60713     
1 1 1 35  1  11 o 0 159.2   10.2  ?     ?   421.112   170.091      110.378    170.091      286.38     -9.9088      
1 1 1 35  1  12 o 0 101.4   10.5  ?     ?   166.137   101.932      152.657    101.932      0.229247   -78.0681     
1 1 1 35  1  13 o 0 207.7   11.6  ?     ?   439.894   -25.5221     196.122    -25.5221     211.016    154.478      
1 1 1 35  1  14 o 0 336.2   13.9  ?     ?   453.078   -107.209     357.985    -107.209     59.8992    72.7911      
1 1 1 35  1  15 o 0 148.4   13.2  ?     ?   139.2     148.441      351.45     148.441      207.061    148.441      
1 1 1 35  1  16 o 0 165.9   15.2  ?     ?   241.156   -32.1418     344.427    -32.1418     99.7346    -32.1418     
1 1 1 35  1  17 o 0 212.2   17.3  ?     ?   253.594   -71.5992     426.059    -71.5992     174.279    -71.5992     
1 1 1 35  1  18 o 0 41.2    18.1  ?     ?   32.7772   71.7754      58.3407    71.7754      26.777     71.7754      
1 1 1 35  1  19 o 0 17.7    20    ?     ?   215.827   -170.753     32.6258    9.24749      240.043    9.24749      
1 1 1 35  1  20 f 1 21      21.7  ?     ?   197.539   123.567      3.51049    -56.4326     194.812    -56.4326     
1 1 1 35  1  21 o 0 6.8     26.6  ?     ?   50.9419   75.7795      31.9784    75.7795      20.9494    -104.22      
1 1 1 35  1  22 o 0 -32.9   31.1  ?     ?   101.47    -55.52       0.199876   124.48       102.123    124.48       
1 1 1 35  1  23 o 0 43.8    29.7  ?     ?   213.244   63.8913      58.9999    63.8913      149.185    -116.109     
1 1 1 35  1  24 o 0 -30.6   29.6  ?     ?   166.311   90.2176      23.5191    -89.7824     182.886    -89.7824     
1 1 1 -35 3  25 < 0 62.3    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 3  24 o 0 85.9    8.6   ?     ?   135.288   114.488      271.925    114.488      153.346    114.488      
1 1 1 -35 3  23 o 0 72.4    7     ?     ?   241.387   157.862      149.981    157.862      66.3454    -22.1381     
1 1 1 -35 3  22 f 1 92      6.7   ?     ?   165.868   -171.434     255.065    -171.434     100.8      -171.434     
1 1 1 -35 3  21 o 0 39.6    5.2   ?     ?   53.6302   -6.08599     113.967    -6.08599     62.4609    -6.08599     
1 1 1 -35 3  20 o 0 70.1    5.4   ?     ?   190.761   14.3808      170.214    14.3808      0.254612   -165.619     
1 1 1 -35 3  19 o 0 6.1     4.8   ?     ?   131.829   -100.013     64.4936    79.9872      182.398    79.9872      
1 1 1 -35 3  18 o 0 119.6   5.4   ?     ?   243.098   -88.3613     249.49     -88.3613     30.9051    -88.3613     
1 1 1 -35 3  17 o 0 8.1     4     ?     ?   39.6752   -41.9375     16.9797    138.062      53.8827    138.062      
1 1 1 -35 3  16 o 0 13.7    3.4   ?     ?   141.732   -164.669     44.4644    15.331       179.633    15.331       
1 1 1 -35 3  15 f 1 148.1   4.5   ?     ?   248.065   34.1101      272.649    34.1101      28.7544    34.1101      
1 1 1 -35 3  14 o 0 338.1   8.7   ?     ?   404.86    62.753       379.462    62.753       26.1741    62.753       
1 1 1 -35 3  13 o 0 146.1   5.2   ?     ?   248.175   -171.945     227.798    -171.945     9.76376    -171.945     
1 1 1 -35 3  12 o 0 759.3   14.8  ?     ?   544.057   49.0761      656.836    49.0761      180.003    49.0761      
1 1 1 -35 3  11 o 0 196.4   5     ?     ?   292.564   52.4215      271.481    52.4215      13.5617    52.4215      
1 1 1 -35 3  10 o 0 961.9   19.1  ?     ?   529.608   -80.1133     809.625    -80.1133     330.218    -80.1133     
1 1 1 -35 3  9  o 0 1072.9  22.7  ?     ?   670.964   -25.8145     768.758    -25.8145     158.376    -25.8145     
1 1 1 -35 3  8  o 0 310.3   8.1   ?     ?   611.749   85.349       160.662    85.349       405.145    -94.651      
1 1 1 -35 3  7  o 0 583.6   13.4  ?     ?   794.769   81.0781      276.98     81.0781      441.741    -98.9219     
1 1 1 -35 3  6  o 0 676.4   12.8  ?     ?   618.593   110.422      508.797    110.422      52.6949    -69.5784     
1 1 1 -35 3  5  o 0 1617.1  30.4  ?     ?   848.644   -8.65723     916.055    -8.65723     143.152    -8.65723     
1 1 1 -35 3  4  o 0 1330.1  24.3  ?     ?   816.081   25.6891      787.626    25.6891      42.1314    25.6891      
1 1 1 -35 3  3  o 0 548.3   11.9  ?     ?   521.483   -6.77991     480.277    -6.77991     3.69364    173.22       
1 1 1 -35 3  2  o 0 345.4   7.4   ?     ?   647.989   -143.02      163.928    -143.02      438.898    36.9795      
1 1 1 -35 3  1  o 0 1088.1  20.5  ?     ?   823.779   175.773      627.785    175.773      140.207    -4.22684     
1 1 1 35  3  0  o 0 1026.6  23.1  ?     ?   824.866   4.20262      586.939    4.20262      183.354    -175.797     
1 1 1 35  3  1  o 0 193     5.2   ?     ?   344.362   79.7382      214.927    79.7382      107.229    -100.262     
1 1 1 35  3  2  o 0 1731.8  37.2  ?     ?   839.436   -64.9116     989.883    -64.9116     203.354    -64.9116     
1 1 1 35  3  3  o 0 1710.2  31.4  ?     ?   838.044   -54.5145     990.314    -54.5145     214.321    -54.5145     
1 1 1 35  3  4  o 0 914.9   17.7  ?     ?   739.845   -37.5831     597.029    -37.5831     88.7019    142.417      
1 1 1 35  3  5  o 0 808.3   16.4  ?     ?   812.461   -0.432892    453.835    -0.432892    299.663    179.567      
1 1 1 35  3  6  o 0 337.2   10.2  ?     ?   509.895   10.9037      280.615    10.9037      192.38     -169.096     
1 1 1 35  3  7  o 0 2180.5  42.5  ?     ?   1115.25   -144.134     998.851    -144.134     63.385     35.8663      
1 1 1 35  3  8  o 0 116.4   6.7   ?     ?   269.102   178.578      133.433    178.578      119.64     -1.42243     
1 1 1 35  3  9  o 0 80.2    7.4   ?     ?   284.244   97.9445      40.3703    97.9445      226.637    -82.0555     
1 1 1 35  3  10 o 0 33.6    8.7   ?     ?   127.073   112.295      30.0467    -67.7045     149.218    -67.7045     
1 1 1 35  3  11 o 0 41.8    8.6   ?     ?   191.834   69.564       11.5132    -110.436     187.294    -110.436     
1 1 1 35  3  12 o 0 54.5    9.5   ?     ?   136.19    40.5723      36.9042    40.5723      87.5588    -139.428     
1 1 1 35  3  13 o 0 179.3   11.9  ?     ?   278.552   -138.593     275.539    -138.593     19.55      -138.593     
1 1 1 35  3  14 o 0 485.2   17.7  ?     ?   424.122   -113.866     617.61     -113.866     179.124    -113.866     
1 1 1 35  3  15 f 1 269     15.1  ?     ?   402.305   77.6481      370.84     77.6481      38.2359    -102.352     
1 1 1 35  3  16 o 0 218.2   15.5  ?     ?   336.948   56.6807      351.247    56.6807      11.9481    56.6807      
1 1 1 35  3  17 o 0 172     16.9  ?     ?   342.949   92.8414      272.437    92.8414      65.4166    -87.1586     
1 1 1 35  3  18 o 0 107.5   17.9  ?     ?   133.812   -72.569      307.113    -72.569      179.28     -72.569      
1 1 1 35  3  19 o 0 182.6   24.7  ?     ?   237.065   9.39968      383.447    9.39968      157.475    9.39968      
1 1 1 35  3  20 o 0 40.7    25.8  ?     ?   95.9583   30.1119      121.738    30.1119      22.2152    30.1119      
1 1 1 35  3  21 o 0 71.2    24.7  ?     ?   37.6986   54.5858      181.773    54.5858      142.649    54.5858      
1 1 1 35  3  22 f 1 108.1   25.6  ?     ?   153.929   100.372      306.268    100.372      152.22     100.372      
1 1 1 35  3  23 o 0 31.3    28.8  ?     ?   151.087   117.376      78.2026    117.376      66.0679    -62.624      
1 1 1 35  3  24 o 0 44.6    27.7  ?     ?   116.175   -71.9216     139.751    -71.9216     29.4548    -71.9216     
1 1 1 -35 5  24 < 0 12.4    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 5  23 o 0 19      8.2   ?     ?   19.917    -109.681     25.9924    -109.681     8.73038    -109.681     
1 1 1 -35 5  22 o 0 91.1    7.5   ?     ?   208.723   8.09179      221.39     8.09179      36.0286    8.09179      
1 1 1 -35 5  21 o 0 113.7   7.6   ?     ?   255.187   71.8617      222.706    71.8617      19.41      -108.138     
1 1 1 -35 5  20 o 0 72.7    6.3   ?     ?   109.852   132.7        231.439    132.7        126.913    132.7        
1 1 1 -35 5  19 o 0 37.1    5.2   ?     ?   217.717   118.187      46.9461    118.187      145.794    -61.8125     
1 1 1 -35 5  18 o 0 64      4.9   ?     ?   107.275   -135.83      189.57     -135.83      94.5317    -135.83      
1 1 1 -35 5  17 o 0 219.1   7.4   ?     ?   307.214   158.863      371.229    158.863      97.6285    158.863      
1 1 1 -35 5  16 f 1 33.7    3.7   ?     ?   103.433   58.7467      75.5069    58.7467      20.2613    -121.253     
1 1 1 -35 5  15 o 0 177.7   6     ?     ?   313.906   -34.1644     284.559    -34.1644     11.8992    145.836      
1 1 1 -35 5  14 f 1 45.4    3.8   ?     ?   370.494   72.3132      84.2482    -107.687     444.937    -107.687     
1 1 1 -35 5  13 o 0 927.5   17.5  ?     ?   672       36.3125      745.654    36.3125      90.1106    36.3125      
1 1 1 -35 5  12 o 0 43.5    2.7   ?     ?   151.92    164.43       28.3249    164.43       103.812    -15.5698     
1 1 1 -35 5  11 o 0 121.8   3.8   ?     ?   139.546   153.369      216.907    153.369      94.7735    153.369      
1 1 1 -35 5  10 o 0 361.8   8.8   ?     ?   592.331   133.988      254.324    133.988      262.573    -46.012      
1 1 1 -35 5  9  o 0 190.9   4.5   ?     ?   358.205   -160.245     217.552    -160.245     96.7054    19.7547      
1 1 1 -35 5  8  f 1 2035.7  35.3  ?     ?   1079.74   172.366      927.062    172.366      50.0955    -7.63383     
1 1 1 -35 5  7  o 0 226.5   4.8   ?     ?   186.123   178.294      344.922    178.294      176.595    178.294      
1 1 1 -35 5  6  o 0 576.2   13.3  ?     ?   690.594   98.6278      374.104    98.6278      252.989    -81.3722     
1 1 1 -35 5  5  o 0 214.7   7.8   ?     ?   124.032   -171.095     309.437    -171.095     196.4      -171.095     
1 1 1 -35 5  4  o 0 129.3   5.9   ?     ?   413.542   -110.243     53.8399    -110.243     328.846    69.757       
1 1 1 -35 5  3  o 0 13.9    1.6   ?     ?   343.555   151.484      225.638    -28.516      536.096    -28.516      
1 1 1 -35 5  2  f 1 35.2    2     ?     ?   98.6928   -169.386     18.7313    10.6138      108.6      10.6138      
1 1 1 -35 5  1  f 1 993.6   18.6  ?     ?   557.229   47.7455      792.683    47.7455      284.175    47.7455      
1 1 1 35  5  0  o 0 1542.9  28.5  ?     ?   765.266   154.404      949.68     154.404      252.503    154.404      
1 1 1 35  5  1  f 1 159.8   5.2   ?     ?   434.777   -58.1494     89.661     -58.1494     309.127    121.851      
1 1 1 35  5  2  f 1 150.3   4.5   ?     ?   356.83    47.4345      132.473    47.4345      195.27     -132.565     
1 1 1 35  5  3  o 0 580.3   12.1  ?     ?   573.764   65.0811      468.731    65.0811      56.1255    -114.919     
1 1 1 35  5  4  o 0 634.9   13.3  ?     ?   451.955   63.8833      634.212    63.8833      209.319    63.8833      
1 1 1 35  5  5  o 0 216.6   6.6   ?     ?   410.392   4.2413       210.629    4.2413       170.707    -175.759     
1 1 1 35  5  6  o 0 136.5   6.7   ?     ?   226.975   -166.214     191.403    -166.214     19.4898    13.7861      
1 1 1 35  5  7  o 0 198.3   8.7   ?     ?   203.947   -136.703     307.19     -136.703     117.787    -136.703     
1 1 1 35  5  8  f 1 335.2   9.3   ?     ?   346.211   -83.5714     431.082    -83.5714     114.94     -83.5714     
1 1 1 35  5  9  o 0 274.1   10.1  ?     ?   339.923   66.8777      358.994    66.8777      50.6205    66.8777      
1 1 1 35  5  10 o 0 728.9   17.6  ?     ?   707.081   -35.9749     514.606    -35.9749     125.625    144.025      
1 1 1 35  5  11 o 0 789.4   18.2  ?     ?   682.256   59.4262      583.367    59.4262      38.3003    -120.574     
1 1 1 35  5  12 o 0 352.1   14.1  ?     ?   538.161   -62.7925     299.448    -62.7925     189.501    117.207      
1 1 1 35  5  13 o 0 422     15.5  ?     ?   408.468   -56.2532     553.161    -56.2532     135.553    -56.2532     
1 1 1 35  5  14 f 1 131.7   12.3  ?     ?   231.896   -79.6549     278.17     -79.6549     44.934     -79.6549     
1 1 1 35  5  15 o 0 316.5   16.6  ?     ?   349.471   -6.94695     493.368    -6.94695     151.016    -6.94695     
1 1 1 35  5  16 f 1 144.2   16.5  ?     ?   291.525   68.6112      260.246    68.6112      25.423     -111.389     
1 1 1 35  5  17 o 0 190.2   16.5  ?     ?   186.194   -147.722     439.766    -147.722     263.702    -147.722     
1 1 1 35  5  18 o 0 21.6    18.6  ?     ?   65.1876   3.43056      35.3323    3.43056      26.1857    -176.569     
1 1 1 35  5  19 o 0 375.1   22.2  ?     ?   398.624   -36.1687     531.795    -36.1687     122.405    -36.1687     
1 1 1 35  5  20 o 0 187.6   26.5  ?     ?   358.188   -51.0278     278.211    -51.0278     89.9602    128.972      
1 1 1 35  5  21 o 0 169.9   31    ?     ?   107.568   11.3395      464.597    11.3395      358.505    11.3395      
1 1 1 35  5  22 o 0 125.6   30.2  ?     ?   195.631   -7.568       304.519    -7.568       119.446    -7.568       
1 1 1 35  5  23 o 0 39.8    24.8  ?     ?   55.6109   -137.682     143.159    -137.682     90.8442    -137.682     
1 1 1 -35 7  23 < 0 67.3    10.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 7  22 o 0 11.7    7.6   ?     ?   82.2758   122.487      29.157     122.487      41.108     -57.5134     
1 1 1 -35 7  21 o 0 26.6    7.8   ?     ?   137.542   168.764      69.0935    168.764      50.9833    -11.236      
1 1 1 -35 7  20 o 0 50.2    7.9   ?     ?   135.928   127.795      155.443    127.795      32.9468    127.795      
1 1 1 -35 7  19 o 0 51.3    5.7   ?     ?   51.3431   109.039      159.294    109.039      110.92     109.039      
1 1 1 -35 7  18 o 0 39.4    5.4   ?     ?   151.968   -58.5616     102.585    -58.5616     40.9288    121.438      
1 1 1 -35 7  17 o 0 44.7    4.7   ?     ?   95.5642   -87.5596     135.47     -87.5596     51.5533    -87.5596     
1 1 1 -35 7  16 o 0 14.3    5.1   ?     ?   54.9011   102.757      3.40378    102.757      44.8131    -77.243      
1 1 1 -35 7  15 o 0 442.4   10    ?     ?   437.346   170.295      539.044    170.295      153.15     170.295      
1 1 1 -35 7  14 o 0 291.9   7.2   ?     ?   324.402   133.909      450.357    133.909      154.466    133.909      
1 1 1 -35 7  13 o 0 626.7   12.7  ?     ?   560.152   118.559      597.338    118.559      73.8249    118.559      
1 1 1 -35 7  12 o 0 378     8.3   ?     ?   326.962   111.747      552.744    111.747      245.011    111.747      
1 1 1 -35 7  11 o 0 408.1   8.5   ?     ?   397.682   18.9123      516.389    18.9123      132.931    18.9123      
1 1 1 -35 7  10 o 0 48.6    2.3   ?     ?   88.7547   -115.847     76.1339    -115.847     9.97129    64.1526      
1 1 1 -35 7  9  o 0 100.7   3     ?     ?   452.834   -129.045     8.45478    50.9546      399.748    50.9546      
1 1 1 -35 7  8  o 0 162.9   5.1   ?     ?   235.757   -35.3278     260.908    -35.3278     56.1278    -35.3278     
1 1 1 -35 7  7  o 0 261.9   9.6   ?     ?   448.233   -110.258     247.138    -110.258     140.662    69.7419      
1 1 1 -35 7  6  f 1 1233    33.4  ?     ?   875.936   -148.083     688.731    -148.083     76.2994    31.9168      
1 1 1 -35 7  5  o 0 411.8   12.7  ?     ?   596.771   110.607      304.172    110.607      216.393    -69.393      
1 1 1 -35 7  4  o 0 1249.7  35.4  ?     ?   738.682   -23.4594     823.993    -23.4594     177.403    -23.4594     
1 1 1 -35 7  3  f 1 570.6   18.7  ?     ?   324.239   36.1116      669.33     36.1116      383.183    36.1116      
1 1 1 -35 7  2  o 0 666.6   21.6  ?     ?   563.024   -27.1962     554.732    -27.1962     48.5385    -27.1962     
1 1 1 -35 7  1  o 0 970.4   21.7  ?     ?   627.644   -109.066     729.723    -109.066     164.158    -109.066     
1 1 1 35  7  0  f 1 16.1    3.5   ?     ?   141.453   97.4291      81.456     -82.5709     210.464    -82.5709     
1 1 1 35  7  1  o 0 72.4    6.1   ?     ?   430.593   60.3738      79.8721    -119.626     471.134    -119.626     
1 1 1 35  7  2  o 0 2459.6  43.3  ?     ?   934.286   -132.214     1263.22    -132.214     413.339    -132.214     
1 1 1 35  7  3  f 1 43.9    4.3   ?     ?   203.955   45.0143      8.85865    -134.986     191.596    -134.986     
1 1 1 35  7  4  o 0 14.5    4.4   ?     ?   79.7447   123.54       43.1032    -56.4599     114.214    -56.4599     
1 1 1 35  7  5  o 0 157.8   5.6   ?     ?   202.822   112.901      254.449    112.901      73.5861    112.901      
1 1 1 35  7  6  f 1 681.7   18    ?     ?   195.842   19.9241      849.087    19.9241      673.624    19.9241      
1 1 1 35  7  7  o 0 24.5    7.3   ?     ?   14.6478   -77.4676     2.07208    102.532      15.2317    102.532      
1 1 1 35  7  8  o 0 155.7   8.2   ?     ?   162.343   102.476      286.146    102.476      140.487    102.476      
1 1 1 35  7  9  o 0 495.9   13.1  ?     ?   400.193   109.203      559.862    109.203      201.432    109.203      
1 1 1 35  7  10 o 0 96.1    7.9   ?     ?   194.421   135.116      203.124    135.116      6.95175    135.116      
1 1 1 35  7  11 o 0 339.4   11.7  ?     ?   379.553   70.9484      469.383    70.9484      87.4513    70.9484      
1 1 1 35  7  12 o 0 20.1    10.6  ?     ?   83.6641   -84.8932     0.525466   -84.8932     81.9282    95.1068      
1 1 1 35  7  13 o 0 99.9    12.4  ?     ?   249.854   -75.6271     199.286    -75.6271     41.949     104.373      
1 1 1 35  7  14 o 0 168.3   13.8  ?     ?   139.75    -56.3338     417.406    -56.3338     283.037    -56.3338     
1 1 1 35  7  15 o 0 380.2   18    ?     ?   374.769   -47.0787     550.648    -47.0787     200.907    -47.0787     
1 1 1 35  7  16 o 0 114     16.1  ?     ?   251.289   -53.1001     234.069    -53.1001     0.122918   126.9        
1 1 1 35  7  17 o 0 34      18.9  ?     ?   139.301   107.099      72.4128    107.099      57.8208    -72.9007     
1 1 1 35  7  18 o 0 97.8    22.9  ?     ?   161.991   160.951      266.43     160.951      103.015    160.951      
1 1 1 35  7  19 o 0 40      27.4  ?     ?   182.508   144.228      63.7374    144.228      120.561    -35.7716     
1 1 1 35  7  20 o 0 20.5    27.3  ?     ?   62.1038   9.5135       74.6622    9.5135       15.7316    9.5135       
1 1 1 35  7  21 o 0 58.4    30.2  ?     ?   106.418   175.041      172.767    175.041      73.8287    175.041      
1 1 1 -35 9  21 < 0 2.4     7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 9  20 o 0 18      6.4   ?     ?   54.8217   -72.7542     64.1497    -72.7542     17.9899    -72.7542     
1 1 1 -35 9  19 o 0 66.3    6.1   ?     ?   161.81    -137.171     187.188    -137.171     47.996     -137.171     
1 1 1 -35 9  18 o 0 58.3    5.7   ?     ?   157.307   -81.2618     164.709    -81.2618     25.1092    -81.2618     
1 1 1 -35 9  17 o 0 16      4.6   ?     ?   69.1037   84.1433      30.6092    84.1433      33.4665    -95.8567     
1 1 1 -35 9  16 o 0 54.4    4.5   ?     ?   140.615   109.375      158.493    109.375      27.889     109.375      
1 1 1 -35 9  15 o 0 28.8    3.9   ?     ?   113.336   23.5648      71.7533    23.5648      26.0679    -156.435     
1 1 1 -35 9  14 o 0 6.8     3.2   ?     ?   100.712   55.2146      43.9855    -124.785     130.87     -124.785     
1 1 1 -35 9  13 o 0 52.9    3.3   ?     ?   146.384   112.918      141.428    112.918      14.155     112.918      
1 1 1 -35 9  12 o 0 409.8   8.9   ?     ?   479.474   80.2812      462.889    80.2812      44.5256    80.2812      
1 1 1 -35 9  11 o 0 166.2   5.1   ?     ?   262.273   5.07106      307.852    5.07106      71.549     5.07106      
1 1 1 -35 9  10 o 0 164.1   5.6   ?     ?   195.329   -73.3924     355.823    -73.3924     178.707    -73.3924     
1 1 1 -35 9  9  f 1 236.6   5.5   ?     ?   388.966   -61.2839     307.047    -61.2839     55.6321    118.716      
1 1 1 -35 9  8  o 0 62.2    2.8   ?     ?   71.3028   -72.8989     132.517    -72.8989     66.01      -72.8989     
1 1 1 -35 9  7  o 0 356.5   11.9  ?     ?   432.433   -31.454      419.575    -31.454      6.99749    -31.454      
1 1 1 -35 9  6  o 0 500.3   15.5  ?     ?   434.002   -128.795     579.696    -128.795     163.729    -128.795     
1 1 1 -35 9  5  o 0 143.4   7.6   ?     ?   231.471   -111.241     271.79     -111.241     49.0242    -111.241     
1 1 1 -35 9  4  o 0 92.9    6.7   ?     ?   220.796   79.4324      170.833    79.4324      42.4398    -100.568     
1 1 1 -35 9  3  f 1 217.3   10.8  ?     ?   324.03    -179.858     281.166    -179.858     1.6357     -179.858     
1 1 1 -35 9  2  o 0 143.1   4.8   ?     ?   265.227   -11.2712     207.668    -11.2712     20.6033    168.729      
1 1 1 -35 9  1  o 0 103.5   3.9   ?     ?   123.687   -82.4301     173.566    -82.4301     66.8593    -82.4301     
1 1 1 35  9  0  o 0 76.2    3.8   ?     ?   251.728   -29.8616     80.7447    -29.8616     138.969    150.138      
1 1 1 35  9  1  o 0 412.6   9.3   ?     ?   473.752   -51.2885     406.048    -51.2885     7.93332    128.711      
1 1 1 35  9  2  o 0 179.9   5.6   ?     ?   431.278   -73.6754     150.599    -73.6754     226.57     106.325      
1 1 1 35  9  3  f 1 32.4    4.2   ?     ?   134.924   42.9091      2.7395     -137.091     121.394    -137.091     
1 1 1 35  9  4  o 0 290.7   8.3   ?     ?   250.351   136.596      505.862    136.596      258.54     136.596      
1 1 1 35  9  5  o 0 27.3    5.5   ?     ?   79.0629   129.591      10.8738    129.591      67.2038    -50.4086     
1 1 1 35  9  6  o 0 4.2     6.2   ?     ?   150.935   73.3458      111.734    -106.654     260.671    -106.654     
1 1 1 35  9  7  o 0 97.5    7.5   ?     ?   187.918   141.453      226.269    141.453      44.2999    141.453      
1 1 1 35  9  8  o 0 19.2    8.3   ?     ?   127.791   169.287      14.9232    -10.7134     138.462    -10.7134     
1 1 1 35  9  9  f 1 24.1    9.4   ?     ?   127.052   177.706      7.67203    177.706      115.522    -2.29442     
1 1 1 35  9  10 o 0 61.3    10.1  ?     ?   262.704   40.9104      83.2111    40.9104      165.334    -139.09      
1 1 1 35  9  11 o 0 91.4    12.2  ?     ?   254.428   83.0756      179.606    83.0756      54.3998    -96.9244     
1 1 1 35  9  12 o 0 56.8    13    ?     ?   220.329   91.7646      108.989    91.7646      92.9412    -88.2354     
1 1 1 35  9  13 o 0 57.4    12.8  ?     ?   190.731   -143.938     131.621    -143.938     43.1418    36.0618      
1 1 1 35  9  14 o 0 74.7    16.5  ?     ?   147.598   -93.3645     210.123    -93.3645     74.3047    -93.3645     
1 1 1 35  9  15 o 0 71.9    17.9  ?     ?   192.383   105.692      175.791    105.692      15.4349    -74.3079     
1 1 1 35  9  16 o 0 0.5     19.8  ?     ?   112.175   -81.2964     0.966503   98.7036      112.7      98.7036      
1 1 1 35  9  17 o 0 -25.1   19.3  ?     ?   56.7416   -74.7598     14.7195    105.24       69.0168    105.24       
1 1 1 35  9  18 o 0 24.4    26.5  ?     ?   148.001   -121.23      57.247     -121.23      80.5562    58.7696      
1 1 1 35  9  19 o 0 98.8    33    ?     ?   186.973   -41.9344     218.394    -41.9344     47.7246    -41.9344     
1 1 1 35  9  20 o 0 43.7    30.5  ?     ?   114.037   5.35038      131.147    5.35038      27.5638    5.35038      
1 1 1 -35 11 19 < 0 48.9    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 11 18 < 0 7.6     5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 11 17 o 0 47.4    5.7   ?     ?   199.955   38.7108      107.364    38.7108      58.3833    -141.289     
1 1 1 -35 11 16 o 0 140.5   7.9   ?     ?   289.552   108.662      248.282    108.662      2.79319    108.662      
1 1 1 -35 11 15 o 0 10.6    4.5   ?     ?   109.2     25.8117      10.2173    -154.188     105.622    -154.188     
1 1 1 -35 11 14 o 0 54      4.3   ?     ?   198.655   -31.5192     115.38     -31.5192     65.758     148.481      
1 1 1 -35 11 13 o 0 91.3    4.6   ?     ?   189.05    -112.796     221.782    -112.796     48.0124    -112.796     
1 1 1 -35 11 12 o 0 36.7    3.6   ?     ?   143.265   -58.6636     95.7879    -58.6636     35.9093    121.336      
1 1 1 -35 11 11 o 0 8.5     2.9   ?     ?   105.649   55.8955      31.0616    -124.104     121.165    -124.104     
1 1 1 -35 11 10 o 0 163.4   5.2   ?     ?   318.535   98.7687      257.614    98.7687      15.8571    -81.2313     
1 1 1 -35 11 9  o 0 426.1   9.4   ?     ?   419.009   113.636      518.383    113.636      159.573    113.636      
1 1 1 -35 11 8  o 0 115.5   4.1   ?     ?   242.864   73.179       230.148    73.179       21.7734    73.179       
1 1 1 -35 11 7  f 1 106.1   3.8   ?     ?   201.371   26.1556      240.497    26.1556      65.9232    26.1556      
1 1 1 -35 11 6  o 0 480.4   10.6  ?     ?   401.776   39.5998      597.752    39.5998      249.566    39.5998      
1 1 1 -35 11 5  o 0 59.5    3.3   ?     ?   51.348    -95.5129     121.912    -95.5129     76.0797    -95.5129     
1 1 1 -35 11 4  o 0 129.4   4.6   ?     ?   325.952   -139.966     187.861    -139.966     104.205    40.0337      
1 1 1 -35 11 3  o 0 77.1    5.5   ?     ?   129.896   -73.7147     206.351    -73.7147     89.5611    -73.7147     
1 1 1 -35 11 2  o 0 239.6   7.9   ?     ?   191.83    163.627      475.434    163.627      302.447    163.627      
1 1 1 -35 11 1  o 0 275.6   8.8   ?     ?   401.084   -14.276      359.899    -14.276      2.70703    165.724      
1 1 1 35  11 0  o 0 234.5   6.8   ?     ?   381.377   66.0433      324.769    66.0433      25.946     -113.957     
1 1 1 35  11 1  o 0 142.7   6.2   ?     ?   188.611   97.158       326.088    97.158       152.488    97.158       
1 1 1 35  11 2  o 0 20.3    4.3   ?     ?   84.2878   -60.751      19.8541    -60.751      57.7643    119.249      
1 1 1 35  11 3  o 0 16.2    5     ?     ?   149.491   2.11811      19.9208    -177.882     157.598    -177.882     
1 1 1 35  11 4  o 0 15.5    6.6   ?     ?   140.236   77.0462      23.7562    -102.954     152.871    -102.954     
1 1 1 35  11 5  o 0 94.4    6.7   ?     ?   132.618   11.6331      263.752    11.6331      144.777    11.6331      
1 1 1 35  11 6  o 0 1.7     6     ?     ?   301.73    -105.03      201.896    74.9702      472.276    74.9702      
1 1 1 35  11 7  f 1 187.5   10    ?     ?   214.751   -99.014      393.274    -99.014      200.152    -99.014      
1 1 1 35  11 8  o 0 5.9     9.5   ?     ?   127.274   -82.3831     46.0422    97.6169      160.11     97.6169      
1 1 1 35  11 9  o 0 83.5    11.5  ?     ?   252.632   106.44       155.912    106.44       69.9479    -73.5601     
1 1 1 35  11 10 o 0 38      12.6  ?     ?   206.21    54.1687      50.3389    54.1687      135.089    -125.831     
1 1 1 35  11 11 o 0 29.2    11    ?     ?   205.325   -75.3407     16.854     -75.3407     176.059    104.659      
1 1 1 35  11 12 o 0 168.1   17.5  ?     ?   285.041   -172.749     305.445    -172.749     29.2137    -172.749     
1 1 1 35  11 13 o 0 10.5    17.2  ?     ?   156.052   -161.035     12.1026    18.9646      163.811    18.9646      
1 1 1 35  11 14 o 0 -17.1   18.1  ?     ?   125.755   87.2203      40.3633    -92.7797     157.941    -92.7797     
1 1 1 35  11 15 o 0 81.6    19.4  ?     ?   105.374   -61.577      261.369    -61.577      165.404    -61.577      
1 1 1 35  11 16 o 0 14.6    22.3  ?     ?   115.697   56.1063      48.2319    56.1063      55.1717    -123.894     
1 1 1 35  11 17 o 0 -8.6    20    ?     ?   95.3186   -75.8542     14.8539    -75.8542     70.0073    104.146      
1 1 1 -35 13 15 < 0 95.8    10.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 13 14 o 0 18.1    7.4   ?     ?   134.923   139.256      36.0235    139.256      73.3513    -40.7444     
1 1 1 -35 13 13 o 0 109.7   6.5   ?     ?   260.641   172.093      211.589    172.093      0.969778   -7.90734     
1 1 1 -35 13 12 o 0 16.6    4.7   ?     ?   156.725   -152.798     15.9464    -152.798     112.865    27.2019      
1 1 1 -35 13 11 o 0 8.5     4.8   ?     ?   35.2547   -12.1028     0.0420409  167.897      29.6157    167.897      
1 1 1 -35 13 10 o 0 55.2    4.6   ?     ?   115.037   -10.4569     175.577    -10.4569     76.3459    -10.4569     
1 1 1 -35 13 9  o 0 279.2   8.8   ?     ?   335.797   -8.7272      414.463    -8.7272      122.953    -8.7272      
1 1 1 -35 13 8  o 0 21.4    4.1   ?     ?   112.659   1.55006      49.1931    1.55006      52.6142    -178.45      
1 1 1 -35 13 7  f 1 25.2    4.2   ?     ?   89.5738   -175.025     73.7536    -175.025     8.05172    4.97521      
1 1 1 -35 13 6  o 0 104.2   5.3   ?     ?   211.814   115.45       229.45     115.45       37.4775    115.45       
1 1 1 -35 13 5  o 0 142.6   5.9   ?     ?   243.102   -71.9007     281.923    -71.9007     60.5972    -71.9007     
1 1 1 -35 13 4  f 1 88.3    5.1   ?     ?   179.572   49.628       219.389    49.628       54.3957    49.628       
1 1 1 -35 13 3  o 0 94.7    5.8   ?     ?   104.961   133.656      275.133    133.656      182.135    133.656      
1 1 1 -35 13 2  o 0 124.7   7.1   ?     ?   128.008   160.407      317.092    160.407      208.569    160.407      
1 1 1 -35 13 1  o 0 13.9    5.3   ?     ?   58.9919   -38.0388     6.11944    -38.0388     44.0281    141.961      
1 1 1 35  13 0  o 0 39.9    5.5   ?     ?   99.8973   102.156      116.841    102.156      29.9681    102.156      
1 1 1 35  13 1  o 0 189.2   7.8   ?     ?   263.231   119.05       346.916    119.05       117.865    119.05       
1 1 1 35  13 2  o 0 386.9   11.7  ?     ?   402.471   108.351      515.188    108.351      147.951    108.351      
1 1 1 35  13 3  o 0 43.9    6.7   ?     ?   146.645   138.504      121.701    138.504      16.8173    -41.496      
1 1 1 35  13 4  f 1 196     9.5   ?     ?   186.257   -122.157     431.339    -122.157     254.609    -122.157     
1 1 1 35  13 5  o 0 211.9   10.7  ?     ?   210.625   -134.993     437.164    -134.993     238.543    -134.993     
1 1 1 35  13 6  o 0 103.1   10.8  ?     ?   136.565   4.84393      288.747    4.84393      160.156    4.84393      
1 1 1 35  13 7  f 1 65      9.9   ?     ?   172.731   29.8544      169.693    29.8544      5.2986     29.8544      
1 1 1 35  13 8  o 0 9.1     12.9  ?     ?   168.728   -72.0884     39.0032    107.912      198.39     107.912      
1 1 1 35  13 9  o 0 67.6    15.2  ?     ?   244.979   -109.168     121.443    -109.168     101.555    70.8316      
1 1 1 35  13 10 o 0 120.8   15.6  ?     ?   197.421   -151.243     288.876    -151.243     113.486    -151.243     
1 1 1 35  13 11 o 0 33.2    17.9  ?     ?   126.892   -99.5998     86.1066    -99.5998     26.2075    80.4002      
1 1 1 35  13 12 o 0 61.7    19.9  ?     ?   119.86    -166.706     187.332    -166.706     83.0594    -166.706     
1 1 1 35  13 13 o 0 0       22.5  ?     ?   16.5745   -164.744     18.0327    -164.744     3.64782    -164.744     
1 1 1 35  13 14 < 0 40.6    22.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 15 9  < 0 31.2    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 15 8  < 0 46      6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -35 15 7  o 0 22.7    5.5   ?     ?   68.1139   132.477      89.7921    132.477      35.1544    132.477      
1 1 1 -35 15 6  o 0 68.7    6.7   ?     ?   167.228   166.504      188.635    166.504      53.7983    166.504      
1 1 1 -35 15 5  o 0 58.1    6.1   ?     ?   125.582   -120.254     183.846    -120.254     82.34      -120.254     
1 1 1 -35 15 4  o 0 14.4    6.3   ?     ?   64.4144   -69.9685     32.6616    -69.9685     19.6242    110.032      
1 1 1 -35 15 3  o 0 230.1   12.7  ?     ?   303.91    -9.18329     372.569    -9.18329     124.949    -9.18329     
1 1 1 -35 15 2  o 0 60.2    10.1  ?     ?   100.298   80.1323      200.735    80.1323      118.743    80.1323      
1 1 1 -35 15 1  o 0 91.2    9.5   ?     ?   150.606   88.4151      251.095    88.4151      127.622    88.4151      
1 1 1 35  15 0  o 0 24.4    8.4   ?     ?   158.718   53.4056      46.2668    53.4056      87.6197    -126.594     
1 1 1 35  15 1  o 0 43.3    9.6   ?     ?   152.108   -80.0839     126.193    -80.0839     2.16076    99.9161      
1 1 1 35  15 2  o 0 95.3    10.4  ?     ?   215.222   -110.493     220.37     -110.493     38.7725    -110.493     
1 1 1 35  15 3  o 0 35.8    9.4   ?     ?   154.103   -101.739     98.3594    -101.739     31.6035    78.2612      
1 1 1 35  15 4  o 0 163.6   11.5  ?     ?   255.51    131.643      320.865    131.643      105.579    131.643      
1 1 1 35  15 5  o 0 144.1   12    ?     ?   344.089   177.472      216.308    177.472      73.8718    -2.52813     
1 1 1 35  15 6  o 0 26.3    13.3  ?     ?   139.852   162.415      63.8635    162.415      53.8672    -17.5845     
1 1 1 35  15 7  o 0 87.6    14    ?     ?   162.586   9.31706      239.627    9.31706      103.062    9.31706      
1 1 1 35  15 8  < 0 20.1    16.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 35  15 9  < 0 17.7    16.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 0  25 < 0 3.9     11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 0  24 o 0 -5.5    9     ?     ?   59.6632   180          7.78364    180          44.9567    1.21485e-15  
1 1 1 -36 0  23 o 0 64.7    9.9   ?     ?   237.117   180          182.12     180          32.5743    3.92297e-14  
1 1 1 -36 0  22 o 0 18.1    9.3   ?     ?   9.5351    180          6.63614    180          2.58403    1.80199e-14  
1 1 1 -36 0  21 f 1 9.2     7.1   ?     ?   33.0604   180          9.63497    180          22.5787    2.99423e-15  
1 1 1 -36 0  20 o 0 172.6   8.4   ?     ?   264.866   0            296.36     0            57.5617    0            
1 1 1 -36 0  19 o 0 17.5    6.3   ?     ?   121.046   0            56.8576    0            52.3149    180          
1 1 1 -36 0  18 o 0 148.7   7.3   ?     ?   187.812   0            279.289    0            104.728    0            
1 1 1 -36 0  17 o 0 76.8    5.4   ?     ?   156.583   0            194.925    0            48.1965    0            
1 1 1 -36 0  16 o 0 196.2   7.7   ?     ?   258.865   0            326.935    0            78.3357    0            
1 1 1 -36 0  15 o 0 1376.5  41.8  ?     ?   914.432   0            871.853    0            28.4061    180          
1 1 1 -36 0  14 o 0 121     5.6   ?     ?   94.2798   180          146.862    180          64.0985    180          
1 1 1 -36 0  13 o 0 80.4    4.7   ?     ?   164       180          149.193    180          4.31675    180          
1 1 1 -36 0  12 o 0 92.4    4.7   ?     ?   54.4911   0            59.4229    0            11.4243    0            
1 1 1 -36 0  11 o 0 32      3.5   ?     ?   117.963   0            38.9065    0            67.7853    180          
1 1 1 -36 0  10 o 0 572.6   22.3  ?     ?   692.366   180          514.837    180          114.485    3.1554e-14   
1 1 1 -36 0  9  o 0 5.2     3     ?     ?   198.564   180          7.91164    180          173.392    3.20164e-16  
1 1 1 -36 0  8  o 0 1360.5  33.8  ?     ?   826.051   180          779.823    180          33.4214    180          
1 1 1 -36 0  7  f 1 194.5   7.6   ?     ?   299.67    180          287.235    180          14.0392    180          
1 1 1 -36 0  6  o 0 2505.4  61    ?     ?   1177.63   0            1065.76    0            6.00996    180          
1 1 1 -36 0  5  o 0 3834.4  91    ?     ?   1639.29   0            1322.36    0            174.238    180          
1 1 1 -36 0  4  o 0 1892.3  46.2  ?     ?   868.312   0            931.887    0            126.397    0            
1 1 1 -36 0  3  o 0 1841.7  44.7  ?     ?   693.463   0            921.774    0            276.799    0            
1 1 1 -36 0  2  o 0 2476    61.5  ?     ?   1170.29   180          1071.22    180          19.8528    3.78608e-13  
1 1 1 -36 0  1  f 1 351.3   15.8  ?     ?   205.265   180          390.699    180          197.923    180          
1 1 1 36  0  0  o 0 710.1   22.1  ?     ?   595.08    180          576.131    180          19.0078    180          
1 1 1 36  0  1  f 1 10.7    3     ?     ?   612.557   180          52.5996    180          524.864    7.03184e-16  
1 1 1 36  0  2  o 0 348.7   12.7  ?     ?   488.457   180          404.989    180          53.8407    5.27796e-14  
1 1 1 36  0  3  o 0 199.3   7.2   ?     ?   308.007   180          300.404    180          10.7042    180          
1 1 1 36  0  4  o 0 567.6   24.1  ?     ?   450.312   0            517.761    0            93.7924    0            
1 1 1 36  0  5  o 0 780.9   32    ?     ?   800.455   0            607.697    0            136.61     180          
1 1 1 36  0  6  o 0 146.7   12    ?     ?   385.109   0            258.055    0            100.145    180          
1 1 1 36  0  7  f 1 309     14.7  ?     ?   546.27    180          382.26     180          128.396    2.08902e-14  
1 1 1 36  0  8  o 0 58.7    8.8   ?     ?   201.489   180          109.347    180          82.9942    9.24471e-15  
1 1 1 36  0  9  o 0 318.9   16    ?     ?   327.666   180          395.948    180          87.2085    180          
1 1 1 36  0  10 o 0 399.7   16.9  ?     ?   517.986   180          445.199    180          42.1514    7.41099e-14  
1 1 1 36  0  11 o 0 52.5    13    ?     ?   242.521   180          117.692    180          105.299    7.84252e-15  
1 1 1 36  0  12 o 0 61.3    12.9  ?     ?   70.0989   0            50.7167    0            13.5809    180          
1 1 1 36  0  13 o 0 7.1     14.3  ?     ?   79.1232   0            8.32004    0            64.6782    180          
1 1 1 36  0  14 o 0 2.1     14.2  ?     ?   132.021   180          10.6133    180          110.777    6.72258e-16  
1 1 1 36  0  15 o 0 160.6   20.8  ?     ?   126.834   180          280.798    180          149.627    180          
1 1 1 36  0  16 o 0 9.3     18.6  ?     ?   15.5156   180          3.85695    180          11.8411    2.28552e-15  
1 1 1 36  0  17 o 0 24.4    23.4  ?     ?   137.167   180          63.2925    180          72.5214    6.12378e-15  
1 1 1 36  0  18 o 0 60.9    27.4  ?     ?   43.2056   180          69.1807    180          27.6829    180          
1 1 1 36  0  19 o 0 95.5    25.3  ?     ?   249.695   180          224.625    180          14.7535    1.06831e-13  
1 1 1 36  0  20 o 0 -24.7   32.9  ?     ?   57.3058   0            16.1106    0            38.9746    180          
1 1 1 36  0  21 f 1 38.7    38    ?     ?   143.713   180          105.719    180          44.043     1.68426e-14  
1 1 1 -36 2  25 < 0 20.5    10    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 2  24 o 0 32.8    6.5   ?     ?   134.727   29.5479      112.844    29.5479      5.47446    -150.452     
1 1 1 -36 2  23 o 0 106.8   8.1   ?     ?   163.412   106.396      294.041    106.396      147.327    106.396      
1 1 1 -36 2  22 o 0 6.1     5.5   ?     ?   85.9549   -129.196     26.6372    50.8039      106.305    50.8039      
1 1 1 -36 2  21 o 0 152.3   6.2   ?     ?   174.099   36.0578      373.086    36.0578      205.623    36.0578      
1 1 1 -36 2  20 o 0 204.9   6.8   ?     ?   302.319   55.5405      350.415    55.5405      79.8762    55.5405      
1 1 1 -36 2  19 o 0 130.8   6.4   ?     ?   152.749   50.1362      332.816    50.1362      196.029    50.1362      
1 1 1 -36 2  18 o 0 197     6.4   ?     ?   329.44    -101.008     322.017    -101.008     25.4678    -101.008     
1 1 1 -36 2  17 o 0 55.6    4.2   ?     ?   66.8078   23.8461      136.164    23.8461      73.9642    23.8461      
1 1 1 -36 2  16 o 0 92.6    3.9   ?     ?   320.244   70.1178      109.709    70.1178      195.954    -109.882     
1 1 1 -36 2  15 o 0 92.6    3.6   ?     ?   109.273   -50.4353     205.706    -50.4353     98.7487    -50.4353     
1 1 1 -36 2  14 o 0 744.4   14.3  ?     ?   631.857   -102.872     567.327    -102.872     15.6756    -102.872     
1 1 1 -36 2  13 o 0 139.6   4.3   ?     ?   300.659   -150.206     182.274    -150.206     81.9664    29.7943      
1 1 1 -36 2  12 o 0 32.8    2.8   ?     ?   109.58    -84.075      14.1471    95.925       110.208    95.925       
1 1 1 -36 2  11 o 0 238.5   5.6   ?     ?   259.832   116.43       352.539    116.43       123.459    116.43       
1 1 1 -36 2  10 o 0 112.5   3.4   ?     ?   101.1     -18.5032     124.103    -18.5032     32.5919    -18.5032     
1 1 1 -36 2  9  f 1 389.8   7.8   ?     ?   311.067   -106.409     494.643    -106.409     210.261    -106.409     
1 1 1 -36 2  8  o 0 86.6    2.8   ?     ?   244.125   90.0045      71.6809    90.0045      154.042    -89.9955     
1 1 1 -36 2  7  o 0 286.5   6     ?     ?   457.8     4.9967       254.633    4.9967       159.197    -175.003     
1 1 1 -36 2  6  o 0 1715.6  29.7  ?     ?   929.983   -16.3663     892.225    -16.3663     48.4921    -16.3663     
1 1 1 -36 2  5  o 0 2209.6  48.4  ?     ?   1018.59   -97.3648     1053.98    -97.3648     126.804    -97.3648     
1 1 1 -36 2  4  o 0 245.4   6.6   ?     ?   237.628   18.6676      353.687    18.6676      136.737    18.6676      
1 1 1 -36 2  3  o 0 1265.3  32.6  ?     ?   905.197   115.359      661.695    115.359      177.9      -64.6405     
1 1 1 -36 2  2  o 0 2407.5  53.2  ?     ?   991.141   98.7482      1164.59    98.7482      243.045    98.7482      
1 1 1 -36 2  1  o 0 12.5    2.5   ?     ?   214.162   -166.104     143.222    13.8964      342.779    13.8964      
1 1 1 36  2  0  o 0 157.3   4.2   ?     ?   225.728   -19.3899     226.806    -19.3899     16.0951    -19.3899     
1 1 1 36  2  1  o 0 3131.6  58.7  ?     ?   1084.45   -124.716     1383.76    -124.716     369.615    -124.716     
1 1 1 36  2  2  o 0 1082.7  20.5  ?     ?   749.382   -109.938     694.338    -109.938     7.57657    70.0622      
1 1 1 36  2  3  o 0 725.5   14.3  ?     ?   589.314   -22.8459     584.387    -22.8459     38.8701    -22.8459     
1 1 1 36  2  4  o 0 467.6   10.3  ?     ?   493.831   -23.272      435.476    -23.272      22.1186    156.728      
1 1 1 36  2  5  o 0 6.2     4.5   ?     ?   49.1133   -89.5785     38.8213    90.4215      84.3614    90.4215      
1 1 1 36  2  6  o 0 116.6   6.6   ?     ?   291.293   158.949      114.504    158.949      155.674    -21.0508     
1 1 1 36  2  7  o 0 933.4   19.5  ?     ?   690.442   96.2905      654.115    96.2905      13.8064    96.2905      
1 1 1 36  2  8  o 0 766.4   17.6  ?     ?   516.398   128.046      704.06     128.046      218.401    128.046      
1 1 1 36  2  9  f 1 136.2   8.3   ?     ?   226.196   -134.382     192.705    -134.382     20.8963    45.6183      
1 1 1 36  2  10 o 0 171.8   8.4   ?     ?   418.117   169.795      134.351    169.795      257.865    -10.2049     
1 1 1 36  2  11 o 0 84.4    8.7   ?     ?   119.08    -23.427      105.645    -23.427      3.50987    156.573      
1 1 1 36  2  12 o 0 46.5    9.7   ?     ?   273.282   35.0659      34.3171    -144.934     284.192    -144.934     
1 1 1 36  2  13 o 0 34      11.8  ?     ?   103.104   56.8293      3.21471    56.8293      91.5973    -123.171     
1 1 1 36  2  14 o 0 189.6   15.1  ?     ?   291.634   171.815      330.933    171.815      29.1899    171.815      
1 1 1 36  2  15 o 0 282.9   17.9  ?     ?   362.946   37.8222      415.466    37.8222      41.432     37.8222      
1 1 1 36  2  16 o 0 483.6   22.2  ?     ?   541.285   2.78651      510.954    2.78651      34.6908    -177.213     
1 1 1 36  2  17 o 0 -13.5   16    ?     ?   89.3675   164.806      46.6895    -15.1941     134.837    -15.1941     
1 1 1 36  2  18 o 0 10.4    20.5  ?     ?   3.00488   -109.828     0.940115   -109.828     1.9345     70.1724      
1 1 1 36  2  19 o 0 51      19    ?     ?   86.6931   123.082      141.451    123.082      58.6858    123.082      
1 1 1 36  2  20 o 0 54.8    23.4  ?     ?   163.295   159.762      135.506    159.762      34.1469    -20.238      
1 1 1 36  2  21 o 0 2.4     28.8  ?     ?   39.4334   139.476      32.5664    139.476      8.43621    -40.5242     
1 1 1 36  2  22 o 0 49.4    31.7  ?     ?   205.256   56.6089      82.1527    56.6089      122.637    -123.391     
1 1 1 36  2  23 o 0 6.3     29.3  ?     ?   70.603    -13.9855     63.9096    -13.9855     3.66055    166.015      
1 1 1 36  2  24 o 0 66      28.2  ?     ?   176.232   -35.6398     155.947    -35.6398     11.779     144.36       
1 1 1 -36 4  24 < 0 56.9    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 4  23 o 0 12.1    6.5   ?     ?   70.7958   -64.9213     22.2373    -64.9213     39.4779    115.079      
1 1 1 -36 4  22 o 0 46.8    6.9   ?     ?   166.08    0.876124     130.885    0.876124     17.4423    -179.124     
1 1 1 -36 4  21 o 0 40.5    6     ?     ?   101.367   31.6912      138.025    31.6912      41.3184    31.6912      
1 1 1 -36 4  20 o 0 15      5.4   ?     ?   113.013   -30.8116     5.98541    -30.8116     102.127    149.188      
1 1 1 -36 4  19 o 0 16.6    5.1   ?     ?   80.564    -60.8215     20.7396    -60.8215     50.9556    119.178      
1 1 1 -36 4  18 o 0 48.7    4.9   ?     ?   76.2184   131.966      136.256    131.966      68.3878    131.966      
1 1 1 -36 4  17 o 0 18.5    4     ?     ?   69.9506   60.2729      20.8957    60.2729      41.7091    -119.727     
1 1 1 -36 4  16 o 0 55.3    3.8   ?     ?   235.487   8.5678       86.3244    8.5678       131.636    -171.432     
1 1 1 -36 4  15 o 0 279.8   7.4   ?     ?   400.266   24.6278      367.807    24.6278      11.964     -155.372     
1 1 1 -36 4  14 o 0 90.8    3.8   ?     ?   232.498   98.0973      159.274    98.0973      66.9218    -81.9027     
1 1 1 -36 4  13 o 0 89.9    3.4   ?     ?   444.221   70.8981      17.8776    -109.102     404.558    -109.102     
1 1 1 -36 4  12 o 0 234.6   6.3   ?     ?   513.739   -6.59135     164.046    -6.59135     284.658    173.409      
1 1 1 -36 4  11 o 0 8.1     2.2   ?     ?   173.541   82.1309      118.654    -97.8691     269.828    -97.8691     
1 1 1 -36 4  10 o 0 490.3   9.8   ?     ?   516.411   -98.9809     449.498    -98.9809     2.89556    81.0191      
1 1 1 -36 4  9  o 0 364     9.7   ?     ?   361.198   -107.36      426.935    -107.36      102.099    -107.36      
1 1 1 -36 4  8  o 0 1658    29.2  ?     ?   753.688   109.991      1033.21    109.991      352.166    109.991      
1 1 1 -36 4  7  o 0 361.1   7.3   ?     ?   402.077   -113.103     397.116    -113.103     32.2102    -113.103     
1 1 1 -36 4  6  o 0 6.4     1.4   ?     ?   170.256   -119.261     131.987    60.7392      287.113    60.7392      
1 1 1 -36 4  5  o 0 524.9   10.3  ?     ?   563.019   -122.127     432.328    -122.127     88.717     57.8727      
1 1 1 -36 4  4  o 0 917.7   18.2  ?     ?   850.827   32.8384      487.686    32.8384      281.471    -147.162     
1 1 1 -36 4  3  o 0 32      1.9   ?     ?   118.28    -61.8882     30.9652    118.112      138.196    118.112      
1 1 1 -36 4  2  o 0 1729    30.5  ?     ?   942.037   -146.61      889.986    -146.61      33.8048    -146.61      
1 1 1 -36 4  1  o 0 347.3   9     ?     ?   274.866   -109.162     461.928    -109.162     211.565    -109.162     
1 1 1 36  4  0  o 0 64.5    3.3   ?     ?   240.655   -38.5085     16.1282    -38.5085     203.697    141.491      
1 1 1 36  4  1  o 0 849.1   16.8  ?     ?   617.256   -49.5175     648.206    -49.5175     83.3949    -49.5175     
1 1 1 36  4  2  o 0 111.7   4.2   ?     ?   315.8     -99.0043     88.0812    -99.0043     201.313    80.9957      
1 1 1 36  4  3  o 0 402.1   9     ?     ?   317.549   17.8907      499.203    17.8907      207.863    17.8907      
1 1 1 36  4  4  o 0 1068.4  20.3  ?     ?   628.4     51.2761      793.316    51.2761      216.287    51.2761      
1 1 1 36  4  5  o 0 130.1   5.9   ?     ?   321.584   11.4719      124.646    11.4719      178.765    -168.528     
1 1 1 36  4  6  o 0 114.5   6.8   ?     ?   436.083   -33.1982     12.0838    -33.1982     394.472    146.802      
1 1 1 36  4  7  o 0 644.8   14.4  ?     ?   574.125   -90.4766     547.161    -90.4766     12.0901    -90.4766     
1 1 1 36  4  8  o 0 123.6   7.3   ?     ?   274.441   -67.6801     144.17     -67.6801     111.401    112.32       
1 1 1 36  4  9  o 0 329.2   14.8  ?     ?   433.64    3.92051      358.294    3.92051      36.6221    -176.079     
1 1 1 36  4  10 o 0 783.2   18.2  ?     ?   720.043   -1.40904     548.955    -1.40904     105.65     178.591      
1 1 1 36  4  11 o 0 156.8   9.8   ?     ?   405.454   -17.2526     139.207    -17.2526     231.798    162.747      
1 1 1 36  4  12 o 0 356.9   12.2  ?     ?   393.715   -57.934      427.7      -57.934      68.4162    -57.934      
1 1 1 36  4  13 o 0 38.2    9.4   ?     ?   143.096   -92.149      44.0336    -92.149      102.933    87.851       
1 1 1 36  4  14 o 0 59.2    11.3  ?     ?   137.577   -99.1473     148.918    -99.1473     10.6005    -99.1473     
1 1 1 36  4  15 o 0 776.4   21.5  ?     ?   449.98    22.1798      882.143    22.1798      431.632    22.1798      
1 1 1 36  4  16 o 0 147.5   14.3  ?     ?   159.802   73.0734      373.568    73.0734      216.982    73.0734      
1 1 1 36  4  17 o 0 171.6   17.4  ?     ?   236.742   -32.8781     369.296    -32.8781     144.25     -32.8781     
1 1 1 36  4  18 o 0 49.6    19.2  ?     ?   136.562   -126.072     128.677    -126.072     0.902382   53.9277      
1 1 1 36  4  19 o 0 87.5    21.1  ?     ?   265.572   -48.4454     155.159    -48.4454     97.5149    131.555      
1 1 1 36  4  20 o 0 28.4    21.7  ?     ?   96.041    93.7606      77.7391    93.7606      20.8154    -86.2394     
1 1 1 36  4  21 o 0 39      25.8  ?     ?   135.079   167.261      98.6396    167.261      35.3879    -12.739      
1 1 1 36  4  22 o 0 4.3     27.1  ?     ?   129.024   -85.989      28.8167    -85.989      95.6253    94.011       
1 1 1 -36 6  23 < 0 7.4     9.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 6  22 o 0 29.4    8.3   ?     ?   101.58    43.4775      105.445    43.4775      18.0418    43.4775      
1 1 1 -36 6  21 o 0 22.3    7.3   ?     ?   94.8297   35.9911      65.4274    35.9911      18.1592    -144.009     
1 1 1 -36 6  20 o 0 175     8     ?     ?   251.552   88.6569      340.543    88.6569      103.717    88.6569      
1 1 1 -36 6  19 o 0 15.1    6     ?     ?   105.784   78.4162      8.3186     78.4162      91.5349    -101.584     
1 1 1 -36 6  18 o 0 1.7     5.1   ?     ?   105.195   14.0505      60.8373    -165.95      153.198    -165.95      
1 1 1 -36 6  17 o 0 32.5    5.1   ?     ?   144.128   41.9626      71.2624    41.9626      55.3419    -138.037     
1 1 1 -36 6  16 o 0 0.1     4.3   ?     ?   54.1049   75.9647      36.7795    -104.035     84.5436    -104.035     
1 1 1 -36 6  15 o 0 24.7    3.5   ?     ?   141.907   137.744      27.6222    137.744      101.922    -42.2558     
1 1 1 -36 6  14 f 1 567.6   11.5  ?     ?   562.096   47.6961      538.644    47.6961      9.99662    47.6961      
1 1 1 -36 6  13 o 0 229.6   5.6   ?     ?   333.488   34.1445      351.233    34.1445      36.8884    34.1445      
1 1 1 -36 6  12 f 1 163.1   4.9   ?     ?   225.161   74.8496      313.775    74.8496      95.1529    74.8496      
1 1 1 -36 6  11 o 0 5.6     2.1   ?     ?   77.9743   24.647       57.6924    -155.353     133.502    -155.353     
1 1 1 -36 6  10 o 0 114.9   3.8   ?     ?   355.161   170.747      94.927     170.747      212.731    -9.25334     
1 1 1 -36 6  9  o 0 112.5   3.1   ?     ?   424.552   -135.919     37.769     -135.919     332.042    44.0814      
1 1 1 -36 6  8  o 0 25.5    1.6   ?     ?   452.007   179.922      227.676    -0.0776509   619.976    -0.0776509   
1 1 1 -36 6  7  f 1 1042.5  27.3  ?     ?   902.752   165.841      549.625    165.841      241.585    -14.1592     
1 1 1 -36 6  6  o 0 313.3   10.6  ?     ?   252.036   151.688      450.809    151.688      230.112    151.688      
1 1 1 -36 6  5  o 0 2762.8  67.3  ?     ?   1048.55   155.004      1270.62    155.004      329.333    155.004      
1 1 1 -36 6  4  o 0 733.4   21.6  ?     ?   621.56    -22.7385     560.723    -22.7385     0.84411    -22.7385     
1 1 1 -36 6  3  o 0 70.4    5.7   ?     ?   341.657   61.1788      21.0052    -118.821     329.686    -118.821     
1 1 1 -36 6  2  o 0 5.3     5.4   ?     ?   104.159   -34.2957     80.7581    145.704      175.112    145.704      
1 1 1 -36 6  1  o 0 156.9   4.7   ?     ?   399.925   -83.7242     118.852    -83.7242     244.242    96.2758      
1 1 1 36  6  0  f 1 667.3   13.6  ?     ?   578.672   164.423      548.731    164.423      17.6724    164.423      
1 1 1 36  6  1  o 0 20.1    2.9   ?     ?   87.4995   62.2039      42.3951    -117.796     122.409    -117.796     
1 1 1 36  6  2  o 0 284.6   6.9   ?     ?   271.303   -139.592     398.14     -139.592     149.737    -139.592     
1 1 1 36  6  3  o 0 244.3   6.7   ?     ?   458.251   108.579      209.726    108.579      210.23     -71.4209     
1 1 1 36  6  4  o 0 553.7   11.8  ?     ?   588.132   82.6958      445.534    82.6958      93.7545    -97.3042     
1 1 1 36  6  5  o 0 78.9    4.8   ?     ?   290.031   111.296      33.0279    111.296      232.966    -68.7036     
1 1 1 36  6  6  o 0 150.4   7.4   ?     ?   158.571   -21.9332     246.988    -21.9332     104.621    -21.9332     
1 1 1 36  6  7  f 1 960.5   22.8  ?     ?   719.68    -46.0928     669.208    -46.0928     20.1714    -46.0928     
1 1 1 36  6  8  o 0 105.4   7.5   ?     ?   245.796   18.616       135.991    18.616       84.3007    -161.384     
1 1 1 36  6  9  o 0 80.9    8     ?     ?   70.4585   3.93101      98.0861    3.93101      34.4852    3.93101      
1 1 1 36  6  10 o 0 89.4    8.5   ?     ?   125.039   125.628      149.811    125.628      37.1714    125.628      
1 1 1 36  6  11 o 0 232.4   11.3  ?     ?   280.981   60.264       406.186    60.264       121.111    60.264       
1 1 1 36  6  12 f 1 293.9   13    ?     ?   305.651   -84.5033     474.317    -84.5033     163.553    -84.5033     
1 1 1 36  6  13 o 0 65.3    10.9  ?     ?   108.505   20.3306      168.43     20.3306      60.9658    20.3306      
1 1 1 36  6  14 f 1 10.7    11    ?     ?   149.55    133.562      47.4905    -46.4377     193.3      -46.4377     
1 1 1 36  6  15 o 0 72.1    12.4  ?     ?   127.303   -76.6744     216.502    -76.6744     96.6267    -76.6744     
1 1 1 36  6  16 o 0 66.7    15.8  ?     ?   207.677   23.1817      149.176    23.1817      46.16      -156.818     
1 1 1 36  6  17 o 0 40.5    17.5  ?     ?   179.47    85.2606      75.8695    85.2606      93.5013    -94.7394     
1 1 1 36  6  18 o 0 63.1    20.3  ?     ?   96.3543   37.0819      203.773    37.0819      105.637    37.0819      
1 1 1 36  6  19 o 0 31.4    23.8  ?     ?   154.664   -11.6802     63.2797    -11.6802     94.4364    168.32       
1 1 1 36  6  20 o 0 194.7   25.1  ?     ?   245.528   -11.0072     406.978    -11.0072     166.65     -11.0072     
1 1 1 36  6  21 o 0 -3.5    27.8  ?     ?   93.9591   76.4519      31.8382    76.4519      57.5747    -103.548     
1 1 1 36  6  22 o 0 27.4    29.5  ?     ?   126.548   124.055      87.9183    124.055      30.3111    -55.945      
1 1 1 -36 8  22 < 0 43      7.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 8  21 f 1 41.1    7.5   ?     ?   163.264   -87.3056     116.891    -87.3056     21.6675    92.6944      
1 1 1 -36 8  20 o 0 70.5    6.8   ?     ?   205.031   -36.3573     172.421    -36.3573     2.19271    143.643      
1 1 1 -36 8  19 o 0 1.3     5.3   ?     ?   73.9146   -108.846     37.6543    71.1537      103.475    71.1537      
1 1 1 -36 8  18 o 0 20.2    4.4   ?     ?   86.3824   -66.2765     51.6975    -66.2765     28.7032    113.723      
1 1 1 -36 8  17 o 0 27.7    3.8   ?     ?   181.372   37.014       34.8593    37.014       134.297    -142.986     
1 1 1 -36 8  16 o 0 10.5    3.4   ?     ?   146.813   107.665      36.2872    -72.3347     163.571    -72.3347     
1 1 1 -36 8  15 o 0 27.5    3.8   ?     ?   65.6048   172.363      55.5409    172.363      1.33003    -7.63722     
1 1 1 -36 8  14 o 0 104.5   4.5   ?     ?   252.618   -178.131     202.931    -178.131     17.0172    1.86932      
1 1 1 -36 8  13 o 0 81.4    3.7   ?     ?   214.306   56.6355      179.139    56.6355      8.88937    -123.365     
1 1 1 -36 8  12 o 0 199     5.3   ?     ?   253.996   17.8829      370.744    17.8829      140.547    17.8829      
1 1 1 -36 8  11 f 1 740     14    ?     ?   647.298   -11.9075     609.358    -11.9075     5.61297    -11.9075     
1 1 1 -36 8  10 o 0 28.9    2.1   ?     ?   186.317   -86.3579     10.0724    -86.3579     163.911    93.6421      
1 1 1 -36 8  9  o 0 324.7   7.3   ?     ?   411.064   -19.2805     400.407    -19.2805     7.44676    -19.2805     
1 1 1 -36 8  8  o 0 594.1   17.9  ?     ?   574.258   -5.3931      545.574    -5.3931      6.35485    174.607      
1 1 1 -36 8  7  f 1 342.4   11    ?     ?   455.07    -84.907      384.992    -84.907      56.8036    95.093       
1 1 1 -36 8  6  o 0 1038.2  27.8  ?     ?   856.267   -179.223     573.768    -179.223     162.001    0.777262     
1 1 1 -36 8  5  o 0 852.6   23.3  ?     ?   742.375   99.133       547.306    99.133       93.1843    -80.867      
1 1 1 -36 8  4  o 0 838.6   26    ?     ?   656.368   47.7868      610.978    47.7868      42.6412    47.7868      
1 1 1 -36 8  3  o 0 170.2   8.1   ?     ?   354.478   83.2001      192.949    83.2001      114.967    -96.7999     
1 1 1 -36 8  2  o 0 114.4   7.8   ?     ?   416.809   -13.1259     47.2121    -13.1259     315.854    166.874      
1 1 1 -36 8  1  o 0 157.3   5.2   ?     ?   321.446   -138.325     185.729    -138.325     92.4971    41.6753      
1 1 1 36  8  0  o 0 12      2.6   ?     ?   233.38    108.961      142.742    -71.0388     346.745    -71.0388     
1 1 1 36  8  1  o 0 292.3   8.9   ?     ?   352.694   -80.6677     360.346    -80.6677     51.645     -80.6677     
1 1 1 36  8  2  o 0 623.6   13.1  ?     ?   530.929   -76.2289     561.125    -76.2289     91.8962    -76.2289     
1 1 1 36  8  3  o 0 332.7   8.6   ?     ?   495.269   0.192751     305.373    0.192751     132.607    -179.807     
1 1 1 36  8  4  o 0 122.9   5.4   ?     ?   157.711   141.987      221.661    141.987      82.1615    141.987      
1 1 1 36  8  5  o 0 3.4     5.1   ?     ?   184.873   -100.696     137.241    79.3044      300.738    79.3044      
1 1 1 36  8  6  o 0 172.7   7.7   ?     ?   370.134   65.8067      188.421    65.8067      138.728    -114.193     
1 1 1 36  8  7  f 1 440.5   12    ?     ?   396.388   153.262      570.415    153.262      173.202    153.262      
1 1 1 36  8  8  o 0 186.1   9.1   ?     ?   200.498   157.982      382.143    157.982      182.546    157.982      
1 1 1 36  8  9  o 0 87.2    8.4   ?     ?   230.042   52.3789      172.316    52.3789      52.2627    -127.621     
1 1 1 36  8  10 o 0 93.1    9.7   ?     ?   278.18    66.8521      147.881    66.8521      123.047    -113.148     
1 1 1 36  8  11 f 1 68      10.3  ?     ?   266.407   45.2883      99.7949    45.2883      155.915    -134.712     
1 1 1 36  8  12 o 0 35.1    11.2  ?     ?   120.465   -90.7157     78.4377    -90.7157     36.2176    89.2843      
1 1 1 36  8  13 o 0 328.5   16.6  ?     ?   423.441   -74.4304     438.445    -74.4304     46.9476    -74.4304     
1 1 1 36  8  14 o 0 116.6   13.6  ?     ?   298.792   -110.183     200.092    -110.183     76.0216    69.8171      
1 1 1 36  8  15 o 0 45.1    17.2  ?     ?   153.24    159.849      108.558    159.849      33.6183    -20.1511     
1 1 1 36  8  16 o 0 12.9    15.1  ?     ?   118.21    -130.816     7.44991    -130.816     110.99     49.184       
1 1 1 36  8  17 o 0 6.8     19.2  ?     ?   60.1948   8.4111       22.2526    8.41109      38.1699    -171.589     
1 1 1 36  8  18 o 0 131     26.3  ?     ?   159.043   -97.7244     341.311    -97.7243     187.979    -97.7243     
1 1 1 36  8  19 o 0 44.9    26.7  ?     ?   141.7     -10.3872     115.361    -10.3872     17.5329    169.613      
1 1 1 36  8  20 o 0 54.2    25.5  ?     ?   150.975   -56.7066     141.715    -56.7066     2.93769    -56.7066     
1 1 1 -36 10 20 < 1 109.1   7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 10 19 o 0 211.6   8.8   ?     ?   317.876   -104.302     344.135    -104.302     80.707     -104.302     
1 1 1 -36 10 18 o 0 51.9    6.2   ?     ?   141.597   -70.8563     162.033    -70.8563     43.7477    -70.8563     
1 1 1 -36 10 17 o 0 38.2    5.4   ?     ?   138.231   70.6763      115.221    70.6763      2.92791    -109.324     
1 1 1 -36 10 16 o 0 70.8    5.6   ?     ?   147.902   101.549      204.511    101.549      74.1942    101.549      
1 1 1 -36 10 15 o 0 44.7    4.5   ?     ?   198.184   25.7556      87.3026    25.7556      95.0121    -154.244     
1 1 1 -36 10 14 o 0 7.7     3.3   ?     ?   102.153   -10.1572     34.6707    169.843      128.731    169.843      
1 1 1 -36 10 13 o 0 8       3.3   ?     ?   94.1597   -140.674     29.8474    39.3257      110.353    39.3257      
1 1 1 -36 10 12 o 0 -0.4    2.7   ?     ?   111.925   47.9507      82.008     -132.049     178.422    -132.049     
1 1 1 -36 10 11 o 0 35      2.8   ?     ?   58.011    -51.0643     75.9816    -51.0643     26.0959    -51.0643     
1 1 1 -36 10 10 o 0 52.5    2.8   ?     ?   125.527   -87.6056     145.633    -87.6056     37.3864    -87.6056     
1 1 1 -36 10 9  f 1 22.4    2     ?     ?   42.6757   107.286      26.5397    107.286      10.6761    -72.7136     
1 1 1 -36 10 8  o 0 90.8    3.3   ?     ?   115.725   -131.956     242.97     -131.956     139.422    -131.956     
1 1 1 -36 10 7  f 1 321.8   8.3   ?     ?   329.052   -52.9422     476.754    -52.9422     179.282    -52.9422     
1 1 1 -36 10 6  o 0 388.9   9.6   ?     ?   388.416   5.18596      510.152    5.18596      159.162    5.18596      
1 1 1 -36 10 5  o 0 148.4   4.9   ?     ?   231.203   -38.3721     291.255    -38.3721     77.8733    -38.3721     
1 1 1 -36 10 4  o 0 300.9   8.7   ?     ?   332.083   -85.6367     445.103    -85.6367     137.448    -85.6367     
1 1 1 -36 10 3  o 0 5.3     2.1   ?     ?   152.829   70.3758      103.224    -109.624     245.289    -109.624     
1 1 1 -36 10 2  f 1 145.4   4.8   ?     ?   205.305   55.6095      306.279    55.6095      113.889    55.6095      
1 1 1 -36 10 1  o 0 100.4   4     ?     ?   316.723   -147.401     128.489    -147.401     167.532    32.5989      
1 1 1 36  10 0  o 0 109.1   4.2   ?     ?   215.115   -94.1869     230.587    -94.1869     26.4887    -94.1869     
1 1 1 36  10 1  o 0 213.3   6.3   ?     ?   447.528   -93.7329     227.844    -93.7329     197.209    86.2671      
1 1 1 36  10 2  f 1 463.2   10.6  ?     ?   518.333   -101.061     481.054    -101.061     14.1125    78.9393      
1 1 1 36  10 3  o 0 239.7   7.4   ?     ?   371.192   -106.157     336.539    -106.157     16.3492    73.8427      
1 1 1 36  10 4  o 0 14      5.1   ?     ?   121.611   94.9287      36.1696    -85.0713     151.771    -85.0713     
1 1 1 36  10 5  o 0 333.2   10.7  ?     ?   361.662   3.20886      472.5      3.20886      128.889    3.20886      
1 1 1 36  10 6  o 0 13.4    7.8   ?     ?   72.1585   -11.5854     10.2515    168.415      77.5999    168.415      
1 1 1 36  10 7  f 1 58.6    8.1   ?     ?   252.085   153.796      82.0231    153.796      154.143    -26.2042     
1 1 1 36  10 8  o 0 99      8.3   ?     ?   26.3807   154.239      151.113    154.239      127.181    154.239      
1 1 1 36  10 9  f 1 37.9    10.5  ?     ?   168.512   34.4128      77.91      34.4128      75.4028    -145.587     
1 1 1 36  10 10 o 0 83.7    11    ?     ?   187.508   -4.43018     207.066    -4.43018     37.1665    -4.43018     
1 1 1 36  10 11 o 0 113.3   10.9  ?     ?   205.519   92.1821      262.986    92.1821      77.359     92.1821      
1 1 1 36  10 12 o 0 212.2   16.4  ?     ?   199.939   158.684      445.4      158.684      263.893    158.684      
1 1 1 36  10 13 o 0 63.5    17    ?     ?   131.708   -88.6056     193.265    -88.6056     64.0039    -88.6056     
1 1 1 36  10 14 o 0 159.1   17.6  ?     ?   184.157   -7.12149     380.302    -7.12149     199.039    -7.12149     
1 1 1 36  10 15 o 0 156.7   21.7  ?     ?   272.38    -3.30196     290.754    -3.30196     23.9965    -3.30196     
1 1 1 36  10 16 o 0 35.9    23.1  ?     ?   168.564   -61.9665     59.5871    -61.9665     99.068     118.034      
1 1 1 36  10 17 o 0 13.9    28    ?     ?   241.293   -74.6084     32.0222    105.392      250.2      105.392      
1 1 1 36  10 18 o 0 209.7   27.5  ?     ?   288.927   -134.715     373.946    -134.715     113.771    -134.715     
1 1 1 36  10 19 < 0 59.7    27.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 12 17 < 0 7.1     6     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 12 16 < 0 21.8    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 12 15 o 0 19.7    6.6   ?     ?   93.5604   76.0073      68.1838    76.0073      8.64077    -103.993     
1 1 1 -36 12 14 o 0 34.4    4.8   ?     ?   142.223   70.9094      102.998    70.9094      14.5339    -109.091     
1 1 1 -36 12 13 f 1 13.7    4.4   ?     ?   41.1775   79.7904      21.5368    79.7904      13.403     -100.21      
1 1 1 -36 12 12 f 1 50.8    4.4   ?     ?   92.0805   -62.0787     170.882    -62.0787     90.4689    -62.0787     
1 1 1 -36 12 11 o 0 106.6   4.8   ?     ?   256.479   71.3181      197.838    71.3181      34.4361    -108.682     
1 1 1 -36 12 10 o 0 20.5    3.5   ?     ?   161.007   50.8486      18.1894    50.8486      128.613    -129.151     
1 1 1 -36 12 9  o 0 61.9    3.7   ?     ?   87.983    -73.3511     196.689    -73.3511     116.562    -73.3511     
1 1 1 -36 12 8  f 1 86.2    4.2   ?     ?   89.9081   -164.803     262.457    -164.803     179.674    -164.803     
1 1 1 -36 12 7  o 0 89.4    4.1   ?     ?   238.67    96.8838      174.222    96.8838      28.268     -83.1162     
1 1 1 -36 12 6  o 0 72.4    4     ?     ?   169.441   99.9395      182.488    99.9395      38.0241    99.9395      
1 1 1 -36 12 5  o 0 21      3.1   ?     ?   108.069   -29.5778     31.0826    -29.5778     60.6628    150.422      
1 1 1 -36 12 4  o 0 37.1    3.6   ?     ?   85.4573   -1.30874     95.9005    -1.30874     23.0604    -1.30874     
1 1 1 -36 12 3  o 0 311.2   10.8  ?     ?   294.645   -52.5699     487.015    -52.5699     234.979    -52.5699     
1 1 1 -36 12 2  o 0 291.6   13.8  ?     ?   262.646   16.8166      487.648    16.8166      262.286    16.8166      
1 1 1 -36 12 1  o 0 15      3.9   ?     ?   61.3133   14.209       7.91812    14.209       44.8316    -165.791     
1 1 1 36  12 0  o 0 111.3   5.2   ?     ?   115.965   61.456       302.661    61.456       200.808    61.456       
1 1 1 36  12 1  o 0 276.5   8.1   ?     ?   300.014   -146.876     451.717    -146.876     188.007    -146.876     
1 1 1 36  12 2  o 0 1.1     4.9   ?     ?   24.5724   -75.4245     15.1208    104.575      36.7279    104.575      
1 1 1 36  12 3  o 0 13.2    6.8   ?     ?   49.2419   -160.058     0.605077   19.9419      43.9037    19.9419      
1 1 1 36  12 4  o 0 75.2    8.1   ?     ?   129.332   175.847      212.512    175.847      98.8398    175.847      
1 1 1 36  12 5  o 0 54.2    7.7   ?     ?   38.4461   -47.2059     115.273    -47.2059     81.2151    -47.2059     
1 1 1 36  12 6  o 0 41.7    8.4   ?     ?   237.047   -91.6111     47.3456    -91.6111     162.377    88.3889      
1 1 1 36  12 7  o 0 127.5   10.4  ?     ?   238.792   -94.6336     260.693    -94.6336     49.7894    -94.6336     
1 1 1 36  12 8  f 1 62.6    10.5  ?     ?   197.346   -129.315     143.746    -129.315     46.023     50.6849      
1 1 1 36  12 9  o 0 203.8   12.6  ?     ?   406.25    -175.519     255.127    -175.519     132.518    4.48105      
1 1 1 36  12 10 o 0 15.9    13.9  ?     ?   174.609   -108.471     16.5445    71.5289      183.895    71.5289      
1 1 1 36  12 11 o 0 -9.8    15.9  ?     ?   115.937   -76.6775     34.445     103.323      141.446    103.323      
1 1 1 36  12 12 f 1 41.4    17.2  ?     ?   62.0141   -72.273      117.431    -72.273      60.1298    -72.273      
1 1 1 36  12 13 f 1 22.1    19.7  ?     ?   32.4049   -148.207     42.8262    -148.207     13.6374    -148.207     
1 1 1 36  12 14 o 0 19.4    13.7  ?     ?   177.717   -86.3706     8.16873    -86.3706     148.252    93.6294      
1 1 1 36  12 15 o 0 -11.6   23.7  ?     ?   67.0898   -158.171     30.7861    -158.171     28.083     21.8288      
1 1 1 36  12 16 < 0 -10.8   27.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 14 12 < 0 10.2    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 14 11 < 0 20.5    5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 14 10 o 0 31.3    5     ?     ?   88.5462   -17.0374     123.059    -17.0374     51.5253    -17.0374     
1 1 1 -36 14 9  o 0 96      6     ?     ?   160.644   9.86926      254.465    9.86926      124.132    9.86926      
1 1 1 -36 14 8  o 0 43.8    4.9   ?     ?   139.362   -10.2678     135.483    -10.2678     21.7319    -10.2678     
1 1 1 -36 14 7  f 1 75.8    5.1   ?     ?   106.233   -169.29      236.296    -169.29      147.496    -169.29      
1 1 1 -36 14 6  o 0 31      5     ?     ?   81.3658   -97.8848     105.945    -97.8848     37.9332    -97.8848     
1 1 1 -36 14 5  o 0 -5.3    4.9   ?     ?   32.8791   25.6023      21.7154    -154.398     49.9142    -154.398     
1 1 1 -36 14 4  o 0 7.5     5     ?     ?   86.7946   0.164516     19.1199    -179.835     93.8715    -179.835     
1 1 1 -36 14 3  o 0 213.5   12.1  ?     ?   242.083   117.66       397.529    117.66       188.257    117.66       
1 1 1 -36 14 2  o 0 53.2    9.7   ?     ?   160.661   147.002      141.28     147.002      1.93876    147.002      
1 1 1 -36 14 1  o 0 -10.5   6.5   ?     ?   52.174    166.808      34.1664    -13.1922     79.5451    -13.1922     
1 1 1 36  14 0  o 0 0       7.2   ?     ?   69.1562   168.551      30.4928    -11.4487     92.2597    -11.4487     
1 1 1 36  14 1  o 0 34.4    6.7   ?     ?   90.9267   162.285      115.844    162.285      34.592     162.285      
1 1 1 36  14 2  o 0 7.9     7.1   ?     ?   67.2677   139.87       7.26802    -40.1303     67.3838    -40.1303     
1 1 1 36  14 3  o 0 103.9   8.6   ?     ?   165.144   -4.96455     274.279    -4.96455     126.741    -4.96455     
1 1 1 36  14 4  o 0 1.1     8.2   ?     ?   72.3659   -79.7262     25.5031    100.274      90.1063    100.274      
1 1 1 36  14 5  o 0 9.8     9.2   ?     ?   84.4943   -177.867     5.23508    -177.867     68.5366    2.13259      
1 1 1 36  14 6  o 0 101.1   12.5  ?     ?   163.98    122.968      269.586    122.968      126.645    122.968      
1 1 1 36  14 7  f 1 45.8    13.7  ?     ?   35.2254   -110.642     115.212    -110.642     84.4109    -110.642     
1 1 1 36  14 8  o 0 340     17    ?     ?   425.626   -86.262      433.201    -86.262      68.6678    -86.262      
1 1 1 36  14 9  o 0 275.3   18.2  ?     ?   304.906   -92.33       450.876    -92.33       189.912    -92.33       
1 1 1 36  14 10 o 0 69.3    16.8  ?     ?   129.015   -89.7835     215.929    -89.7835     105.878    -89.7835     
1 1 1 36  14 11 < 0 34.5    18.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 36  14 12 < 0 55.9    22.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 16 2  < 1 -6.1    8.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -36 16 1  < 0 15.2    10.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 36  16 0  < 0 59.3    12.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 36  16 1  < 0 10.1    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 36  16 2  < 1 2.4     12.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 1  25 < 0 135.5   8.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 1  24 f 1 31.1    7     ?     ?   82.788    -55.3838     132.966    -55.3838     59.8896    -55.3838     
1 1 1 -37 1  23 o 0 23.5    6.1   ?     ?   129.096   160.735      63.1594    160.735      52.7244    -19.2652     
1 1 1 -37 1  22 o 0 -3.3    6.1   ?     ?   70.2396   176.291      42.7419    -3.70875     107.824    -3.70875     
1 1 1 -37 1  21 o 0 87      5.5   ?     ?   159.342   53.48        243.066    53.48        89.8653    53.48        
1 1 1 -37 1  20 f 1 279.5   7.8   ?     ?   341.77    -29.2388     423.548    -29.2388     116.31     -29.2388     
1 1 1 -37 1  19 o 0 144.7   7     ?     ?   358.123   -19.1686     203.426    -19.1686     117.044    160.831      
1 1 1 -37 1  18 o 0 672.6   13.6  ?     ?   538.825   -68.1185     684.638    -68.1185     200.019    -68.1185     
1 1 1 -37 1  17 o 0 38.6    3.7   ?     ?   360.218   -30.2747     72.6806    149.725      407.721    149.725      
1 1 1 -37 1  16 o 0 503.6   10.3  ?     ?   473.909   10.4928      568.297    10.4928      116.471    10.4928      
1 1 1 -37 1  15 o 0 170.3   5     ?     ?   186.522   -95.4915     356.001    -95.4915     173.66     -95.4915     
1 1 1 -37 1  14 o 0 322.5   7     ?     ?   324.794   152.418      485.975    152.418      166.244    152.418      
1 1 1 -37 1  13 o 0 160.4   4.6   ?     ?   240.377   81.0466      256.79     81.0466      45.8486    81.0466      
1 1 1 -37 1  12 o 0 36.6    2.7   ?     ?   46.473    -89.4057     0.0554465  90.5943      40.7286    90.5943      
1 1 1 -37 1  11 o 0 411.7   8.8   ?     ?   638.487   149.735      272.41     149.735      289.528    -30.2646     
1 1 1 -37 1  10 o 0 647.1   13.8  ?     ?   521.887   114.943      575.714    114.943      104.2      114.943      
1 1 1 -37 1  9  o 0 448.7   9.1   ?     ?   329.287   -136.96      544.537    -136.96      245.622    -136.96      
1 1 1 -37 1  8  o 0 712.2   16.2  ?     ?   528.728   131.441      629.251    131.441      147.207    131.441      
1 1 1 -37 1  7  o 0 528.9   14.7  ?     ?   361.758   119.225      584.432    119.225      258.105    119.225      
1 1 1 -37 1  6  o 0 130.4   3.4   ?     ?   288.424   -112.285     140.573    -112.285     120.54     67.715       
1 1 1 -37 1  5  o 0 708.4   15.1  ?     ?   711.266   32.11        455.383    32.11        190.642    -147.89      
1 1 1 -37 1  4  o 0 656     15.3  ?     ?   565.061   76.0667      539.105    76.0667      24.3443    76.0667      
1 1 1 -37 1  3  f 1 1247.9  32.4  ?     ?   479.166   -97.8826     1025.15    -97.8826     585.208    -97.8826     
1 1 1 -37 1  2  o 0 1439.6  37.1  ?     ?   927.552   -147.033     743.193    -147.033     117.374    32.9671      
1 1 1 -37 1  1  o 0 699.2   15.5  ?     ?   411.851   -162.256     702.347    -162.256     319.389    -162.256     
1 1 1 37  1  0  o 0 1394.4  28.3  ?     ?   658.683   -172.056     962.195    -172.056     348.507    -172.056     
1 1 1 37  1  1  o 0 1716    35.9  ?     ?   1014.7    -143.885     818.613    -143.885     128.498    36.1148      
1 1 1 37  1  2  o 0 858.8   20.3  ?     ?   460.431   -112.55      789.883    -112.55      359.441    -112.55      
1 1 1 37  1  3  f 1 361.2   9.2   ?     ?   307.279   -20.2741     463.068    -20.2741     177.711    -20.2741     
1 1 1 37  1  4  o 0 1062.2  26.7  ?     ?   768.065   -25.9429     671.972    -25.9429     38.3737    154.057      
1 1 1 37  1  5  o 0 388.7   13.5  ?     ?   786.074   107.694      98.585     107.694      628.91     -72.3063     
1 1 1 37  1  6  o 0 1101.1  23.5  ?     ?   731.88    91.422       730.41     91.422       52.8638    91.422       
1 1 1 37  1  7  o 0 412     10.6  ?     ?   223.669   -171.386     583.798    -171.386     371.168    -171.386     
1 1 1 37  1  8  o 0 11.4    5.8   ?     ?   148.012   105.309      103.75     -74.6909     242.699    -74.6909     
1 1 1 37  1  9  o 0 276.7   9.5   ?     ?   423.89    129.589      287.26     129.589      110.28     -50.4107     
1 1 1 37  1  10 o 0 654.8   16.2  ?     ?   372.242   -98.88       740.265    -98.88       398.934    -98.88       
1 1 1 37  1  11 o 0 457     15    ?     ?   396.527   -54.5664     533.044    -54.5664     170.15     -54.5664     
1 1 1 37  1  12 o 0 62.1    11.1  ?     ?   270.715   39.2544      33.6286    39.2544      215.689    -140.746     
1 1 1 37  1  13 o 0 365.4   14.3  ?     ?   510.997   38.0239      341.598    38.0239      127.644    -141.976     
1 1 1 37  1  14 o 0 22.5    12.2  ?     ?   204.93    -176.358     62.16      3.64209      273.921    3.64209      
1 1 1 37  1  15 o 0 95.7    13.2  ?     ?   275.773   30.1284      161.203    30.1284      117.709    -149.872     
1 1 1 37  1  16 o 0 -20.6   14.4  ?     ?   90.1064   -103.329     64.5623    76.671       155.301    76.671       
1 1 1 37  1  17 o 0 92.7    16.2  ?     ?   297.716   123.798      141.74     123.798      151.653    -56.2019     
1 1 1 37  1  18 o 0 98      17.4  ?     ?   243.242   105.066      208.71     105.066      23.815     -74.9341     
1 1 1 37  1  19 o 0 80.2    22.9  ?     ?   212.115   114.136      179.81     114.136      22.5763    -65.8644     
1 1 1 37  1  20 f 1 74.7    21.7  ?     ?   154.724   121.597      217.609    121.597      56.1035    121.597      
1 1 1 37  1  21 o 0 64.3    23.7  ?     ?   75.6241   80.8445      210.556    80.8446      131.943    80.8446      
1 1 1 37  1  22 o 0 -4.9    31.6  ?     ?   112.871   35.9042      25.1298    35.9042      87.4744    -144.096     
1 1 1 37  1  23 o 0 3.2     34.7  ?     ?   84.8475   18.3232      70.035     18.3232      11.1748    -161.677     
1 1 1 37  1  24 f 1 73.6    30.3  ?     ?   173.288   -116.468     173.741    -116.468     7.92584    -116.468     
1 1 1 -37 3  24 o 0 34.9    6.4   ?     ?   66.3487   -161.06      149.439    -161.06      91.9142    -161.06      
1 1 1 -37 3  23 o 0 156.1   8.1   ?     ?   265.97    -35.1211     313.083    -35.1211     80.3625    -35.1211     
1 1 1 -37 3  22 o 0 67.6    6.3   ?     ?   181.676   -41.2078     178.521    -41.2078     12.2148    -41.2078     
1 1 1 -37 3  21 o 0 143.4   6.2   ?     ?   316.864   28.6862      230.893    28.6862      72.447     -151.314     
1 1 1 -37 3  20 f 1 18.3    5.7   ?     ?   76.7221   46.3618      35.7527    46.3618      38.2644    -133.638     
1 1 1 -37 3  19 f 1 16.4    4.6   ?     ?   104.38    -141.242     16.0841    -141.242     77.5779    38.7582      
1 1 1 -37 3  18 o 0 15.6    3.7   ?     ?   147.525   0.131444     12.2638    -179.869     143.527    -179.869     
1 1 1 -37 3  17 o 0 131.6   5.5   ?     ?   192.08    -23.5581     302.125    -23.5581     125.322    -23.5581     
1 1 1 -37 3  16 o 0 46.9    3.3   ?     ?   146.563   139.197      115.671    139.197      20.3522    -40.8027     
1 1 1 -37 3  15 o 0 274.5   6.4   ?     ?   347.826   14.1898      407.599    14.1898      76.7369    14.1898      
1 1 1 -37 3  14 o 0 106.7   3.9   ?     ?   198.024   -11.083      219.865    -11.083      26.7437    -11.083      
1 1 1 -37 3  13 o 0 101.7   4.2   ?     ?   90.3594   32.711       151.783    32.711       73.2       32.711       
1 1 1 -37 3  12 f 1 228.2   6     ?     ?   367.803   -18.35       269.926    -18.35       53.6503    161.65       
1 1 1 -37 3  11 o 0 742     14    ?     ?   402.592   -88.732      751.895    -88.732      400.501    -88.732      
1 1 1 -37 3  10 o 0 1425.7  27    ?     ?   891.609   -114.134     799.341    -114.134     16.8317    -114.134     
1 1 1 -37 3  9  o 0 78.7    2.9   ?     ?   182.992   18.755       72.854     18.755       91.996     -161.245     
1 1 1 -37 3  8  o 0 1618.8  28.3  ?     ?   677.482   151.742      1079.87    151.742      466.721    151.742      
1 1 1 -37 3  7  o 0 1828.4  32.1  ?     ?   1036.26   -126.897     878.16     -126.897     63.6872    53.1032      
1 1 1 -37 3  6  o 0 61.8    3.2   ?     ?   222.136   -148.843     16.4579    -148.843     188.672    31.1575      
1 1 1 -37 3  5  o 0 1220.6  23.7  ?     ?   791.327   -66.909      734.613    -66.909      20.5819    -66.909      
1 1 1 -37 3  4  o 0 1594.7  36    ?     ?   776.856   -49.4949     960.891    -49.4949     257.71     -49.4949     
1 1 1 -37 3  3  o 0 1105.5  20.5  ?     ?   572.088   -171.081     855.889    -171.081     336.593    -171.081     
1 1 1 -37 3  2  o 0 4655.6  84.5  ?     ?   1586.49   -155.661     1447.36    -155.661     3.6477     -155.661     
1 1 1 -37 3  1  o 0 1426.2  37.4  ?     ?   514.376   -2.73386     1100.61    -2.73386     631.478    -2.73386     
1 1 1 37  3  0  o 0 259.9   10    ?     ?   537.551   -27.4141     157.456    -27.4141     334.054    152.586      
1 1 1 37  3  1  o 0 1311.9  24.5  ?     ?   959.563   -117.308     651.566    -117.308     227.387    62.6916      
1 1 1 37  3  2  o 0 547.4   10.9  ?     ?   555.814   -177.817     455.57     -177.817     54.3369    2.18322      
1 1 1 37  3  3  o 0 725.4   15.7  ?     ?   743.639   77.8329      445.784    77.8329      237.295    -102.167     
1 1 1 37  3  4  o 0 263.3   7.2   ?     ?   573.9     171.029      132.212    171.029      395.448    -8.97107     
1 1 1 37  3  5  o 0 892.4   17.4  ?     ?   976.266   -63.4988     375.966    -63.4988     546.403    116.501      
1 1 1 37  3  6  o 0 217.3   7.2   ?     ?   293.504   -60.414      297.172    -60.414      23.1325    -60.414      
1 1 1 37  3  7  o 0 479.4   11.2  ?     ?   454.254   131.023      494.582    131.023      70.5457    131.023      
1 1 1 37  3  8  o 0 247.4   8.9   ?     ?   304.531   -146.034     333.927    -146.034     49.8412    -146.034     
1 1 1 37  3  9  o 0 54      7.2   ?     ?   204.122   -10.2999     22.6404    -10.2999     163.602    169.7        
1 1 1 37  3  10 o 0 18.5    7.3   ?     ?   31.9456   143.752      14.9217    -36.2484     44.0224    -36.2484     
1 1 1 37  3  11 o 0 589.2   15.8  ?     ?   558.09    -45.0223     524.702    -45.0223     17.3696    -45.0223     
1 1 1 37  3  12 f 1 33.5    8.8   ?     ?   304.793   -92.8881     85.3063    87.1119      365.52     87.1119      
1 1 1 37  3  13 o 0 145.8   11.4  ?     ?   84.1642   -51.7443     318.218    -51.7443     231.565    -51.7443     
1 1 1 37  3  14 o 0 749.7   20.5  ?     ?   529.788   -55.5657     773.136    -55.5657     229.611    -55.5657     
1 1 1 37  3  15 o 0 310.2   15.9  ?     ?   333.64    32.254       492.514    32.254       157.551    32.254       
1 1 1 37  3  16 o 0 1.6     16.8  ?     ?   94.9327   5.89258      25.8432    -174.107     119.14     -174.107     
1 1 1 37  3  17 o 0 18.6    17.2  ?     ?   118.991   27.5079      19.2979    27.5079      94.1669    -152.492     
1 1 1 37  3  18 o 0 285.4   19.3  ?     ?   278.59    -171.11      516.086    -171.11      250.872    -171.11      
1 1 1 37  3  19 f 1 -1.1    20.6  ?     ?   98.8057   155.725      5.3348     -24.2749     100.152    -24.2749     
1 1 1 37  3  20 f 1 54.6    23.9  ?     ?   109.659   176.646      163.981    176.646      50.4619    176.646      
1 1 1 37  3  21 o 0 -15.7   35.5  ?     ?   165.109   179.527      7.72926    -0.472687    172.179    -0.472687    
1 1 1 37  3  22 o 0 41.8    24    ?     ?   89.2836   174.693      136.091    174.693      49.6329    174.693      
1 1 1 37  3  23 o 0 56.7    34.2  ?     ?   253.039   -59.4591     58.5098    -59.4591     182.062    120.541      
1 1 1 -37 5  24 < 0 -0.8    8.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 5  23 o 0 10.1    9     ?     ?   95.7867   -72.5941     19.6749    -72.5941     62.6237    107.406      
1 1 1 -37 5  22 o 0 -8.9    7.5   ?     ?   13.0075   -32.2246     6.45882    147.775      17.7363    147.775      
1 1 1 -37 5  21 o 0 2.7     6.6   ?     ?   36.9836   -67.9553     13.2806    112.045      46.8231    112.045      
1 1 1 -37 5  20 f 1 89.3    6.5   ?     ?   116.063   94.0538      274.185    94.0538      163.546    94.0538      
1 1 1 -37 5  19 o 0 13.1    5.1   ?     ?   71.6644   -1.85633     6.39733    -1.85633     61.7377    178.144      
1 1 1 -37 5  18 o 0 89.6    5.2   ?     ?   205.078   -27.7641     207.09     -27.7641     25.7573    -27.7641     
1 1 1 -37 5  17 o 0 30.4    3.5   ?     ?   205.948   -30.8684     27.587     -30.8684     154.576    149.132      
1 1 1 -37 5  16 o 0 320.8   7.9   ?     ?   470.586   8.02409      373.997    8.02409      44.2614    -171.976     
1 1 1 -37 5  15 o 0 17.8    3.1   ?     ?   101.26    42.0428      6.57162    42.0428      86.4813    -137.957     
1 1 1 -37 5  14 o 0 14.9    2.8   ?     ?   75.5437   -53.0022     12.9762    126.998      84.1207    126.998      
1 1 1 -37 5  13 o 0 37      3     ?     ?   108.771   -86.2199     42.7614    -86.2199     62.2513    93.7801      
1 1 1 -37 5  12 o 0 66.4    3     ?     ?   186.406   -124.758     121.376    -124.758     59.8117    55.2418      
1 1 1 -37 5  11 o 0 475.3   10.6  ?     ?   261.992   128.652      621.973    128.652      395.007    128.652      
1 1 1 -37 5  10 f 1 591.6   13    ?     ?   414.635   -73.6885     617.889    -73.6885     254.718    -73.6885     
1 1 1 -37 5  9  o 0 212.5   6     ?     ?   205.133   -101.922     334.329    -101.922     156.166    -101.922     
1 1 1 -37 5  8  o 0 225     5.1   ?     ?   338.805   72.0924      280.335    72.0924      15.3934    -107.908     
1 1 1 -37 5  7  o 0 47.7    2     ?     ?   92.7518   -106.614     19.331     -106.614     61.9972    73.3859      
1 1 1 -37 5  6  o 0 53.2    2     ?     ?   170.39    93.2666      11.0194    93.2666      142.196    -86.7334     
1 1 1 -37 5  5  o 0 672.1   16    ?     ?   521.565   162.019      596.15     162.019      125.4      162.019      
1 1 1 -37 5  4  o 0 1304.7  26.8  ?     ?   693.446   31.7471      890.27     31.7471      262.283    31.7471      
1 1 1 -37 5  3  f 1 492.9   12.6  ?     ?   350.899   60.4249      572.148    60.4249      251.786    60.4249      
1 1 1 -37 5  2  o 0 13.2    1.4   ?     ?   300.917   -80.9691     198.631    99.0309      472.673    99.0309      
1 1 1 -37 5  1  o 0 309.5   7.9   ?     ?   619.514   175.713      159.818    175.713      405.646    -4.28715     
1 1 1 37  5  0  o 0 397.7   8.8   ?     ?   414.957   133.05       432.14     133.05       51.6387    133.05       
1 1 1 37  5  1  o 0 1994.6  35.8  ?     ?   703.417   -41.0171     1265.77    -41.0171     619.688    -41.0171     
1 1 1 37  5  2  o 0 624.9   12.5  ?     ?   400.7     -92.7216     665.263    -92.7216     296.719    -92.7216     
1 1 1 37  5  3  f 1 372.4   8.5   ?     ?   384.22    -2.86179     427.973    -2.86179     72.3933    -2.86179     
1 1 1 37  5  4  o 0 45.2    4.3   ?     ?   310.668   84.5922      76.7519    -95.4078     362.997    -95.4078     
1 1 1 37  5  5  o 0 45.1    5.2   ?     ?   234.298   -179.429     35.3293    0.570609     251.283    0.570609     
1 1 1 37  5  6  o 0 332.5   10.9  ?     ?   202.124   -102.98      491.509    -102.98      305.22     -102.98      
1 1 1 37  5  7  o 0 1908.3  38.2  ?     ?   1036.44   -41.7911     951.961    -41.7911     17.0693    -41.7911     
1 1 1 37  5  8  o 0 131.5   7.3   ?     ?   112.071   106.745      192.964    106.745      91.9666    106.745      
1 1 1 37  5  9  o 0 135.1   8.3   ?     ?   262.913   41.9401      188.531    41.9401      48.0781    -138.06      
1 1 1 37  5  10 f 1 101.3   9     ?     ?   310.999   -25.8013     101.961    -25.8013     181.301    154.199      
1 1 1 37  5  11 o 0 43.1    8.7   ?     ?   164.379   25.2472      24.2386    25.2472      124.366    -154.753     
1 1 1 37  5  12 o 0 114.8   9.4   ?     ?   125.047   -116.103     272.028    -116.103     144.746    -116.103     
1 1 1 37  5  13 o 0 68.6    10.5  ?     ?   205.058   164.778      141.798    164.778      62.6053    -15.2219     
1 1 1 37  5  14 o 0 248.4   13.7  ?     ?   351.394   118.661      381.761    118.661      32.8123    118.661      
1 1 1 37  5  15 o 0 177.4   14.7  ?     ?   321.932   11.2104      298.495    11.2104      14.5202    -168.79      
1 1 1 37  5  16 o 0 434.8   19.2  ?     ?   475.885   16.8998      530.267    16.8998      81.2109    16.8998      
1 1 1 37  5  17 o 0 11.5    15    ?     ?   180.173   -98.9564     39.6275    81.0436      209.4      81.0436      
1 1 1 37  5  18 o 0 127.8   19.9  ?     ?   171.313   48.4311      325.256    48.4311      163.332    48.4311      
1 1 1 37  5  19 o 0 36.6    21.4  ?     ?   100.421   48.002       104.298    48.002       1.88707    48.002       
1 1 1 37  5  20 f 1 38.9    23.6  ?     ?   210.767   107.128      40.5583    107.128      168.418    -72.8721     
1 1 1 37  5  21 o 0 6       27.1  ?     ?   100.533   125.309      45.7645    125.309      50.6667    -54.6907     
1 1 1 37  5  22 o 0 -23.2   25.3  ?     ?   59.8804   18.6549      14.7822    18.6549      41.4923    -161.345     
1 1 1 -37 7  22 < 0 26.5    7.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 7  21 o 0 14      7.1   ?     ?   77.7144   30.8877      31.3088    30.8877      34.924     -149.112     
1 1 1 -37 7  20 o 0 71.7    7     ?     ?   195.602   32.8333      179.735    32.8333      9.00534    32.8333      
1 1 1 -37 7  19 o 0 -2.7    6.4   ?     ?   36.4442   69.0324      20.0129    -110.968     52.8364    -110.968     
1 1 1 -37 7  18 o 0 77.9    6.1   ?     ?   163.569   -10.0041     210.155    -10.0041     57.3426    -10.0041     
1 1 1 -37 7  17 o 0 17.8    4.2   ?     ?   146.396   -164.323     7.70789    -164.323     125.628    15.6774      
1 1 1 -37 7  16 o 0 128.8   5.1   ?     ?   280.33    153.647      230.211    153.647      13.3764    -26.3534     
1 1 1 -37 7  15 o 0 15.6    3.3   ?     ?   153.762   -145.634     13.2755    34.3656      148.021    34.3656      
1 1 1 -37 7  14 o 0 22.2    2.9   ?     ?   127.345   29.4726      30.9786    29.4726      81.0932    -150.527     
1 1 1 -37 7  13 o 0 22.4    2.7   ?     ?   140.906   -33.4923     17.1509    -33.4923     110.985    146.508      
1 1 1 -37 7  12 o 0 983.3   18.4  ?     ?   733.701   -39.0803     723.821    -39.0803     40.4432    -39.0803     
1 1 1 -37 7  11 o 0 372.6   8.3   ?     ?   499.854   -64.0013     392.54     -64.0013     76.131     115.999      
1 1 1 -37 7  10 o 0 144.6   4.1   ?     ?   351.365   -70.8846     178.695    -70.8846     158.685    109.115      
1 1 1 -37 7  9  f 1 558.6   11.2  ?     ?   485.355   -33.3927     594.44     -33.3927     123.316    -33.3927     
1 1 1 -37 7  8  o 0 36.8    4.8   ?     ?   190.416   -65.679      4.99441    114.321      168.719    114.321      
1 1 1 -37 7  7  o 0 49.1    4.9   ?     ?   61.3898   165.961      33.0708    165.961      19.9698    -14.0394     
1 1 1 -37 7  6  o 0 58.9    4.7   ?     ?   38.8239   155.933      33.5288    155.933      0.162998   -24.0671     
1 1 1 -37 7  5  o 0 427.2   12.9  ?     ?   639.19    62.3043      282.211    62.3043      269.861    -117.696     
1 1 1 -37 7  4  o 0 178.3   8.2   ?     ?   451.894   -50.0761     125.762    -50.0761     265.933    129.924      
1 1 1 -37 7  3  o 0 371.9   13.1  ?     ?   358.956   164.365      445.733    164.365      133.613    164.365      
1 1 1 -37 7  2  o 0 168.5   8.9   ?     ?   198.931   153.368      267.865    153.368      94.4137    153.368      
1 1 1 -37 7  1  o 0 165.2   4.6   ?     ?   455.118   -91.73       103.307    -91.73       294.455    88.27        
1 1 1 37  7  0  o 0 272     6.6   ?     ?   620.466   104.861      125.684    104.861      421.081    -75.1388     
1 1 1 37  7  1  o 0 94.8    4.4   ?     ?   136.958   149.513      129.362    149.513      8.49652    149.513      
1 1 1 37  7  2  o 0 190.8   5.8   ?     ?   482.13    -149.727     124.229    -149.727     301.727    30.2732      
1 1 1 37  7  3  o 0 185     6.2   ?     ?   209.686   168.098      296.026    168.098      110.628    168.098      
1 1 1 37  7  4  o 0 1323.9  25.5  ?     ?   725.883   -152.509     888.324    -152.509     246.255    -152.509     
1 1 1 37  7  5  o 0 7.8     4.8   ?     ?   88.3611   -147.485     58.3253    32.5154      137.17     32.5154      
1 1 1 37  7  6  o 0 150.3   8.3   ?     ?   457.418   35.6949      82.742     35.6949      325.255    -144.305     
1 1 1 37  7  7  o 0 684.4   15.4  ?     ?   511.302   142.842      632.861    142.842      177.173    142.842      
1 1 1 37  7  8  o 0 22.8    6.4   ?     ?   171.971   9.08215      50.0179    -170.918     203.092    -170.918     
1 1 1 37  7  9  f 1 125.6   8.2   ?     ?   315.289   18.0756      177.109    18.0756      140.85     -161.924     
1 1 1 37  7  10 o 0 336.9   12.3  ?     ?   298.186   -65.0399     535.45     -65.0399     236.927    -65.0399     
1 1 1 37  7  11 o 0 95.6    9.9   ?     ?   245.979   -17.7283     181.451    -17.7283     59.8668    162.272      
1 1 1 37  7  12 o 0 70.5    9.4   ?     ?   238.227   -99.313      132.205    -99.313      96.8888    80.687       
1 1 1 37  7  13 o 0 220.8   14.4  ?     ?   238.321   -107.603     438.355    -107.603     209.993    -107.603     
1 1 1 37  7  14 o 0 10.5    14.7  ?     ?   156.147   -175.139     29.8804    4.86104      175.186    4.86104      
1 1 1 37  7  15 o 0 43.3    15.9  ?     ?   90.5522   96.2724      114.528    96.2724      30.3276    96.2724      
1 1 1 37  7  16 o 0 183.7   19.5  ?     ?   256.134   83.7937      363.024    83.7937      123.966    83.7937      
1 1 1 37  7  17 o 0 130.1   22.6  ?     ?   217.63    143.841      296.899    143.841      77.6031    143.841      
1 1 1 37  7  18 o 0 43.5    22.5  ?     ?   67.7734   -125.035     132.448    -125.035     64.048     -125.035     
1 1 1 37  7  19 o 0 139.4   23.7  ?     ?   244.289   1.88         296.387    1.88         59.6442    1.88         
1 1 1 37  7  20 o 0 99.8    28.1  ?     ?   195.651   -11.918      241.93     -11.918      59.9308    -11.918      
1 1 1 37  7  21 o 0 47.1    30.5  ?     ?   16.6774   -43.9502     76.9985    -43.9502     61.5612    -43.9502     
1 1 1 -37 9  20 < 0 -0.5    6     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 9  19 o 0 60.3    6.2   ?     ?   180.085   -158.485     161.239    -158.485     10.0046    -158.485     
1 1 1 -37 9  18 o 0 14.2    4.6   ?     ?   62.3822   87.6152      28.89      87.6152      24.7306    -92.3848     
1 1 1 -37 9  17 o 0 36.8    5.8   ?     ?   84.0838   21.563       125.753    21.563       51.2213    21.563       
1 1 1 -37 9  16 o 0 5.9     5.3   ?     ?   86.2222   111.9        30.128     -68.1005     109.951    -68.1005     
1 1 1 -37 9  15 o 0 45.8    3.9   ?     ?   58.4647   -72.4624     135.98     -72.4624     81.7845    -72.4624     
1 1 1 -37 9  14 o 0 74.4    3.6   ?     ?   204.705   -58.7582     165.758    -58.7582     10.5042    121.242      
1 1 1 -37 9  13 o 0 285.7   7     ?     ?   372.557   -84.2978     396.34     -84.2978     75.8289    -84.2978     
1 1 1 -37 9  12 f 1 117.8   4.4   ?     ?   220.076   -51.0869     252.405    -51.0869     60.69      -51.0869     
1 1 1 -37 9  11 o 0 208.9   5.4   ?     ?   300.736   -91.364      352.463    -91.364      90.9978    -91.364      
1 1 1 -37 9  10 o 0 122.4   3.6   ?     ?   120.498   159.064      312.602    159.064      204.468    159.064      
1 1 1 -37 9  9  o 0 88.3    3.3   ?     ?   290.717   -168.702     129.525    -168.702     132.933    11.2981      
1 1 1 -37 9  8  o 0 34.7    5     ?     ?   122.1     57.9761      57.8995    57.9761      54.8278    -122.024     
1 1 1 -37 9  7  o 0 412.5   13.8  ?     ?   420.941   -98.3263     502.816    -98.3263     112.206    -98.3263     
1 1 1 -37 9  6  o 0 137.9   6.7   ?     ?   305.185   -106.321     215.812    -106.321     68.7004    73.679       
1 1 1 -37 9  5  o 0 189.3   8.5   ?     ?   277.914   88.8846      316.208    88.8846      51.4062    88.8846      
1 1 1 -37 9  4  o 0 10      5.4   ?     ?   14.31     58.3049      7.7986     -121.695     21.4848    -121.695     
1 1 1 -37 9  3  o 0 252.7   11.8  ?     ?   107.546   31.9964      497.669    31.9964      394.469    31.9964      
1 1 1 -37 9  2  o 0 717.5   24.8  ?     ?   504.151   25.6465      720.752    25.6465      235.568    25.6465      
1 1 1 -37 9  1  o 0 15.5    2.2   ?     ?   80.5212   -117.766     25.8218    62.2341      103.506    62.2341      
1 1 1 37  9  0  o 0 276.3   6.8   ?     ?   311.751   133.679      431.052    133.679      126.324    133.679      
1 1 1 37  9  1  o 0 50.8    3.3   ?     ?   225.208   -33.2878     50.1772    -33.2878     170.222    146.712      
1 1 1 37  9  2  o 0 58.9    4.3   ?     ?   39.4972   -122.555     59.8049    -122.555     21.1187    -122.555     
1 1 1 37  9  3  o 0 57.3    4.9   ?     ?   163.31    121.357      103.851    121.357      56.1801    -58.6426     
1 1 1 37  9  4  o 0 51.4    4.7   ?     ?   209.113   6.56         62.1683    6.56         142.762    -173.44      
1 1 1 37  9  5  o 0 159.3   7.4   ?     ?   242.757   -54.8439     315.243    -54.8439     81.5705    -54.8439     
1 1 1 37  9  6  o 0 89.3    7.2   ?     ?   246.023   103.849      163.065    103.849      73.5761    -76.1513     
1 1 1 37  9  7  o 0 135.2   7.7   ?     ?   268.099   128.35       247.65     128.35       9.92296    -51.6504     
1 1 1 37  9  8  o 0 161.3   10    ?     ?   269.942   -11.9736     306.159    -11.9736     51.5583    -11.9736     
1 1 1 37  9  9  o 0 71.8    10.2  ?     ?   193.983   -49.8056     165.24     -49.8056     17.3428    130.194      
1 1 1 37  9  10 o 0 -7.2    10.3  ?     ?   163.531   -7.51778     98.935     172.482      248.647    172.482      
1 1 1 37  9  11 o 0 49.5    12    ?     ?   119.497   -38.0274     141.788    -38.0274     32.714     -38.0274     
1 1 1 37  9  12 f 1 -12.2   11.6  ?     ?   44.5336   -31.726      25.181     148.274      66.0525    148.274      
1 1 1 37  9  13 o 0 181.4   18    ?     ?   379.087   -47.0043     249.678    -47.0043     98.128     132.996      
1 1 1 37  9  14 o 0 56.2    15.8  ?     ?   75.6667   60.6258      174.571    60.6258      102.105    60.6258      
1 1 1 37  9  15 o 0 109.2   19.1  ?     ?   164.496   -44.1999     290.866    -44.1999     128.532    -44.1999     
1 1 1 37  9  16 o 0 208.7   19.5  ?     ?   264.576   -12.5239     397.189    -12.5239     135.515    -12.5239     
1 1 1 37  9  17 o 0 105.5   26.7  ?     ?   133.983   23.2625      286.97     23.2625      159.65     23.2625      
1 1 1 37  9  18 o 0 109.1   29.1  ?     ?   220.239   165.47       237.37     165.47       36.3617    165.47       
1 1 1 37  9  19 o 0 -18.5   31.8  ?     ?   82.9073   135.674      44.1535    135.674      31.1854    -44.326      
1 1 1 -37 11 18 < 0 -0.5    5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 11 17 o 0 4.6     5.1   ?     ?   63.3036   127.881      6.9177     -52.1193     58.9421    -52.1193     
1 1 1 -37 11 16 o 0 28.4    4.6   ?     ?   91.5828   -131.275     103.726    -131.275     27.914     -131.275     
1 1 1 -37 11 15 o 0 43.8    4.4   ?     ?   202.808   -33.0336     90.1372    -33.0336     81.5043    146.966      
1 1 1 -37 11 14 o 0 142.9   5.9   ?     ?   237.033   -19.935      291.125    -19.935      84.4851    -19.935      
1 1 1 -37 11 13 o 0 86.4    4.3   ?     ?   235.752   -131.87      170.836    -131.87      43.5748    48.1298      
1 1 1 -37 11 12 o 0 78.6    3.9   ?     ?   98.7591   123.754      247.308    123.754      156.801    123.754      
1 1 1 -37 11 11 o 0 117.2   4.4   ?     ?   270.358   100.775      211.821    100.775      35.8686    -79.2254     
1 1 1 -37 11 10 o 0 55.7    2.8   ?     ?   195.011   99.643       120.505    99.643       45.1842    -80.357      
1 1 1 -37 11 9  o 0 80.7    3.2   ?     ?   194.759   169.575      186.996    169.575      20.4866    169.575      
1 1 1 -37 11 8  o 0 47.9    2.7   ?     ?   130.085   -91.0353     129.695    -91.0353     18.8075    -91.0353     
1 1 1 -37 11 7  o 0 41.8    2.9   ?     ?   96.7122   -18.7888     114.892    -18.7888     32.0134    -18.7888     
1 1 1 -37 11 6  o 0 11.9    2.5   ?     ?   196.425   108.924      60.5881    -71.0756     229.101    -71.0756     
1 1 1 -37 11 5  f 1 75.7    3.4   ?     ?   184.202   -85.3553     181.16     -85.3553     21.6211    -85.3553     
1 1 1 -37 11 4  o 0 125     4.2   ?     ?   141.268   5.31012      316.237    5.31012      194.028    5.31012      
1 1 1 -37 11 3  o 0 286.9   9.1   ?     ?   435.303   37.5932      351.59     37.5932      26.3069    -142.407     
1 1 1 -37 11 2  o 0 91.3    4.4   ?     ?   251.758   102.301      174.078    102.301      45.1496    -77.6993     
1 1 1 -37 11 1  o 0 98.7    4.7   ?     ?   313.628   -108.236     133.745    -108.236     147.069    71.7642      
1 1 1 37  11 0  o 0 45.1    3.6   ?     ?   82.162    115.857      111.574    115.857      36.6269    115.857      
1 1 1 37  11 1  o 0 269.9   7.8   ?     ?   392.075   -81.652      363.544    -81.652      5.56356    -81.652      
1 1 1 37  11 2  o 0 229.5   7.3   ?     ?   408.782   -40.8046     302.652    -40.8046     61.4904    139.195      
1 1 1 37  11 3  o 0 28      5     ?     ?   112.024   -104.513     61.3307    -104.513     38.4751    75.4867      
1 1 1 37  11 4  o 0 220.5   9.8   ?     ?   248.439   89.8085      419.493    89.8085      198.205    89.8085      
1 1 1 37  11 5  f 1 237.7   10.1  ?     ?   283.691   111.922      416.169    111.922      162.35     111.922      
1 1 1 37  11 6  o 0 259.3   9.4   ?     ?   254.376   155.736      471.09     155.736      244.057    155.736      
1 1 1 37  11 7  o 0 202.4   9.3   ?     ?   317.678   172.934      334.757    172.934      51.6551    172.934      
1 1 1 37  11 8  o 0 35.6    8.2   ?     ?   229.929   131.604      29.4345    131.604      175.069    -48.3964     
1 1 1 37  11 9  o 0 76.6    11    ?     ?   179.85    -107.003     192.779    -107.003     31.8031    -107.003     
1 1 1 37  11 10 o 0 364.7   15.6  ?     ?   367.275   -58.7467     521.276    -58.7467     165.44     -58.7467     
1 1 1 37  11 11 o 0 286.3   16.5  ?     ?   275.372   -51.7011     500.085    -51.7011     234.17     -51.7011     
1 1 1 37  11 12 o 0 42      13.9  ?     ?   24.9236   -8.69573     73.4868    -8.69573     49.3294    -8.69573     
1 1 1 37  11 13 o 0 3       17.9  ?     ?   163.811   -24.5553     31.8871    155.445      184.671    155.445      
1 1 1 37  11 14 o 0 141.9   18.8  ?     ?   187.186   29.698       344.046    29.698       173.897    29.698       
1 1 1 37  11 15 o 0 45.4    20.8  ?     ?   101.675   139.835      145.289    139.835      54.5385    139.835      
1 1 1 37  11 16 o 0 23      23.8  ?     ?   76.3946   -129.13      94.2338    -129.13      26.2735    -129.13      
1 1 1 37  11 17 < 0 204.5   28.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 13 14 < 1 72.7    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 13 13 o 0 22.1    5.2   ?     ?   90.3409   -26.2995     83.9895    -26.2995     10.9288    -26.2995     
1 1 1 -37 13 12 o 0 40.1    4.9   ?     ?   145.475   -18.902      119.243    -18.902      0.933453   -18.902      
1 1 1 -37 13 11 f 1 123.7   6     ?     ?   224.466   -20.9866     266.57     -20.9866     81.7234    -20.9866     
1 1 1 -37 13 10 f 1 71.8    4.8   ?     ?   127.988   13.1853      217.045    13.1853      109.514    13.1853      
1 1 1 -37 13 9  o 0 -4      3.6   ?     ?   29.6312   24.2232      21.1604    -155.777     46.6188    -155.777     
1 1 1 -37 13 8  o 0 26.3    4.1   ?     ?   158.504   137.476      51.0224    137.476      85.9763    -42.5238     
1 1 1 -37 13 7  o 0 45.6    4.3   ?     ?   167.087   173.364      111.267    173.364      39.0089    -6.63649     
1 1 1 -37 13 6  o 0 30.6    4.2   ?     ?   119.778   33.2831      86.9539    33.2831      21.3179    -146.717     
1 1 1 -37 13 5  o 0 40.7    4.1   ?     ?   41.6188   -165.037     107.361    -165.037     69.5675    -165.037     
1 1 1 -37 13 4  o 0 93.7    5.3   ?     ?   118.79    87.6483      268.17     87.6483      160.657    87.6483      
1 1 1 -37 13 3  o 0 6.7     4.3   ?     ?   19.3498   -93.0242     6.24699    86.9758      23.8244    86.9758      
1 1 1 -37 13 2  f 1 105.7   8     ?     ?   129.013   -116.677     290.343    -116.677     172.163    -116.677     
1 1 1 -37 13 1  o 0 27.8    4.5   ?     ?   106.748   -106.982     75.1702    -106.982     22.3852    73.0178      
1 1 1 37  13 0  o 0 6       4.2   ?     ?   104.476   -71.953      46.7629    108.047      144.609    108.047      
1 1 1 37  13 1  o 0 2.8     5.5   ?     ?   21.4217   93.4373      10.7305    -86.5627     30.806     -86.5627     
1 1 1 37  13 2  f 1 105.7   8.3   ?     ?   202.202   -71.4944     246.459    -71.4944     55.9394    -71.4944     
1 1 1 37  13 3  o 0 439.4   15.3  ?     ?   436.965   -79.4549     526.243    -79.4549     116.69     -79.4549     
1 1 1 37  13 4  o 0 39.4    7.6   ?     ?   231.546   -88.1846     41.7429    -88.1846     176.784    91.8154      
1 1 1 37  13 5  o 0 40.3    8.3   ?     ?   159.927   167.664      101.265    167.664      49.521     -12.336      
1 1 1 37  13 6  o 0 46.2    10.7  ?     ?   131.765   59.0808      138.546    59.0808      14.4874    59.0808      
1 1 1 37  13 7  o 0 9.6     12.1  ?     ?   264.643   -69.8366     109.547    110.163      349.879    110.163      
1 1 1 37  13 8  o 0 203.1   15.7  ?     ?   377.52    -89.4433     283.154    -89.4433     58.9041    90.5567      
1 1 1 37  13 9  o 0 369.9   16.5  ?     ?   386.442   -119.347     506.192    -119.347     164.284    -119.347     
1 1 1 37  13 10 f 1 140.5   15.5  ?     ?   183.598   -101.732     336.372    -101.732     173.613    -101.732     
1 1 1 37  13 11 f 1 106.8   16.2  ?     ?   211.675   -36.912      248.291    -36.912      63.7585    -36.912      
1 1 1 37  13 12 o 0 52.6    16.7  ?     ?   111.542   18.7153      174.68     18.7153      78.1139    18.7153      
1 1 1 37  13 13 < 0 36.9    22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 37  13 14 < 1 17.7    24.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 15 8  < 0 18.7    6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 15 7  < 0 0.8     5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 15 6  < 0 14      5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -37 15 5  f 1 10.5    6     ?     ?   81.1218   -57.5914     20.3948    -57.5914     44.9989    122.409      
1 1 1 -37 15 4  o 0 11.6    6.6   ?     ?   134.584   -166.895     2.37085    -166.895     106.031    13.1054      
1 1 1 -37 15 3  f 1 20.5    6.6   ?     ?   177.745   167.31       19.8696    167.31       124.589    -12.6901     
1 1 1 -37 15 2  f 1 167.6   11.5  ?     ?   214.276   156.159      347.336    156.159      172.593    156.159      
1 1 1 -37 15 1  o 0 -0.7    8.6   ?     ?   33.2769   144.201      1.67036    -35.7993     28.749     -35.7993     
1 1 1 37  15 0  o 0 22.2    9.9   ?     ?   97.4048   -163.2       75.5434    -163.2       6.1696     16.7999      
1 1 1 37  15 1  o 0 5.9     8.9   ?     ?   65.3194   -15.6708     11.6143    -15.6708     43.204     164.329      
1 1 1 37  15 2  f 1 46      8.3   ?     ?   116.848   63.719       163.009    63.719       64.4429    63.719       
1 1 1 37  15 3  f 1 63.6    11.1  ?     ?   139.83    135.322      197.228    135.322      79.3268    135.322      
1 1 1 37  15 4  o 0 83.1    10.9  ?     ?   249.383   161.074      165.893    161.074      43.1257    -18.9259     
1 1 1 37  15 5  f 1 107.1   13.8  ?     ?   246.334   -149.635     217.829    -149.635     10.5702    -149.635     
1 1 1 37  15 6  < 0 29.4    12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 37  15 7  < 0 31.2    12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 37  15 8  < 0 5       17.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 0  25 < 0 24.3    10.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 0  24 o 0 191.3   13.3  ?     ?   300.261   180          309.253    180          46.1038    180          
1 1 1 -38 0  23 o 0 -9.3    7.1   ?     ?   9.90874   0            0.660455   0            8.21516    180          
1 1 1 -38 0  22 o 0 92.9    12.7  ?     ?   155.452   0            218.579    0            74.8681    0            
1 1 1 -38 0  21 o 0 22.8    6.7   ?     ?   116.693   0            88.9944    0            23.7726    180          
1 1 1 -38 0  20 o 0 553.8   17.2  ?     ?   471.604   0            550.711    0            109.62     0            
1 1 1 -38 0  19 o 0 15.6    5.5   ?     ?   51.6216   0            24.9079    0            21.1649    180          
1 1 1 -38 0  18 o 0 12.5    4.9   ?     ?   114.225   180          38.34      180          64.1122    4.19609e-15  
1 1 1 -38 0  17 o 0 153.3   6.5   ?     ?   250.699   180          283.799    180          51.2887    180          
1 1 1 -38 0  16 o 0 55      5.7   ?     ?   58.8917   0            81.6448    0            25.6641    0            
1 1 1 -38 0  15 o 0 3.6     4.2   ?     ?   76.3287   0            5.45183    0            67.637     180          
1 1 1 -38 0  14 f 1 271.6   9.2   ?     ?   110.304   180          362.333    180          253.538    180          
1 1 1 -38 0  13 o 0 65.3    4.5   ?     ?   251.737   0            152.141    0            68.0438    180          
1 1 1 -38 0  12 o 0 404.8   12.3  ?     ?   291.733   180          424.203    180          167.512    180          
1 1 1 -38 0  11 o 0 61.1    3.8   ?     ?   332.903   180          149.445    180          142.532    7.35703e-15  
1 1 1 -38 0  10 o 0 1037.6  37.6  ?     ?   482.441   0            686.277    0            260.988    0            
1 1 1 -38 0  9  o 0 179.7   9     ?     ?   438.485   180          285.41     180          111.204    1.80087e-14  
1 1 1 -38 0  8  o 0 107     6.1   ?     ?   344.358   0            210.302    0            102.51     180          
1 1 1 -38 0  7  o 0 1400.9  35.4  ?     ?   533.542   180          808.274    180          315.815    180          
1 1 1 -38 0  6  o 0 196.6   7.3   ?     ?   492.498   0            295.305    0            148.916    180          
1 1 1 -38 0  5  f 1 3352.5  80.5  ?     ?   900.315   0            1225.59    0            406.68     0            
1 1 1 -38 0  4  o 0 78.8    3.6   ?     ?   256.427   180          153.445    180          79.2978    1.35777e-14  
1 1 1 -38 0  3  o 0 5788.3  137   ?     ?   1398.14   180          1619.15    180          346.666    180          
1 1 1 -38 0  2  o 0 1929    48.7  ?     ?   978.136   180          937.573    180          45.1245    180          
1 1 1 -38 0  1  o 0 33.7    5.3   ?     ?   68.876    180          24.0831    180          38.9018    4.34386e-15  
1 1 1 38  0  0  o 0 1872.3  46.8  ?     ?   970.481   180          927.702    180          38.4137    -180         
1 1 1 38  0  1  o 0 342.3   14.6  ?     ?   385.502   180          396.639    180          42.7492    180          
1 1 1 38  0  2  o 0 48.8    4.2   ?     ?   64.6273   0            33.2461    0            26.1744    180          
1 1 1 38  0  3  o 0 0.8     5.9   ?     ?   26.1259   180          0.606517   180          23.4455    1.81517e-16  
1 1 1 38  0  4  o 0 551.9   19.9  ?     ?   528.219   0            506.453    0            19.6845    0            
1 1 1 38  0  5  f 1 5       5.9   ?     ?   106.039   180          4.14934    180          94.1343    3.09289e-16  
1 1 1 38  0  6  o 0 2025.5  59.4  ?     ?   720.42    180          997.078    180          314.642    180          
1 1 1 38  0  7  o 0 61.6    9     ?     ?   148.303   180          90.2609    180          48.5263    1.30514e-14  
1 1 1 38  0  8  o 0 3786.3  143.1 ?     ?   1080.63   0            1359.34    0            348.585    0            
1 1 1 38  0  9  o 0 469.4   27.3  ?     ?   554.494   0            478.669    0            39.4671    180          
1 1 1 38  0  10 o 0 183.4   19.9  ?     ?   395.849   180          296.337    180          65.3337    3.1826e-14   
1 1 1 38  0  11 o 0 1277.1  37    ?     ?   832.647   180          787.71     180          28.3921    180          
1 1 1 38  0  12 o 0 239.6   17.5  ?     ?   333.522   0            339.328    0            33.2382    0            
1 1 1 38  0  13 o 0 179.7   15.3  ?     ?   267.006   180          289.687    180          45.3336    180          
1 1 1 38  0  14 f 1 140.5   18.6  ?     ?   155.494   180          271.355    180          110.387    180          
1 1 1 38  0  15 o 0 70.1    20.2  ?     ?   317.649   0            194.31     0            125.922    180          
1 1 1 38  0  16 o 0 84.2    40.5  ?     ?   128.491   0            165.558    0            38.7209    0            
1 1 1 38  0  17 o 0 133.7   25.3  ?     ?   132.878   180          269.667    180          142.359    180          
1 1 1 38  0  18 o 0 261.1   26.2  ?     ?   345.203   0            386.828    0            56.5329    0            
1 1 1 38  0  19 o 0 144.7   31.5  ?     ?   173.618   0            278.066    0            111.412    0            
1 1 1 38  0  20 o 0 28.4    36.2  ?     ?   68.1587   0            56.9971    0            13.6042    180          
1 1 1 38  0  21 o 0 15.7    38.5  ?     ?   59.1105   0            45.0678    0            16.2314    180          
1 1 1 38  0  22 o 0 307.8   41.1  ?     ?   442.19    0            422.184    0            8.794      180          
1 1 1 -38 2  24 f 1 21.2    7.3   ?     ?   97.8919   137.937      76.3935    137.937      9.07251    -42.063      
1 1 1 -38 2  23 o 0 62.4    6.5   ?     ?   134.395   157.028      206.137    157.028      88.3437    157.028      
1 1 1 -38 2  22 o 0 32.5    5.3   ?     ?   231.204   -152.913     24.1851    -152.913     187.79     27.0873      
1 1 1 -38 2  21 o 0 126.7   6.1   ?     ?   137.759   -72.2176     348.217    -72.2176     216.15     -72.2176     
1 1 1 -38 2  20 o 0 140.5   5.7   ?     ?   216.663   -74.4787     316.047    -74.4787     107.825    -74.4787     
1 1 1 -38 2  19 o 0 52.5    4.2   ?     ?   213.443   -53.2902     103.281    -53.2902     87.4835    126.71       
1 1 1 -38 2  18 o 0 91.3    4.6   ?     ?   140.523   -47.5119     251.43     -47.5119     126.271    -47.5119     
1 1 1 -38 2  17 o 0 59.2    3.9   ?     ?   139.596   11.296       157.34     11.296       28.7354    11.296       
1 1 1 -38 2  16 o 0 99.3    3.9   ?     ?   276.218   -70.6542     171.301    -70.6542     85.2379    109.346      
1 1 1 -38 2  15 o 0 576.1   11.5  ?     ?   581.54    -60.1255     540.964    -60.1255     12.5335    119.875      
1 1 1 -38 2  14 o 0 309.7   6.6   ?     ?   412.536   -4.79374     387.755    -4.79374     14.7437    175.206      
1 1 1 -38 2  13 o 0 108     3.5   ?     ?   276.169   99.7867      136.604    99.7867      103.646    -80.2133     
1 1 1 -38 2  12 o 0 389.2   8.5   ?     ?   297.244   -84.9866     517.6      -84.9866     257.393    -84.9866     
1 1 1 -38 2  11 o 0 432.9   9     ?     ?   687.577   172.516      251.201    172.516      348.959    -7.48406     
1 1 1 -38 2  10 o 0 359.8   11    ?     ?   280.76    -137.612     489.365    -137.612     242.98     -137.612     
1 1 1 -38 2  9  o 0 93      3     ?     ?   156.458   45.0597      106.391    45.0597      34.5273    -134.94      
1 1 1 -38 2  8  f 1 787.2   14.6  ?     ?   526.207   161.324      683.136    161.324      204.587    161.324      
1 1 1 -38 2  7  o 0 1147.1  20.7  ?     ?   732.873   -136.835     762.392    -136.835     96.5465    -136.835     
1 1 1 -38 2  6  o 0 1080.3  22.8  ?     ?   688.075   -159.378     753.108    -159.378     117.997    -159.378     
1 1 1 -38 2  5  o 0 1431.5  25.6  ?     ?   738.061   -119.065     902.685    -119.065     237.05     -119.065     
1 1 1 -38 2  4  o 0 851     18.4  ?     ?   486.029   -120.755     751.333    -120.755     311.631    -120.755     
1 1 1 -38 2  3  o 0 87      3.2   ?     ?   304.559   -114.536     39.8104    -114.536     236.496    65.4643      
1 1 1 -38 2  2  o 0 3402.9  67.7  ?     ?   1174.6    -120.934     1395.68    -120.934     327.339    -120.934     
1 1 1 -38 2  1  o 0 1363.4  36.4  ?     ?   482.719   -106.944     1090.27    -106.944     650.223    -106.944     
1 1 1 38  2  0  f 1 2038.6  42.9  ?     ?   1052.32   -102.455     943.915    -102.455     22.6386    77.5455      
1 1 1 38  2  1  o 0 393.9   9.9   ?     ?   403.856   -152.649     425.988    -152.649     56.2684    -152.649     
1 1 1 38  2  2  o 0 1096.7  22.3  ?     ?   515.23    -91.4483     906.683    -91.4483     434.26     -91.4483     
1 1 1 38  2  3  o 0 2.1     3.1   ?     ?   348.371   54.5784      298.471    -125.422     618.314    -125.422     
1 1 1 38  2  4  o 0 478.7   10.7  ?     ?   530.63    -145.733     412.219    -145.733     75.4392    34.2674      
1 1 1 38  2  5  o 0 26.8    4.4   ?     ?   407.989   -162.723     221.55     17.2772      606.866    17.2772      
1 1 1 38  2  6  o 0 898.3   20.3  ?     ?   485.692   -17.1369     825.795    -17.1369     372.46     -17.1369     
1 1 1 38  2  7  o 0 228.6   8.2   ?     ?   406.893   131.59       232.105    131.59       147.626    -48.4103     
1 1 1 38  2  8  f 1 43.8    6.3   ?     ?   223.09    -148.749     35.4197    31.2506      244.568    31.2506      
1 1 1 38  2  9  o 0 265.8   9.2   ?     ?   378.203   95.3022      321.323    95.3022      23.727     -84.6978     
1 1 1 38  2  10 o 0 394.1   12.2  ?     ?   526.479   49.1275      357.714    49.1275      121.898    -130.873     
1 1 1 38  2  11 o 0 299.3   10.8  ?     ?   237.619   38.0273      475.43     38.0273      257.499    38.0273      
1 1 1 38  2  12 o 0 124.5   10.9  ?     ?   162.829   95.4833      231.267    95.4833      82.2945    95.4833      
1 1 1 38  2  13 o 0 48.6    9.9   ?     ?   122.135   -62.2669     85.7704    -62.2669     40.0266    117.733      
1 1 1 38  2  14 o 0 237.4   12.8  ?     ?   340.59    -66.3139     366.062    -66.3139     16.4541    -66.3139     
1 1 1 38  2  15 o 0 27.9    12.2  ?     ?   204.658   -58.9504     14.9611    121.05       220.569    121.05       
1 1 1 38  2  16 o 0 97.9    14.5  ?     ?   217.951   102.911      222.707    102.911      8.33716    102.911      
1 1 1 38  2  17 o 0 283.9   22    ?     ?   322.045   125.791      478.804    125.791      171.417    125.791      
1 1 1 38  2  18 o 0 38.3    19.8  ?     ?   218.57    107.826      34.308     107.826      174.003    -72.1744     
1 1 1 38  2  19 o 0 2.3     22.1  ?     ?   80.5067   81.3959      9.54175    81.3959      67.4199    -98.6041     
1 1 1 38  2  20 o 0 144.7   28.3  ?     ?   199.284   102.647      344.953    102.647      139.408    102.647      
1 1 1 38  2  21 o 0 -17     26.2  ?     ?   127.62    121.955      13.2544    -58.0446     140.573    -58.0446     
1 1 1 38  2  22 o 0 22.3    28.3  ?     ?   110.879   -30.3239     77.9515    -30.3239     29.6123    149.676      
1 1 1 38  2  23 o 0 159.9   34.7  ?     ?   304.006   -120.409     276.828    -120.409     12.7763    59.591       
1 1 1 -38 4  24 < 0 11.1    6.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 4  23 o 0 161.8   7.9   ?     ?   203.145   -25.8535     371.469    -25.8535     195.941    -25.8535     
1 1 1 -38 4  22 o 0 8.6     6.3   ?     ?   53.6282   104.599      0.0252916  104.599      47.3448    -75.4005     
1 1 1 -38 4  21 o 0 124.6   6.7   ?     ?   202.244   59.4321      296.369    59.4321      111.955    59.4321      
1 1 1 -38 4  20 o 0 51.7    5.9   ?     ?   152.89    141.079      148.088    141.079      2.329      141.079      
1 1 1 -38 4  19 o 0 32.7    4.8   ?     ?   113.124   51.0792      93.3378    51.0792      11.0659    -128.921     
1 1 1 -38 4  18 o 0 55      4.6   ?     ?   135.039   7.92846      154.516    7.92846      35.5637    7.92846      
1 1 1 -38 4  17 o 0 292.9   7.4   ?     ?   298.325   -95.874      480.37     -95.874      216.224    -95.874      
1 1 1 -38 4  16 o 0 9.6     3.2   ?     ?   43.4611   76.8289      14.1468    -103.171     53.9462    -103.171     
1 1 1 -38 4  15 o 0 29.5    3     ?     ?   245.144   166.008      14.0271    -13.9924     240.32     -13.9924     
1 1 1 -38 4  14 o 0 263.6   7.4   ?     ?   346.837   146.039      390.728    146.039      62.6589    146.039      
1 1 1 -38 4  13 o 0 242.9   5.8   ?     ?   276.222   -126.453     408.44     -126.453     140.634    -126.453     
1 1 1 -38 4  12 o 0 89.6    3.1   ?     ?   250.892   122.88       143.601    122.88       101.263    -57.1197     
1 1 1 -38 4  11 o 0 317.1   7.4   ?     ?   213.006   -88.3733     485.894    -88.3733     300.637    -88.3733     
1 1 1 -38 4  10 o 0 44.4    2.5   ?     ?   115.298   60.0221      12.2377    60.0221      87.7401    -119.978     
1 1 1 -38 4  9  o 0 295.5   6.2   ?     ?   456.561   77.8883      285.391    77.8883      112.604    -102.112     
1 1 1 -38 4  8  o 0 20.7    1.8   ?     ?   130.037   -10.7153     52.189     169.285      166.098    169.285      
1 1 1 -38 4  7  o 0 2959.9  57.9  ?     ?   1117.61   -130.336     1290.69    -130.336     286.417    -130.336     
1 1 1 -38 4  6  o 0 50.5    2.2   ?     ?   81.4499   105.445      11.4952    105.445      61.9921    -74.5555     
1 1 1 -38 4  5  o 0 953.5   17.6  ?     ?   698.815   83.5786      661.013    83.5786      28.198     83.5786      
1 1 1 -38 4  4  o 0 1037.1  20.6  ?     ?   536.906   30.4246      857.805    30.4246      369.999    30.4246      
1 1 1 -38 4  3  o 0 446.1   9.1   ?     ?   412.438   -76.7371     482.412    -76.7371     106.583    -76.7371     
1 1 1 -38 4  2  o 0 232.5   6.3   ?     ?   283.821   1.95909      315.304    1.95909      52.859     1.95909      
1 1 1 -38 4  1  o 0 1583.6  37.1  ?     ?   731.528   43.9821      1017.85    43.9821      339.865    43.9821      
1 1 1 38  4  0  f 1 2700.4  52.2  ?     ?   981.323   97.9271      1322.13    97.9271      404.415    97.9271      
1 1 1 38  4  1  o 0 688.8   14    ?     ?   698.541   -176.161     462.361    -176.161     188.695    3.83902      
1 1 1 38  4  2  o 0 578.6   12.2  ?     ?   386.074   -125.363     632.446    -125.363     272.088    -125.363     
1 1 1 38  4  3  o 0 180.8   7.5   ?     ?   337.667   -66.0247     207.226    -66.0247     104.544    113.975      
1 1 1 38  4  4  o 0 684.4   16.7  ?     ?   321.377   -168.792     778.255    -168.792     481.276    -168.792     
1 1 1 38  4  5  o 0 124.8   5.3   ?     ?   140.299   -5.84445     171.163    -5.84445     41.4543    -5.84445     
1 1 1 38  4  6  o 0 160.1   6.1   ?     ?   90.3293   -11.897      192.108    -11.897      108.589    -11.897      
1 1 1 38  4  7  o 0 36.9    6     ?     ?   141.023   -20.5861     25.2793    159.414      155.626    159.414      
1 1 1 38  4  8  o 0 779.7   17.1  ?     ?   545.521   116.377      692.595    116.377      199.254    116.377      
1 1 1 38  4  9  o 0 187.6   8.8   ?     ?   206.548   -23.4102     307.509    -23.4102     120.946    -23.4102     
1 1 1 38  4  10 o 0 610.7   15.8  ?     ?   527.506   -20.995      568.883    -20.995      89.0577    -20.995      
1 1 1 38  4  11 o 0 84.1    9.4   ?     ?   236.063   55.603       112.019    55.603       102.241    -124.397     
1 1 1 38  4  12 o 0 97.7    10.8  ?     ?   179.121   -162.038     217.52     -162.038     34.4403    -162.038     
1 1 1 38  4  13 o 0 9.3     11    ?     ?   24.2444   170.973      12.2463    -9.02725     36.949     -9.02725     
1 1 1 38  4  14 o 0 51.3    11.6  ?     ?   250.622   40.1771      51.299     40.1771      198.697    -139.823     
1 1 1 38  4  15 o 0 29.3    13.8  ?     ?   186.284   -36.8832     16.4587    -36.8832     165.511    143.117      
1 1 1 38  4  16 o 0 46.9    16.3  ?     ?   170.744   -130.673     104.866    -130.673     57.0316    49.3274      
1 1 1 38  4  17 o 0 59.1    19.2  ?     ?   216.227   -116.576     110.221    -116.576     94.5479    63.4245      
1 1 1 38  4  18 o 0 194.3   20    ?     ?   355.576   179.149      300.649    179.149      37.1851    -0.850594    
1 1 1 38  4  19 o 0 13.5    21.5  ?     ?   84.7388   17.7667      35.7132    17.7667      51.1697    -162.233     
1 1 1 38  4  20 o 0 12.3    25.7  ?     ?   43.647    -43.9968     41.2046    -43.9968     3.59832    136.003      
1 1 1 38  4  21 o 0 15.8    23.1  ?     ?   176.843   -77.9534     8.8844     -77.9534     161.719    102.047      
1 1 1 38  4  22 o 0 94      36.2  ?     ?   113.758   0.0785515    256.253    0.0785514    148.71     0.0785514    
1 1 1 -38 6  23 < 0 43.9    9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 6  22 f 1 35.3    7.8   ?     ?   136.395   122.186      115.78     122.186      1.13529    -57.8139     
1 1 1 -38 6  21 o 0 16.8    7     ?     ?   87.3833   125.292      45.6893    125.292      29.4899    -54.7079     
1 1 1 -38 6  20 o 0 5.9     5.8   ?     ?   10.1155   -120.4       2.23547    59.5995      11.337     59.5995      
1 1 1 -38 6  19 o 0 77.6    5.7   ?     ?   225.131   -88.4562     163.226    -88.4562     48.5366    91.5438      
1 1 1 -38 6  18 o 0 193.5   6.4   ?     ?   344.528   -82.8579     293.198    -82.8579     31.5978    97.1421      
1 1 1 -38 6  17 o 0 53.5    4.1   ?     ?   106.646   37.444       163.132    37.444       69.6543    37.444       
1 1 1 -38 6  16 o 0 71.4    5     ?     ?   221.249   116.377      148.012    116.377      45.933     -63.6229     
1 1 1 -38 6  15 o 0 112.5   4.8   ?     ?   156.537   39.6402      288.082    39.6402      150.232    39.6402      
1 1 1 -38 6  14 o 0 11.6    2.7   ?     ?   123.289   105.724      33.6002    -74.2756     145.824    -74.2756     
1 1 1 -38 6  13 o 0 186.9   5.5   ?     ?   256.693   -112.833     342.727    -112.833     103.332    -112.833     
1 1 1 -38 6  12 o 0 542     11.6  ?     ?   631.422   -118.825     455.24     -118.825     137.752    61.1751      
1 1 1 -38 6  11 f 1 193.9   4.7   ?     ?   393.238   -94.8058     228.503    -94.8058     151.765    85.1942      
1 1 1 -38 6  10 o 0 60.4    2.4   ?     ?   299.598   -130.54      25.3762    -130.54      264.611    49.4602      
1 1 1 -38 6  9  o 0 294.4   6.3   ?     ?   410.15    -60.6585     320.06     -60.6585     33.5225    119.342      
1 1 1 -38 6  8  o 0 179.3   4.3   ?     ?   431.558   -4.11966     148.181    -4.11966     225.788    175.88       
1 1 1 -38 6  7  o 0 84.9    5     ?     ?   252.959   -125.066     82.3217    -125.066     136.012    54.9339      
1 1 1 -38 6  6  o 0 32.9    4.1   ?     ?   118.845   -82.0031     15.8747    97.9969      118.896    97.9969      
1 1 1 -38 6  5  o 0 456     13.2  ?     ?   370.328   148.084      525.338    148.084      203.061    148.084      
1 1 1 -38 6  4  o 0 739.3   20.7  ?     ?   654.644   -23.4757     548.107    -23.4757     23.5982    156.524      
1 1 1 -38 6  3  o 0 141     6.5   ?     ?   285.161   49.3937      182.123    49.3937      67.6866    -130.606     
1 1 1 -38 6  2  o 0 263.2   6.8   ?     ?   227.554   163.426      401.011    163.426      201.121    163.426      
1 1 1 -38 6  1  o 0 228.7   6.1   ?     ?   336.03    -167.687     275.161    -167.687     27.0104    12.3126      
1 1 1 38  6  0  f 1 526.6   11.1  ?     ?   408.245   104.314      559.383    104.314      187.84     104.314      
1 1 1 38  6  1  o 0 569     11.8  ?     ?   567.906   16.1351      471.512    16.1351      43.502     -163.865     
1 1 1 38  6  2  o 0 42.6    3.2   ?     ?   158.455   -153.842     1.47764    -153.842     139.403    26.158       
1 1 1 38  6  3  o 0 502.1   10.8  ?     ?   552.985   129.948      437.982    129.948      54.1293    -50.0524     
1 1 1 38  6  4  o 0 49.7    4.6   ?     ?   99.3719   161.128      24.212     161.128      64.2717    -18.8724     
1 1 1 38  6  5  o 0 253.3   7.7   ?     ?   538.063   -82.0342     170.516    -82.0342     308.685    97.9658      
1 1 1 38  6  6  o 0 190.9   7.7   ?     ?   284.038   8.39933      270.676    8.39933      17.7621    8.39933      
1 1 1 38  6  7  o 0 141.4   6.7   ?     ?   92.5604   -55.3401     233.162    -55.3401     150.074    -55.3401     
1 1 1 38  6  8  o 0 16      6.9   ?     ?   292.043   82.4878      156.062    -97.5122     417.938    -97.5122     
1 1 1 38  6  9  o 0 326.6   11.3  ?     ?   381.617   -67.5067     393.943    -67.5067     52.2636    -67.5067     
1 1 1 38  6  10 o 0 649.5   16.3  ?     ?   630.465   -43.7039     571.96     -43.7039     64.1373    136.296      
1 1 1 38  6  11 f 1 75.9    9.1   ?     ?   233.168   -18.9679     122.352    -18.9679     113.53     161.032      
1 1 1 38  6  12 o 0 41.2    10.8  ?     ?   124.985   35.1208      85.0544    35.1208      38.1812    -144.879     
1 1 1 38  6  13 o 0 11.7    12    ?     ?   60.8292   -88.6868     7.14455    91.3132      65.9202    91.3132      
1 1 1 38  6  14 o 0 21.5    12.5  ?     ?   147.082   -155.391     13.6323    -155.391     124.411    24.6088      
1 1 1 38  6  15 o 0 139.5   17.6  ?     ?   128.416   26.9425      372.494    26.9425      252.492    26.9425      
1 1 1 38  6  16 o 0 119.2   17.2  ?     ?   272.845   106.314      227.67     106.314      27.0335    -73.6857     
1 1 1 38  6  17 o 0 253.2   21.2  ?     ?   362.962   128.228      381.663    128.228      41.6584    128.228      
1 1 1 38  6  18 o 0 146     21.1  ?     ?   122.911   62.4403      406.312    62.4403      282.038    62.4403      
1 1 1 38  6  19 o 0 55.6    22.3  ?     ?   108.473   74.045       170.234    74.045       64.1096    74.045       
1 1 1 38  6  20 o 0 17.7    26.9  ?     ?   90.2632   173.007      70.9706    173.007      14.9309    -6.99288     
1 1 1 38  6  21 o 0 -5.7    31.1  ?     ?   119.42    -158.004     35.6004    -158.004     75.7862    21.9959      
1 1 1 -38 8  21 < 0 26      9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 8  20 o 0 40      8.2   ?     ?   196.679   88.1834      88.5703    88.1834      77.4447    -91.8166     
1 1 1 -38 8  19 o 0 138.5   7.2   ?     ?   275.586   99.2372      260.41     99.2372      22.7696    99.2372      
1 1 1 -38 8  18 o 0 58.7    5.8   ?     ?   173.856   10.6078      155.088    10.6078      0.436109   10.6078      
1 1 1 -38 8  17 o 0 126.5   6.3   ?     ?   254.28    -84.907      245.843    -84.907      9.51824    -84.907      
1 1 1 -38 8  16 o 0 59.4    4.7   ?     ?   150.713   -157.225     167.641    -157.225     27.3411    -157.225     
1 1 1 -38 8  15 o 0 148     5.3   ?     ?   401.106   -82.7795     165.189    -82.7795     181.773    97.2205      
1 1 1 -38 8  14 f 1 229.9   6.4   ?     ?   273.462   -77.0752     400.104    -77.0752     162.465    -77.0752     
1 1 1 -38 8  13 o 0 134.2   4.5   ?     ?   247.593   -68.7419     266.275    -68.7419     51.3644    -68.7419     
1 1 1 -38 8  12 o 0 11.1    2.4   ?     ?   78.2061   -60.9366     12.1843    119.063      80.5628    119.063      
1 1 1 -38 8  11 o 0 15      2.1   ?     ?   130.927   78.0078      17.1419    -101.992     135.342    -101.992     
1 1 1 -38 8  10 o 0 500.5   9.8   ?     ?   454.484   95.6553      575.231    95.6553      162.307    95.6553      
1 1 1 -38 8  9  o 0 32.4    1.7   ?     ?   120.068   -65.3452     50.1656    -65.3452     61.4339    114.655      
1 1 1 -38 8  8  o 0 639.1   18.4  ?     ?   541.342   179.584      624.702    179.584      118.791    179.584      
1 1 1 -38 8  7  o 0 1082    29.7  ?     ?   698.753   -156.948     815.466    -156.948     147.505    -156.948     
1 1 1 -38 8  6  o 0 175.2   6.8   ?     ?   459.322   89.546       139.246    89.546       301.845    -90.454      
1 1 1 -38 8  5  f 1 97.7    6.1   ?     ?   291.259   76.1707      128.844    76.1707      153.457    -103.829     
1 1 1 -38 8  4  o 0 1242    37.3  ?     ?   776.619   -48.2468     761.672    -48.2468     95.9502    -48.2468     
1 1 1 -38 8  3  o 0 870.6   28.5  ?     ?   476.48    -135.376     775.017    -135.376     365.232    -135.376     
1 1 1 -38 8  2  o 0 301.1   12.5  ?     ?   325.873   -78.6278     390.793    -78.6278     109.727    -78.6278     
1 1 1 -38 8  1  f 1 311.5   7.6   ?     ?   156.532   7.67234      496.376    7.67234      360.338    7.67234      
1 1 1 38  8  0  o 0 213.5   5.6   ?     ?   248.774   -172.307     333.386    -172.307     115.856    -172.307     
1 1 1 38  8  1  f 1 45.1    3.4   ?     ?   107.688   -120.546     36.0982    -120.546     58.6765    59.4535      
1 1 1 38  8  2  o 0 76.6    4.1   ?     ?   236.304   -122.895     90.5829    -122.895     116.528    57.105       
1 1 1 38  8  3  o 0 150.6   5.5   ?     ?   254.208   -155.77      231.585    -155.77      8.63942    -155.77      
1 1 1 38  8  4  o 0 1110.6  22.2  ?     ?   597.661   -119.618     856.387    -119.618     330.425    -119.618     
1 1 1 38  8  5  f 1 95.8    5.7   ?     ?   216.396   -90.6278     184.689    -90.6278     30.7235    89.3722      
1 1 1 38  8  6  o 0 40      6.2   ?     ?   266.789   -169.754     18.5829    10.2464      282.658    10.2464      
1 1 1 38  8  7  o 0 103.1   7.3   ?     ?   187.375   -150.233     219.965    -150.233     34.6753    -150.233     
1 1 1 38  8  8  o 0 22.7    7.1   ?     ?   149.004   1.97205      1.54298    -178.028     146.113    -178.028     
1 1 1 38  8  9  o 0 16      7.1   ?     ?   126.019   -92.7246     29.6812    87.2754      151.723    87.2754      
1 1 1 38  8  10 o 0 138.4   11    ?     ?   154.394   -112.904     348.511    -112.904     201.826    -112.904     
1 1 1 38  8  11 o 0 40.5    9.5   ?     ?   157.248   -24.9107     87.2359    -24.9107     61.7475    155.089      
1 1 1 38  8  12 o 0 75.7    12.1  ?     ?   251.993   -16.7772     140.762    -16.7772     91.2906    163.223      
1 1 1 38  8  13 o 0 56.2    13.8  ?     ?   221.649   -16.6322     105.168    -16.6322     98.955     163.368      
1 1 1 38  8  14 f 1 180     15.6  ?     ?   255.063   77.6147      355.962    77.6147      118.78     77.6147      
1 1 1 38  8  15 o 0 281.1   18    ?     ?   341.721   47.9012      456.979    47.9012      127.069    47.9012      
1 1 1 38  8  16 o 0 196.8   20    ?     ?   311.147   22.4271      339.249    22.4271      29.7916    22.4271      
1 1 1 38  8  17 o 0 23.7    19.9  ?     ?   89.5892   82.232       63.7955    82.232       25.481     -97.768      
1 1 1 38  8  18 o 0 90.8    23.7  ?     ?   190.049   132.729      227.649    132.729      49.5227    132.729      
1 1 1 38  8  19 o 0 77.6    25.1  ?     ?   196.871   58.9848      176.966    58.9848      3.98558    -121.015     
1 1 1 38  8  20 o 0 25.8    30.4  ?     ?   119.53    14.7686      89.3999    14.7686      19.9626    -165.231     
1 1 1 -38 10 19 < 0 66.5    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 10 18 o 0 50.3    5.7   ?     ?   91.055    101.82       189.87     101.82       114.477    101.82       
1 1 1 -38 10 17 f 1 80.2    7     ?     ?   136.274   129.936      240.132    129.936      125.852    129.936      
1 1 1 -38 10 16 o 0 6.3     4.4   ?     ?   54.0952   -135.482     11.4792    44.5175      57.6388    44.5175      
1 1 1 -38 10 15 o 0 37.2    4.1   ?     ?   131.542   -75.5471     111.448    -75.5471     4.21582    104.453      
1 1 1 -38 10 14 o 0 94.4    4     ?     ?   315.976   -104.03      122.822    -104.03      167.136    75.9697      
1 1 1 -38 10 13 o 0 149.7   5     ?     ?   402.653   -121.767     160.186    -121.767     209.507    58.233       
1 1 1 -38 10 12 o 0 35.3    2.9   ?     ?   157.502   89.4222      78.1709    89.4222      56.0525    -90.5778     
1 1 1 -38 10 11 o 0 128     4.2   ?     ?   208.71    62.7629      278.436    62.7629      99.3106    62.7629      
1 1 1 -38 10 10 f 1 34.1    2.5   ?     ?   49.6431   57.4384      66.2127    57.4384      23.4774    57.4384      
1 1 1 -38 10 9  o 0 10.4    2     ?     ?   73.2019   -172.967     12.4264    7.03274      75.5071    7.03274      
1 1 1 -38 10 8  o 0 163.6   8.2   ?     ?   309.958   -64.3322     269.231    -64.3322     1.61212    -64.3322     
1 1 1 -38 10 7  o 0 256.3   10.2  ?     ?   370.3     -32.1174     363.873    -32.1174     42.475     -32.1174     
1 1 1 -38 10 6  o 0 43.3    5.6   ?     ?   158.577   74.4164      93.2212    74.4164      48.6057    -105.584     
1 1 1 -38 10 5  o 0 38      6.1   ?     ?   100.653   105.752      89.0392    105.752      1.37404    -74.2483     
1 1 1 -38 10 4  f 1 81.2    7.3   ?     ?   250.541   110.047      141.92     110.047      85.173     -69.9528     
1 1 1 -38 10 3  o 0 323.5   15.9  ?     ?   470.286   81.2289      361.264    81.2289      64.2965    -98.7711     
1 1 1 -38 10 2  o 0 24.7    2.3   ?     ?   274.753   69.0847      68.8172    -110.915     322.431    -110.915     
1 1 1 -38 10 1  f 1 60.6    2.9   ?     ?   126.372   178.232      145.314    178.232      27.7591    178.232      
1 1 1 38  10 0  f 1 46.9    3.3   ?     ?   353.432   75.0464      49.1785    -104.954     383.435    -104.954     
1 1 1 38  10 1  f 1 120.6   4.5   ?     ?   282.824   33.6366      200.491    33.6366      67.279     -146.363     
1 1 1 38  10 2  o 0 37.4    4.4   ?     ?   67.1827   -36.9891     79.3836    -36.9891     17.1148    -36.9891     
1 1 1 38  10 3  o 0 360.5   9.1   ?     ?   338.438   87.7965      532.993    87.7965      219.206    87.7965      
1 1 1 38  10 4  f 1 600.4   14    ?     ?   517.766   84.7319      625.244    84.7319      142.753    84.7319      
1 1 1 38  10 5  o 0 107.7   6.7   ?     ?   216.492   153.968      236.044    153.968      35.4276    153.968      
1 1 1 38  10 6  o 0 390.6   12    ?     ?   324.849   126.949      578.838    126.949      278.078    126.949      
1 1 1 38  10 7  o 0 47.6    8.4   ?     ?   167.244   80.7275      115.292    80.7275      35.4968    -99.2725     
1 1 1 38  10 8  o 0 14.1    8.7   ?     ?   122.811   -30.6184     14.0476    149.382      124.581    149.382      
1 1 1 38  10 9  o 0 113.5   10.3  ?     ?   280.083   -29.9098     205.472    -29.9098     47.0069    150.09       
1 1 1 38  10 10 f 1 56.7    10.6  ?     ?   124.175   -53.5782     164.054    -53.5782     51.8394    -53.5782     
1 1 1 38  10 11 o 0 14.6    11.6  ?     ?   25.9264   120.965      7.02994    120.965      16.411     -59.0351     
1 1 1 38  10 12 o 0 42.1    15.2  ?     ?   71.8723   -56.2198     126.015    -56.2197     55.7251    -56.2197     
1 1 1 38  10 13 o 0 112.4   15.9  ?     ?   163.411   -44.615      297.982    -44.615      138.809    -44.615      
1 1 1 38  10 14 o 0 250.6   21.8  ?     ?   318.202   24.3614      407.178    24.3614      96.292     24.3614      
1 1 1 38  10 15 o 0 57.6    17.6  ?     ?   121.007   85.5627      181.781    85.5627      68.0975    85.5627      
1 1 1 38  10 16 o 0 266.1   26.3  ?     ?   296.161   90.4464      455.47     90.4464      184.493    90.4464      
1 1 1 38  10 17 f 1 165.9   25.6  ?     ?   260.848   116.161      325.388    116.161      89.9926    116.161      
1 1 1 38  10 18 < 0 63.2    30.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 12 16 < 0 13.8    5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 12 15 f 1 26.1    4.5   ?     ?   80.9385   -177.52      105.241    -177.52      39.167     -177.52      
1 1 1 -38 12 14 o 0 -3      4     ?     ?   51.0519   154.478      27.7366    -25.5217     69.5618    -25.5217     
1 1 1 -38 12 13 o 0 46.5    4.3   ?     ?   157.893   -137.545     133.918    -137.545     3.78365    -137.545     
1 1 1 -38 12 12 o 0 41.7    3.7   ?     ?   159.365   -113.104     113.257    -113.104     20.8632    66.8962      
1 1 1 -38 12 11 o 0 24.2    4.1   ?     ?   83.757    -110.327     72.5602    -110.327     0.0420807  -110.327     
1 1 1 -38 12 10 o 0 74.7    3.9   ?     ?   117.706   -140.193     225.591    -140.193     119.404    -140.193     
1 1 1 -38 12 9  o 0 49      3.5   ?     ?   203.073   165.092      96.4598    165.092      87.9104    -14.9078     
1 1 1 -38 12 8  f 1 14.9    2.7   ?     ?   144.919   86.5189      6.39149    -93.4811     138.433    -93.4811     
1 1 1 -38 12 7  o 0 5.2     2.7   ?     ?   74.7335   -171.629     36.2274    8.3707       104.342    8.3707       
1 1 1 -38 12 6  o 0 28.8    3     ?     ?   112.678   -138.485     74.0238    -138.485     25.6582    41.5153      
1 1 1 -38 12 5  o 0 75      4     ?     ?   191.615   -147.448     173.522    -147.448     11.0989    -147.448     
1 1 1 -38 12 4  o 0 62.9    3.3   ?     ?   134.019   68.6821      176.688    68.6821      62.6213    68.6821      
1 1 1 -38 12 3  o 0 211.5   7.4   ?     ?   358.735   90.3273      299.16     90.3273      7.28011    -89.6727     
1 1 1 -38 12 2  o 0 33.1    3.8   ?     ?   113.202   148.08       88.6632    148.08       8.34597    -31.9199     
1 1 1 -38 12 1  o 0 59      4.3   ?     ?   157.598   148.404      150.768    148.404      16.5178    148.404      
1 1 1 38  12 0  o 0 92.8    4.9   ?     ?   174.947   40.7004      231.004    40.7004      78.6034    40.7004      
1 1 1 38  12 1  o 0 17      4.6   ?     ?   196.627   142.208      27.0058    -37.7916     199.935    -37.7916     
1 1 1 38  12 2  o 0 217.2   7.8   ?     ?   227.246   -50.2808     422.333    -50.2808     222.39     -50.2808     
1 1 1 38  12 3  o 0 75.1    5.8   ?     ?   117.93    170.918      221.708    170.918      117.944    170.918      
1 1 1 38  12 4  o 0 69.3    6.9   ?     ?   154.65    146.673      188.199    146.673      52.1769    146.673      
1 1 1 38  12 5  o 0 34      7.1   ?     ?   210.97    83.1239      38.6947    83.1239      146.716    -96.8761     
1 1 1 38  12 6  o 0 32.9    8     ?     ?   86.293    -76.1981     101.743    -76.1981     19.5185    -76.1981     
1 1 1 38  12 7  o 0 33.9    7.6   ?     ?   203.532   -63.7474     42.6245    -63.7474     150.993    116.253      
1 1 1 38  12 8  f 1 95.4    11.3  ?     ?   171.959   -133.413     250.483    -133.413     85.1707    -133.413     
1 1 1 38  12 9  o 0 467.5   17.8  ?     ?   443.973   -100.497     552.554    -100.497     128.997    -100.497     
1 1 1 38  12 10 o 0 108     14.2  ?     ?   287.191   -42.0397     186.184    -42.0397     77.789     137.96       
1 1 1 38  12 11 o 0 251     19    ?     ?   322.557   30.7603      401.147    30.7603      105.679    30.7603      
1 1 1 38  12 12 o 0 105.2   17.2  ?     ?   240.357   56.3975      221.368    56.3975      6.62037    56.3975      
1 1 1 38  12 13 o 0 -5.7    19.9  ?     ?   44.1092   9.94779      14.949     9.94779      23.7791    -170.052     
1 1 1 38  12 14 o 0 -21.5   20.5  ?     ?   83.5361   -140.955     4.60797    -140.955     68.5523    39.0448      
1 1 1 38  12 15 < 1 -32.9   26.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 14 11 < 1 63.2    6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 14 10 < 0 8.5     4.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -38 14 9  o 0 37.5    4.6   ?     ?   198.109   96.0876      77.4519    96.0876      81.9424    -83.9124     
1 1 1 -38 14 8  o 0 14.2    4.4   ?     ?   130.885   125.535      24.6743    125.535      81.278     -54.4646     
1 1 1 -38 14 7  o 0 0.4     4.4   ?     ?   98.6767   174.844      48.0216    -5.15573     128.173    -5.15573     
1 1 1 -38 14 6  o 0 140.8   6.6   ?     ?   235.925   -6.6868      289.106    -6.6868      96.4763    -6.6868      
1 1 1 -38 14 5  o 0 44.7    5.2   ?     ?   99.0509   84.144       151.671    84.1441      69.3413    84.1441      
1 1 1 -38 14 4  o 0 1.3     4.6   ?     ?   45.1792   -149.31      21.2029    30.6898      58.9157    30.6898      
1 1 1 -38 14 3  o 0 6.4     5.3   ?     ?   74.4135   -38.7545     15.1372    141.245      77.4903    141.245      
1 1 1 -38 14 2  o 0 98.6    8.3   ?     ?   229.184   -83.7903     210.286    -83.7903     17.5993    -83.7903     
1 1 1 -38 14 1  o 0 43.4    6.8   ?     ?   87.271    -81.8255     150.723    -81.8255     77.1359    -81.8255     
1 1 1 38  14 0  o 0 64.5    6.3   ?     ?   141.778   -75.0803     196.815    -75.0803     73.8225    -75.0803     
1 1 1 38  14 1  o 0 44.4    7.5   ?     ?   135.322   -21.9114     138.807    -21.9114     21.3497    -21.9114     
1 1 1 38  14 2  o 0 93.6    9.6   ?     ?   224.553   4.85181      208.755    4.85181      13.8169    4.85181      
1 1 1 38  14 3  o 0 0.2     7.6   ?     ?   80.5913   -2.73909     29.5044    177.261      99.4487    177.261      
1 1 1 38  14 4  o 0 13.3    7.7   ?     ?   28.5082   -29.9909     13.1052    -29.9909     11.62      150.009      
1 1 1 38  14 5  o 0 72.7    10.5  ?     ?   162.533   -161.808     201.913    -161.808     61.1027    -161.808     
1 1 1 38  14 6  o 0 -6.3    12.5  ?     ?   28.196    -175.03      2.69154    4.97041      26.7637    4.97041      
1 1 1 38  14 7  o 0 71.2    13    ?     ?   154.595   -65.9323     205.627    -65.9323     73.9019    -65.9323     
1 1 1 38  14 8  o 0 -7.4    12.7  ?     ?   12.6984   127.304      0.958076   127.304      9.86008    -52.6958     
1 1 1 38  14 9  o 0 113.5   14.6  ?     ?   273.36    105.718      212.997    105.718      19.2259    -74.282      
1 1 1 38  14 10 < 0 2.1     16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 38  14 11 < 1 79.9    24.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 1  24 < 1 199.1   8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 1  23 o 0 19.7    5     ?     ?   55.649    -90.1021     65.2678    -90.1021     16.508     -90.1021     
1 1 1 -39 1  22 f 1 34.7    5.5   ?     ?   153.628   -131.756     96.6649    -131.756     41.8978    48.2438      
1 1 1 -39 1  21 f 1 7.3     4     ?     ?   91.8918   -33.0545     29.1511    146.946      117.649    146.946      
1 1 1 -39 1  20 o 0 120.9   5.2   ?     ?   238.65    -30.0334     257.311    -30.0334     28.1177    -30.0334     
1 1 1 -39 1  19 o 0 86      4.3   ?     ?   101.4     73.6504      257.367    73.6504      166.815    73.6504      
1 1 1 -39 1  18 o 0 92.7    4.2   ?     ?   262.805   158.812      172.736    158.812      61.9943    -21.1883     
1 1 1 -39 1  17 o 0 56.3    3.5   ?     ?   266.129   -155.784     74.4176    -155.784     164.396    24.2156      
1 1 1 -39 1  16 o 0 85.3    4.7   ?     ?   326.41    -172.502     95.6146    -172.502     207.177    7.49814      
1 1 1 -39 1  15 f 1 189.6   5.1   ?     ?   268.214   -177.451     343.599    -177.451     87.3462    -177.451     
1 1 1 -39 1  14 o 0 275     6.6   ?     ?   313.589   64.3325      426.272    64.3325      120.755    64.3325      
1 1 1 -39 1  13 o 0 24      2.7   ?     ?   109.252   -151.048     4.07495    28.9521      111.22     28.9521      
1 1 1 -39 1  12 o 0 62      3     ?     ?   86.6818   -138.098     70.0535    -138.098     5.70099    41.9015      
1 1 1 -39 1  11 o 0 208.1   5.6   ?     ?   127.489   9.65837      322.963    9.65837      211.88     9.65837      
1 1 1 -39 1  10 o 0 1027.8  21.8  ?     ?   846.865   -27.9759     594.402    -27.9759     147.385    152.024      
1 1 1 -39 1  9  o 0 138.8   3.9   ?     ?   285.984   -102.952     162.087    -102.952     94.9896    77.0479      
1 1 1 -39 1  8  o 0 346.8   7.1   ?     ?   437.019   -85.9056     351.8      -85.9056     42.8033    94.0944      
1 1 1 -39 1  7  o 0 2326.1  39.6  ?     ?   1073.37   -134.524     1077.7     -134.524     104.527    -134.524     
1 1 1 -39 1  6  o 0 197.4   4.7   ?     ?   376.54    106.652      202.879    106.652      139.787    -73.3482     
1 1 1 -39 1  5  o 0 806.2   18.8  ?     ?   543.998   108.968      685.111    108.968      182.346    108.968      
1 1 1 -39 1  4  o 0 3048.7  51.7  ?     ?   1164.24   -77.9808     1263.17    -77.9808     212.189    -77.9808     
1 1 1 -39 1  3  o 0 1527.1  27.2  ?     ?   716.921   -99.5372     977.062    -99.5372     328.052    -99.5372     
1 1 1 -39 1  2  o 0 209.7   5.3   ?     ?   332.766   162.777      245.137    162.777      56.8788    -17.2232     
1 1 1 -39 1  1  o 0 1348.4  29.2  ?     ?   1044.67   -153.142     592.617    -153.142     357.703    26.8582      
1 1 1 39  1  0  o 0 397.5   8.7   ?     ?   620.806   -76.7045     249.938    -76.7045     316.114    103.296      
1 1 1 39  1  1  o 0 999.7   19.1  ?     ?   666.09    -124.591     711.107    -124.591     102.646    -124.591     
1 1 1 39  1  2  o 0 376.1   10.9  ?     ?   210.52    -50.351      527.428    -50.351      334.816    -50.351      
1 1 1 39  1  3  o 0 863     18.4  ?     ?   654.524   -168.46      626.992    -168.46      27.3631    -168.46      
1 1 1 39  1  4  o 0 795.9   18.7  ?     ?   595.997   49.245       627.876    49.245       81.3197    49.245       
1 1 1 39  1  5  o 0 90.6    5.6   ?     ?   197.737   -20.7228     98.3268    -20.7228     88.0235    159.277      
1 1 1 39  1  6  o 0 531.9   12.7  ?     ?   820.161   -92.9764     226.682    -92.9764     537.225    87.0236      
1 1 1 39  1  7  o 0 8.3     5.8   ?     ?   181.189   -117.44      136.319    62.5598      305.062    62.5598      
1 1 1 39  1  8  o 0 1069.4  21.9  ?     ?   714.757   72.2544      745.506    72.2544      80.1974    72.2544      
1 1 1 39  1  9  o 0 41.2    7.2   ?     ?   12.7034   102.115      1.55947    102.115      10.0075    -77.8852     
1 1 1 39  1  10 o 0 89.9    7.6   ?     ?   169.591   175.444      124.628    175.444      29.5715    -4.55586     
1 1 1 39  1  11 o 0 769.1   18.9  ?     ?   648.877   138.622      599.431    138.622      5.40176    138.622      
1 1 1 39  1  12 o 0 163.4   10.8  ?     ?   210.171   -43.5475     288.359    -43.5475     96.4063    -43.5475     
1 1 1 39  1  13 o 0 180.8   12.5  ?     ?   299.645   -121.264     306.562    -121.264     1.56429    58.7358      
1 1 1 39  1  14 o 0 231.5   16.2  ?     ?   316.071   -119.122     392.036    -119.122     73.7455    -119.122     
1 1 1 39  1  15 f 1 1       14.2  ?     ?   56.7005   -68.7846     26.1041    111.215      83.2806    111.215      
1 1 1 39  1  16 o 0 67.2    19.5  ?     ?   251.108   138.694      107.93     138.694      138.738    -41.3056     
1 1 1 39  1  17 o 0 143.8   17    ?     ?   233.534   82.9681      319.103    82.9681      96.4505    82.9681      
1 1 1 39  1  18 o 0 311.1   23.1  ?     ?   254.51    0.782902     570.681    0.782902     328.355    0.782902     
1 1 1 39  1  19 o 0 85.4    21.7  ?     ?   219.726   -36.6117     187.427    -36.6117     22.4469    143.388      
1 1 1 39  1  20 o 0 -24.6   23.3  ?     ?   76.0738   -38.2293     15.584     141.771      93.9939    141.771      
1 1 1 39  1  21 f 1 84.5    29.4  ?     ?   299.994   -13.3001     94.9245    -13.3001     205.743    166.7        
1 1 1 39  1  22 f 1 67.2    32.4  ?     ?   177.021   9.14315      147.89     9.14315      24.6603    -170.857     
1 1 1 39  1  23 o 0 30.8    33    ?     ?   138.995   -66.6829     90.3778    -66.6829     42.0088    113.317      
1 1 1 -39 3  24 < 0 70.8    7.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 3  23 o 0 59.7    6.5   ?     ?   223.959   144.653      133.678    144.653      60.5284    -35.3473     
1 1 1 -39 3  22 o 0 132.8   6.2   ?     ?   289.639   -173.478     245.408    -173.478     11.3161    6.52188      
1 1 1 -39 3  21 o 0 17.8    5.4   ?     ?   37.8478   113.718      31.3809    113.718      3.24472    -66.2816     
1 1 1 -39 3  20 o 0 181.3   6.8   ?     ?   204.26    -36.0581     396.207    -36.0581     202.31     -36.0581     
1 1 1 -39 3  19 o 0 22.2    4.6   ?     ?   145.854   37.6254      30.222     37.6254      98.5639    -142.375     
1 1 1 -39 3  18 o 0 9.8     3.4   ?     ?   63.3052   57.7404      14.3712    -122.26      70.297     -122.26      
1 1 1 -39 3  17 o 0 412.7   9.9   ?     ?   374.233   -128.536     563.298    -128.536     231.028    -128.536     
1 1 1 -39 3  16 o 0 -4      3     ?     ?   204.458   42.8497      173.379    -137.15      361.1      -137.15      
1 1 1 -39 3  15 o 0 524.5   10.7  ?     ?   584.97    6.89869      481.376    6.89869      69.1401    -173.101     
1 1 1 -39 3  14 o 0 83      3.4   ?     ?   239.013   150.744      150.86     150.744      75.7454    -29.2562     
1 1 1 -39 3  13 o 0 107.2   4.2   ?     ?   161.774   -88.1394     237.501    -88.1394     80.3126    -88.1394     
1 1 1 -39 3  12 o 0 738     14.1  ?     ?   621.013   -98.7721     566.96     -98.7721     29.0666    -98.7721     
1 1 1 -39 3  11 o 0 103.9   3.2   ?     ?   410.444   138.795      31.4006    138.795      326.259    -41.2052     
1 1 1 -39 3  10 o 0 242.9   6.6   ?     ?   297.612   113.984      330.923    113.984      72.3932    113.984      
1 1 1 -39 3  9  o 0 185.5   4.5   ?     ?   539.181   35.526       69.2123    35.526       401.59     -144.474     
1 1 1 -39 3  8  o 0 804     15.3  ?     ?   466.208   -165.88      753.992    -165.88      344.969    -165.88      
1 1 1 -39 3  7  o 0 2571.6  44.3  ?     ?   1120.7    176.255      1133.38    176.255      124.848    176.255      
1 1 1 -39 3  6  o 0 30.7    1.9   ?     ?   236.401   -26.269      83.575     153.731      297.162    153.731      
1 1 1 -39 3  5  o 0 1006.1  18.6  ?     ?   873.35    -59.3317     545.957    -59.3317     245.964    120.668      
1 1 1 -39 3  4  o 0 1009.1  20.2  ?     ?   633.658   -79.5453     758.32     -79.5453     181.865    -79.5453     
1 1 1 -39 3  3  f 1 483.4   11.3  ?     ?   473.564   159.292      464.333    159.292      24.7736    159.292      
1 1 1 -39 3  2  o 0 1435.6  30.2  ?     ?   538.688   -27.8955     1102.3     -27.8955     603.547    -27.8955     
1 1 1 -39 3  1  f 1 1675.3  42.9  ?     ?   948.366   17.9489      846.664    17.9489      14.7217    -162.051     
1 1 1 39  3  0  o 0 792.5   18.4  ?     ?   514.72    93.5761      686.107    93.5761      219.415    93.5761      
1 1 1 39  3  1  f 1 375     8.4   ?     ?   257.136   58.4526      514.686    58.4526      273.587    58.4526      
1 1 1 39  3  2  o 0 540     11.6  ?     ?   597.008   6.74863      421.278    6.74863      136.491    -173.251     
1 1 1 39  3  3  f 1 619.8   13    ?     ?   381.694   23.8739      677.227    23.8739      322.634    23.8739      
1 1 1 39  3  4  o 0 101.9   4.9   ?     ?   197.395   -99.1646     126.579    -99.1646     56.0316    80.8354      
1 1 1 39  3  5  o 0 586.7   13.5  ?     ?   478.165   11.3536      572.935    11.3536      130.332    11.3536      
1 1 1 39  3  6  o 0 174.8   6.3   ?     ?   369.525   66.322       174.871    66.322       167.237    -113.678     
1 1 1 39  3  7  o 0 2548.5  46.3  ?     ?   1197.84   93.6246      1085.35    93.6246      23.3742    -86.3754     
1 1 1 39  3  8  o 0 268.1   9.2   ?     ?   224.201   41.7557      421.548    41.7557      218.482    41.7557      
1 1 1 39  3  9  o 0 31.4    7.1   ?     ?   352.939   31.386       139.272    -148.614     458.591    -148.614     
1 1 1 39  3  10 o 0 249.8   9.8   ?     ?   294.861   24.9825      368.286    24.9825      99.5966    24.9825      
1 1 1 39  3  11 o 0 130.4   9.2   ?     ?   256.667   -68.3384     200.468    -68.3384     32.9419    111.662      
1 1 1 39  3  12 o 0 72.1    10.7  ?     ?   15.4885   120.463      34.876     120.463      19.0124    120.463      
1 1 1 39  3  13 o 0 202     13.3  ?     ?   273.599   74.2928      363.86     74.2928      84.47      74.2928      
1 1 1 39  3  14 o 0 138.9   12.4  ?     ?   127.232   39.9498      356.042    39.9498      228.827    39.9498      
1 1 1 39  3  15 o 0 212.1   15.9  ?     ?   467.911   133.989      226.463    133.989      231.767    -46.0105     
1 1 1 39  3  16 o 0 46.6    17.1  ?     ?   27.0178   -166.885     59.1576    -166.885     33.4706    -166.885     
1 1 1 39  3  17 o 0 75.1    17.6  ?     ?   179.588   -159.395     193.603    -159.395     23.047     -159.395     
1 1 1 39  3  18 o 0 63.6    22.3  ?     ?   207.961   147.085      128.348    147.085      69.8338    -32.9145     
1 1 1 39  3  19 o 0 80.7    22.2  ?     ?   136.374   49.792       244.43     49.792       104.159    49.792       
1 1 1 39  3  20 o 0 -22     24    ?     ?   66.2826   -157.9       2.72682    22.1005      70.9941    22.1005      
1 1 1 39  3  21 o 0 -44.5   26.3  ?     ?   71.3512   -137.228     14.3127    42.7719      84.8616    42.7719      
1 1 1 39  3  22 o 0 49.9    34.1  ?     ?   111.275   -40.2876     147.691    -40.2876     42.1027    -40.2876     
1 1 1 39  3  23 o 0 29.4    29.1  ?     ?   172.655   168.588      58.4094    168.588      104.587    -11.412      
1 1 1 -39 5  23 < 0 74.6    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 5  22 o 0 122.6   7.8   ?     ?   248.737   103.111      260.456    103.111      46.7488    103.111      
1 1 1 -39 5  21 o 0 42.5    6.2   ?     ?   139.376   110.272      132.564    110.272      10.1781    110.272      
1 1 1 -39 5  20 o 0 38.9    5.5   ?     ?   130.86    114.831      120.658    114.831      2.06762    114.831      
1 1 1 -39 5  19 o 0 157.5   6.3   ?     ?   186.813   -129.879     366.684    -129.879     189.721    -129.879     
1 1 1 -39 5  18 o 0 43.5    4.3   ?     ?   142.46    -67.1236     122.959    -67.1236     7.64637    112.876      
1 1 1 -39 5  17 o 0 55.5    4.2   ?     ?   160.846   158.404      142.651    158.404      1.94136    158.404      
1 1 1 -39 5  16 f 1 222.3   6.7   ?     ?   323.209   177.5        357.162    177.5        71.564     177.5        
1 1 1 -39 5  15 o 0 137.6   4.4   ?     ?   202.565   172.963      311.605    172.963      132.061    172.963      
1 1 1 -39 5  14 o 0 28.6    3.2   ?     ?   104.505   132.084      54.5244    132.084      41.2077    -47.9162     
1 1 1 -39 5  13 o 0 200.2   5.4   ?     ?   406.72    164.431      240.457    164.431      141.223    -15.5687     
1 1 1 -39 5  12 o 0 98.1    3.3   ?     ?   334.212   172.577      95.6478    172.577      225.752    -7.4228      
1 1 1 -39 5  11 o 0 93.8    3     ?     ?   342.662   152.441      78.9139    152.441      252.722    -27.5589     
1 1 1 -39 5  10 o 0 3       1.9   ?     ?   131.371   172.324      101.81     -7.67631     215.087    -7.67631     
1 1 1 -39 5  9  o 0 122.3   3.6   ?     ?   253.386   127.353      178.384    127.353      41.3073    -52.6474     
1 1 1 -39 5  8  o 0 104.8   2.8   ?     ?   162.385   2.91032      150.956    2.91032      10.6774    2.91032      
1 1 1 -39 5  7  o 0 572.7   11.6  ?     ?   408.445   -33.2596     604.247    -33.2596     249.763    -33.2596     
1 1 1 -39 5  6  o 0 292.3   7.2   ?     ?   165.897   144.522      451.182    144.522      306.591    144.522      
1 1 1 -39 5  5  o 0 271.7   9.7   ?     ?   249.199   -122.1       399.928    -122.1       181.897    -122.1       
1 1 1 -39 5  4  o 0 1872    41.6  ?     ?   740.888   -56.4623     1143.58    -56.4623     479.272    -56.4623     
1 1 1 -39 5  3  o 0 328.9   7.2   ?     ?   321.622   -113.918     414.279    -113.918     125.012    -113.918     
1 1 1 -39 5  2  f 1 5.3     1.5   ?     ?   402.202   24.9663      322.934    -155.034     687.527    -155.034     
1 1 1 -39 5  1  o 0 301.8   6.8   ?     ?   426.279   133.38       306.886    133.38       78.4675    -46.6203     
1 1 1 39  5  0  o 0 75.4    3.3   ?     ?   106.27    100.617      60.7694    100.617      35.8525    -79.3832     
1 1 1 39  5  1  o 0 119.4   4.1   ?     ?   356.928   -168.173     80.7608    -168.173     244.305    11.8267      
1 1 1 39  5  2  f 1 218.4   5.8   ?     ?   295.266   21.9005      289.903    21.9005      19.2395    21.9005      
1 1 1 39  5  3  o 0 92      4.3   ?     ?   132.43    33.3373      101.711    33.3373      19.1916    -146.663     
1 1 1 39  5  4  o 0 238.5   7.2   ?     ?   362.303   -176.215     289.574    -176.215     34.5341    3.78503      
1 1 1 39  5  5  o 0 365.4   9.8   ?     ?   234.115   -163.311     531.994    -163.311     322.487    -163.311     
1 1 1 39  5  6  o 0 247.5   8     ?     ?   550.3     -18.6916     153.248    -18.6916     339.188    161.308      
1 1 1 39  5  7  o 0 7.1     5.7   ?     ?   198.187   5.62883      142.657    -174.371     319.923    -174.371     
1 1 1 39  5  8  o 0 399.5   10.9  ?     ?   461.939   100.746      414.566    100.746      1.85691    -79.254      
1 1 1 39  5  9  o 0 183.1   8.9   ?     ?   305.092   -8.36418     257.811    -8.36418     16.8501    171.636      
1 1 1 39  5  10 o 0 45.1    7.3   ?     ?   69.4153   -13.4889     59.7304    -13.4889     10.7016    166.511      
1 1 1 39  5  11 o 0 226.3   10.5  ?     ?   382.404   56.7593      305.882    56.7593      81.2417    -123.241     
1 1 1 39  5  12 o 0 70.9    9.5   ?     ?   165.563   -108.658     172.635    -108.658     8.40588    -108.658     
1 1 1 39  5  13 o 0 163.2   11.1  ?     ?   182.818   -61.1573     374.574    -61.1573     193.813    -61.1573     
1 1 1 39  5  14 o 0 161.6   13    ?     ?   207.995   0.881209     363.991    0.881209     162.516    0.881209     
1 1 1 39  5  15 o 0 -8.6    14    ?     ?   56.5621   25.8965      25.1225    -154.104     78.3258    -154.104     
1 1 1 39  5  16 f 1 41.1    14.6  ?     ?   153.457   -146.605     93.3968    -146.605     51.5656    33.3947      
1 1 1 39  5  17 o 0 207.4   21    ?     ?   301.078   -142.264     367.887    -142.264     83.8966    -142.264     
1 1 1 39  5  18 o 0 83.1    21.3  ?     ?   142.216   -72.869      245.617    -72.869      100.8      -72.869      
1 1 1 39  5  19 o 0 131.7   23.8  ?     ?   186.1     -34.6027     328.592    -34.6027     138.801    -34.6027     
1 1 1 39  5  20 o 0 -26.3   25.7  ?     ?   128.161   -61.3657     27.7534    118.634      153.252    118.634      
1 1 1 39  5  21 o 0 30      30.2  ?     ?   180.736   -55.5425     52.206     -55.5425     117.668    124.457      
1 1 1 39  5  22 o 0 9.8     26.6  ?     ?   76.977    122.949      73.8628    122.949      1.86955    122.949      
1 1 1 -39 7  22 < 0 102.2   8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 7  21 o 0 13.3    6.9   ?     ?   77.6599   73.7434      38.4167    73.7434      27.1677    -106.257     
1 1 1 -39 7  20 o 0 43.3    6.7   ?     ?   134.918   -13.9951     141.235    -13.9951     26.3173    -13.9951     
1 1 1 -39 7  19 o 0 75      5.6   ?     ?   171.098   -38.6844     201.089    -38.6844     48.7165    -38.6844     
1 1 1 -39 7  18 o 0 32.7    4.6   ?     ?   93.099    -57.6492     107.282    -57.6492     20.6293    -57.6492     
1 1 1 -39 7  17 o 0 76.2    5.1   ?     ?   214.876   -60.3166     166.643    -60.3166     33.7492    119.683      
1 1 1 -39 7  16 o 0 160.9   5.8   ?     ?   165.635   126.002      370.056    126.002      226.472    126.002      
1 1 1 -39 7  15 o 0 13.5    3.5   ?     ?   24.4137   177.702      2.14607    177.702      19.0134    -2.29823     
1 1 1 -39 7  14 o 0 136.3   4.4   ?     ?   216.396   142.535      293.834    142.535      105.472    142.535      
1 1 1 -39 7  13 o 0 3.6     2.4   ?     ?   99.1044   -124.246     63.0519    55.7539      149.977    55.7539      
1 1 1 -39 7  12 o 0 56.6    2.9   ?     ?   202.567   40.6383      112.024    40.6383      71.4957    -139.362     
1 1 1 -39 7  11 o 0 277.4   6.1   ?     ?   344.214   100.214      404.467    100.214      85.1875    100.214      
1 1 1 -39 7  10 o 0 354.9   7.2   ?     ?   300.146   99.4574      543.148    99.4574      262.998    99.4574      
1 1 1 -39 7  9  o 0 21.6    1.7   ?     ?   38.769    170.033      1.55122    -9.96695     38.5949    -9.96695     
1 1 1 -39 7  8  o 0 414.7   12.7  ?     ?   393.731   -162.832     524.962    -162.832     146.731    -162.832     
1 1 1 -39 7  7  o 0 310.6   10.1  ?     ?   345.9     134.633      442.843    134.633      108.92     134.633      
1 1 1 -39 7  6  o 0 229.1   8.5   ?     ?   253.245   147.761      346.293    147.761      128.795    147.761      
1 1 1 -39 7  5  o 0 331.9   11    ?     ?   255.448   -130.947     474.452    -130.947     254.167    -130.947     
1 1 1 -39 7  4  o 0 39.2    5.6   ?     ?   165.893   -39.3434     11.221     -39.3434     132.36     140.657      
1 1 1 -39 7  3  o 0 388.8   13.2  ?     ?   477.511   124.378      375.421    124.378      39.2107    -55.6216     
1 1 1 -39 7  2  o 0 359.1   13.3  ?     ?   369.566   24.9936      429.043    24.9936      107.226    24.9936      
1 1 1 -39 7  1  o 0 7.2     2.3   ?     ?   66.9897   84.8393      46.5182    -95.1607     104.489    -95.1607     
1 1 1 39  7  0  o 0 353.5   8.5   ?     ?   350.836   126.797      433.414    126.797      126.89     126.797      
1 1 1 39  7  1  o 0 81.7    4.2   ?     ?   45.8959   24.7895      69.3709    24.7895      28.8609    24.7895      
1 1 1 39  7  2  o 0 423.3   10    ?     ?   540.769   -122.737     366.487    -122.737     111.369    57.2632      
1 1 1 39  7  3  o 0 494.1   10.7  ?     ?   522.932   -161.619     451.803    -161.619     10.6598    18.3808      
1 1 1 39  7  4  o 0 228.4   6.6   ?     ?   241.452   -72.2082     363.163    -72.2082     149.54     -72.2082     
1 1 1 39  7  5  o 0 324.9   8.5   ?     ?   285.97    -23.666      458.453    -23.666      205.43     -23.666      
1 1 1 39  7  6  o 0 27.1    5.5   ?     ?   164.026   -170.188     29.917     9.81182      174.994    9.81182      
1 1 1 39  7  7  o 0 362     11.1  ?     ?   486.982   -164.999     394.923    -164.999     91.0278    15.0014      
1 1 1 39  7  8  o 0 180.9   8.6   ?     ?   214.883   -23.0935     363.938    -23.0935     149.77     -23.0935     
1 1 1 39  7  9  o 0 282.7   10.3  ?     ?   360.586   -31.9248     418.697    -31.9248     66.1687    -31.9248     
1 1 1 39  7  10 o 0 17.3    8.8   ?     ?   164.873   -21.6028     42.3829    158.397      203.232    158.397      
1 1 1 39  7  11 o 0 140     9.9   ?     ?   244.782   26.6175      289.992    26.6175      55.7763    26.6175      
1 1 1 39  7  12 o 0 190.4   13.7  ?     ?   357.209   56.2265      284.954    56.2265      55.7973    -123.774     
1 1 1 39  7  13 o 0 158.1   12.3  ?     ?   251.359   2.6849       325.913    2.6849       92.921     2.6849       
1 1 1 39  7  14 o 0 267.2   17.5  ?     ?   313.031   27.0619      448.479    27.0619      158.381    27.0619      
1 1 1 39  7  15 o 0 39.2    15.7  ?     ?   184.922   -28.5299     67.9577    -28.5299     104.154    151.47       
1 1 1 39  7  16 o 0 18      18.3  ?     ?   21.7461   -48.5126     18.5127    -48.5126     3.35107    131.487      
1 1 1 39  7  17 o 0 25.1    22.1  ?     ?   120.127   143.081      64.2144    143.081      56.8213    -36.9187     
1 1 1 39  7  18 o 0 27.5    20.8  ?     ?   86.4116   89.5964      83.5288    89.5964      0.120406   -90.4036     
1 1 1 39  7  19 o 0 29      21.7  ?     ?   141.771   -153.588     68.507     -153.588     65.0382    26.412       
1 1 1 39  7  20 o 0 52.8    27.4  ?     ?   161.377   -139.501     128.09     -139.501     20.9497    40.4988      
1 1 1 39  7  21 < 0 93.2    26.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 9  20 < 0 120.9   7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 9  19 o 0 179.3   8.6   ?     ?   260.6     123.374      341.694    123.374      124.828    123.374      
1 1 1 -39 9  18 o 0 70.1    5.8   ?     ?   202.428   31.5287      171.276    31.5287      1.47561    31.5287      
1 1 1 -39 9  17 o 0 115     6.7   ?     ?   156.311   -43.1411     303.666    -43.1411     169.518    -43.1411     
1 1 1 -39 9  16 o 0 16.1    4.3   ?     ?   206.692   -10.6876     32.8563    169.312      215.709    169.312      
1 1 1 -39 9  15 o 0 67.8    4.1   ?     ?   276.849   -52.8794     91.5712    -52.8794     164.127    127.121      
1 1 1 -39 9  14 o 0 67.8    4.2   ?     ?   176.155   -69.366      172.877    -69.366      10.0347    -69.366      
1 1 1 -39 9  13 o 0 133.2   4.6   ?     ?   240.442   176.906      264.873    176.906      58.491     176.906      
1 1 1 -39 9  12 o 0 321.2   7.2   ?     ?   359.495   110.281      449.685    110.281      141.509    110.281      
1 1 1 -39 9  11 o 0 81.9    3.1   ?     ?   302.149   132.952      111.379    132.952      149.453    -47.0482     
1 1 1 -39 9  10 o 0 135.9   3.9   ?     ?   316.739   138.095      215.47     138.095      58.7142    -41.9051     
1 1 1 -39 9  9  o 0 97.5    6.2   ?     ?   229.408   -178.106     204.479    -178.106     4.68304    -178.106     
1 1 1 -39 9  8  o 0 117     6.3   ?     ?   273.172   -61.4509     205.651    -61.4509     39.7084    118.549      
1 1 1 -39 9  7  o 0 65.2    6.1   ?     ?   289.098   -133.496     71.0223    -133.496     189.987    46.5039      
1 1 1 -39 9  6  o 0 18.7    4.7   ?     ?   54.915    123.242      2.1068     123.242      48.5536    -56.7577     
1 1 1 -39 9  5  o 0 8.7     4.8   ?     ?   128.076   85.2199      66.0511    -94.7801     184.712    -94.7801     
1 1 1 -39 9  4  o 0 45.3    6.4   ?     ?   149.451   -88.7368     90.1822    -88.7368     48.8153    91.2632      
1 1 1 -39 9  3  o 0 271.5   11.3  ?     ?   383.108   27.2099      364.775    27.2099      7.24336    27.2099      
1 1 1 -39 9  2  o 0 204.9   9.5   ?     ?   194.329   -49.8853     418.361    -49.8853     236.461    -49.8853     
1 1 1 -39 9  1  o 0 69      2.6   ?     ?   192.864   -118.261     123.483    -118.261     60.7282    61.7385      
1 1 1 39  9  0  o 0 429.5   9.9   ?     ?   401.299   113.646      539.849    113.646      150.938    113.646      
1 1 1 39  9  1  o 0 100.9   4.2   ?     ?   265.911   -43.3806     174.261    -43.3806     79.256     136.619      
1 1 1 39  9  2  o 0 137.3   5.2   ?     ?   126.085   88.7454      338.284    88.7454      217.97     88.7454      
1 1 1 39  9  3  o 0 111.5   5.1   ?     ?   294.592   95.2786      174.905    95.2786      106.344    -84.7214     
1 1 1 39  9  4  o 0 3.9     4.8   ?     ?   66.3566   -109.959     45.5476    70.0407      108.906    70.0407      
1 1 1 39  9  5  o 0 134     6.4   ?     ?   366.471   -116.719     160.364    -116.719     189.449    63.2812      
1 1 1 39  9  6  o 0 3.6     8     ?     ?   206.199   19.1417      132.728    -160.858     329.419    -160.858     
1 1 1 39  9  7  o 0 168     8     ?     ?   231.286   -11.3695     347.519    -11.3695     130.826    -11.3695     
1 1 1 39  9  8  o 0 188     9.9   ?     ?   242.688   -91.7164     372.436    -91.7164     145.413    -91.7164     
1 1 1 39  9  9  o 0 410.2   13.1  ?     ?   283.179   -162.421     650.472    -162.421     392.681    -162.421     
1 1 1 39  9  10 o 0 7.1     11.1  ?     ?   132.346   -116.015     40.3114    63.9848      160.498    63.9848      
1 1 1 39  9  11 o 0 192.8   13.6  ?     ?   243.699   45.0967      384.298    45.0967      162.796    45.0967      
1 1 1 39  9  12 o 0 45.6    15.2  ?     ?   89.715    118.691      131.595    118.691      49.6129    118.691      
1 1 1 39  9  13 o 0 82.8    14.2  ?     ?   112.315   -114.367     258.414    -114.367     151.221    -114.367     
1 1 1 39  9  14 o 0 114     18.8  ?     ?   258.754   74.0487      222.253    74.0487      32.3594    -105.951     
1 1 1 39  9  15 o 0 186.9   19.4  ?     ?   254.821   40.5636      368.371    40.5636      116.936    40.5636      
1 1 1 39  9  16 o 0 353.6   25.5  ?     ?   365.48    61.4575      516.479    61.4575      169.794    61.4575      
1 1 1 39  9  17 o 0 241     28.9  ?     ?   266.994   122.334      443.626    122.334      197.031    122.334      
1 1 1 39  9  18 o 0 30.2    26.8  ?     ?   128.533   106.8        94.09      106.8        22.63      -73.1997     
1 1 1 39  9  19 < 0 107.3   26.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 11 17 < 0 16.5    5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 11 16 o 0 19.3    4.3   ?     ?   92.1365   -166.856     71.7999    -166.856     3.78761    13.1439      
1 1 1 -39 11 15 o 0 10.4    3.8   ?     ?   44.1786   71.8828      13.1326    71.8828      23.3595    -108.117     
1 1 1 -39 11 14 f 1 4.7     3.3   ?     ?   41.9993   -128.457     14.8824    51.5432      50.5192    51.5432      
1 1 1 -39 11 13 o 0 138.5   5     ?     ?   230.11    179.413      287.885    179.413      87.8731    179.413      
1 1 1 -39 11 12 o 0 109.8   4.2   ?     ?   250.082   104.382      210.17     104.382      16.5125    -75.6185     
1 1 1 -39 11 11 o 0 19.1    2.5   ?     ?   206.184   77.3538      21.6895    -102.646     209.937    -102.646     
1 1 1 -39 11 10 o 0 39.3    2.5   ?     ?   167.04    105.422      89.6844    105.422      62.7161    -74.5782     
1 1 1 -39 11 9  o 0 27.9    2.9   ?     ?   125.092   -48.4512     66.5195    -48.4512     44.4019    131.549      
1 1 1 -39 11 8  o 0 309.1   8     ?     ?   480.154   -8.54914     328.411    -8.54914     80.0757    171.451      
1 1 1 -39 11 7  o 0 91.8    7.3   ?     ?   283.218   18.605       146.338    18.605       95.909     -161.395     
1 1 1 -39 11 6  o 0 206     8.7   ?     ?   269.342   109.156      363.075    109.156      133.568    109.156      
1 1 1 -39 11 5  o 0 137.1   8.4   ?     ?   170.596   128.94       319.168    128.94       173.151    128.94       
1 1 1 -39 11 4  o 0 163.9   6.1   ?     ?   282.192   105.887      289.331    105.887      46.8193    105.887      
1 1 1 -39 11 3  o 0 753.4   26.4  ?     ?   513.344   134.118      737.843    134.118      296.758    134.118      
1 1 1 -39 11 2  f 1 232.3   6.9   ?     ?   184.159   134.023      468.354    134.023      308.801    134.023      
1 1 1 -39 11 1  f 1 122     4.4   ?     ?   218.944   65.3365      261.48     65.3365      71.2731    65.3365      
1 1 1 39  11 0  o 0 240.8   6.9   ?     ?   393.182   60.2805      329.237    60.2805      17.535     -119.72      
1 1 1 39  11 1  f 1 8       4     ?     ?   107.634   28.9293      42.8521    -151.071     138.363    -151.071     
1 1 1 39  11 2  f 1 28.1    4.9   ?     ?   233.7     19.4777      3.57655    -160.522     211.077    -160.522     
1 1 1 39  11 3  o 0 16.8    5.1   ?     ?   149.825   71.4647      7.07859    -108.535     139.454    -108.535     
1 1 1 39  11 4  o 0 79.7    6.4   ?     ?   238.959   83.874       157.679    83.874       54.203     -96.126      
1 1 1 39  11 5  o 0 58.1    8.6   ?     ?   134.574   -169.752     163.489    -169.752     44.2366    -169.752     
1 1 1 39  11 6  o 0 328.4   11.3  ?     ?   377.309   -78.0699     457.588    -78.0699     123.58     -78.0699     
1 1 1 39  11 7  o 0 119.8   8.8   ?     ?   307.223   -55.2997     193.604    -55.2997     80.3459    124.7        
1 1 1 39  11 8  o 0 144.2   11.7  ?     ?   257.996   -29.3555     279.257    -29.3555     49.6367    -29.3555     
1 1 1 39  11 9  o 0 113.6   12.4  ?     ?   211.075   -73.9962     262.942    -73.9962     59.4877    -73.9962     
1 1 1 39  11 10 o 0 8.6     13.2  ?     ?   128.794   87.312       18.7285    -92.688      142.529    -92.688      
1 1 1 39  11 11 o 0 446.5   18.2  ?     ?   414.461   93.3028      563.807    93.3028      163.716    93.3028      
1 1 1 39  11 12 o 0 78.6    15.5  ?     ?   173.441   138.827      208.924    138.827      47.7269    138.827      
1 1 1 39  11 13 o 0 96.4    18.4  ?     ?   136.339   53.4734      280.483    53.4734      156.92     53.4734      
1 1 1 39  11 14 f 1 -24.6   17.6  ?     ?   86.7026   130.046      26.3042    -49.9539     104.926    -49.9539     
1 1 1 39  11 15 o 0 4.9     21.6  ?     ?   101.983   174.426      32.7428    174.426      57.6081    -5.57423     
1 1 1 39  11 16 < 0 -16     24.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 13 13 < 0 66.3    5     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 13 12 o 0 32.1    4.6   ?     ?   215.672   -64.4043     45.5816    -64.4043     128.286    115.596      
1 1 1 -39 13 11 o 0 5.4     3.4   ?     ?   81.9528   -43.2208     13.5334    136.779      80.0948    136.779      
1 1 1 -39 13 10 o 0 35.1    4     ?     ?   152.14    80.2385      98.4801    80.2385      25.6733    -99.7615     
1 1 1 -39 13 9  f 1 11.8    3.6   ?     ?   149.722   85.0446      13.5289    -94.9554     138.773    -94.9554     
1 1 1 -39 13 8  o 0 14.8    3.5   ?     ?   62.6373   -4.21083     31.874     -4.21083     20.5707    175.789      
1 1 1 -39 13 7  o 0 71      4.3   ?     ?   241.732   -107.424     132.554    -107.424     75.3099    72.5759      
1 1 1 -39 13 6  f 1 16.9    4.4   ?     ?   105.554   -93.7764     31.8615    -93.7764     59.8397    86.2236      
1 1 1 -39 13 5  o 0 75.3    4.9   ?     ?   204.036   177.464      173.489    177.464      3.68754    -2.53608     
1 1 1 -39 13 4  o 0 45.6    4.3   ?     ?   86.8829   -73.7477     151.543    -73.7477     73.139     -73.7477     
1 1 1 -39 13 3  o 0 85.8    5     ?     ?   153.026   2.49836      231.951    2.49836      93.3375    2.49836      
1 1 1 -39 13 2  o 0 34.3    4.5   ?     ?   120.826   121.709      101.447    121.709      8.36306    -58.2914     
1 1 1 -39 13 1  o 0 134.3   6.1   ?     ?   295.148   111.477      221.566    111.477      47.4469    -68.5225     
1 1 1 39  13 0  o 0 200.1   7.4   ?     ?   238.922   129.72       390.957    129.72       167.395    129.72       
1 1 1 39  13 1  o 0 81      6.7   ?     ?   227.024   -130.131     169.164    -130.131     43.4177    49.869       
1 1 1 39  13 2  o 0 107.4   7.4   ?     ?   234.46    -94.4575     224.357    -94.4575     4.74254    -94.4575     
1 1 1 39  13 3  o 0 1.1     8     ?     ?   138.522   -96.236      66.358     83.764       196.097    83.764       
1 1 1 39  13 4  o 0 7.2     8     ?     ?   64.1272   -84.8134     9.44462    95.1866      69.476     95.1866      
1 1 1 39  13 5  o 0 19.2    9.1   ?     ?   112.235   49.39        33.7808    49.39        67.6549    -130.61      
1 1 1 39  13 6  f 1 128.4   14.9  ?     ?   298.776   51.5041      217.315    51.5041      53.7352    -128.496     
1 1 1 39  13 7  o 0 7.1     11.8  ?     ?   46.7877   -67.7804     3.32766    -67.7804     38.8263    112.22       
1 1 1 39  13 8  o 0 32.6    11.7  ?     ?   80.243    83.1796      106.485    83.1796      35.853     83.1796      
1 1 1 39  13 9  f 1 20.7    14.7  ?     ?   125.868   21.5085      47.3013    21.5085      62.3185    -158.492     
1 1 1 39  13 10 o 0 155.3   18    ?     ?   246.037   22.4345      315.879    22.4345      103.357    22.4345      
1 1 1 39  13 11 o 0 37.6    17.4  ?     ?   198.084   67.6927      58.8952    67.6927      111.986    -112.307     
1 1 1 39  13 12 < 0 57.9    18.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 15 6  < 0 8.4     5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 15 5  < 0 44.2    7.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 15 4  < 0 16.9    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 15 3  < 0 52      6.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 15 2  < 0 4.6     6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -39 15 1  o 0 11.1    7     ?     ?   31.1214   -23.0134     19.9557    -23.0134     5.11236    156.987      
1 1 1 39  15 0  o 0 15.2    7     ?     ?   116.681   4.73437      32.7794    4.73437      64.3061    -175.266     
1 1 1 39  15 1  o 0 19.2    9     ?     ?   56.7294   114.808      66.1018    114.808      18.8782    114.808      
1 1 1 39  15 2  < 0 58.4    8.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 39  15 3  < 0 64.4    9.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 39  15 4  < 0 97.1    11.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 39  15 5  < 0 92.4    13.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 39  15 6  < 0 55.7    14.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 0  24 < 0 74.1    10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 0  23 o 0 100.9   8.4   ?     ?   180.968   0            224.709    0            66.5031    0            
1 1 1 -40 0  22 o 0 11.1    7.8   ?     ?   91.8046   180          34.0405    180          48.1419    4.96142e-15  
1 1 1 -40 0  21 o 0 40.1    5.8   ?     ?   34.593    180          66.8815    180          33.8193    180          
1 1 1 -40 0  20 o 0 10.9    5.1   ?     ?   51.5611   180          19.8248    180          29.5639    4.70522e-15  
1 1 1 -40 0  19 o 0 46.3    5.5   ?     ?   147.222   180          143.248    180          12.1343    180          
1 1 1 -40 0  18 o 0 147.7   8.9   ?     ?   265.526   180          272.951    180          36.4636    180          
1 1 1 -40 0  17 o 0 45.2    4.7   ?     ?   54.7141   0            79.403     0            30.4495    0            
1 1 1 -40 0  16 o 0 42.4    5.3   ?     ?   112.234   180          115.165    180          11.3704    180          
1 1 1 -40 0  15 o 0 21.6    4.3   ?     ?   32.6407   180          18.6119    180          12.3158    1.06038e-14  
1 1 1 -40 0  14 o 0 8.5     3.8   ?     ?   185.644   180          25.3564    180          154.921    1.14845e-15  
1 1 1 -40 0  13 o 0 4.5     3.6   ?     ?   19.4416   180          1.29306    180          17.7098    5.12316e-16  
1 1 1 -40 0  12 o 0 68.2    4.2   ?     ?   341.776   0            166.493    0            131.175    180          
1 1 1 -40 0  11 o 0 2547.3  63.7  ?     ?   985.024   0            1058.73    0            195.985    0            
1 1 1 -40 0  10 o 0 246.6   9.8   ?     ?   340.313   0            329.893    0            32.8673    0            
1 1 1 -40 0  9  o 0 14.8    3.2   ?     ?   27.2107   180          4.68717    180          19.1768    1.71501e-15  
1 1 1 -40 0  8  f 1 35.2    3.4   ?     ?   115.08    0            41.743     0            62.3197    180          
1 1 1 -40 0  7  o 0 2125.4  77.2  ?     ?   805.876   180          984.849    180          256.9      180          
1 1 1 -40 0  6  o 0 22.5    2.5   ?     ?   85.8335   180          20.4069    180          57.4159    2.49389e-15  
1 1 1 -40 0  5  f 1 1282.8  33.2  ?     ?   622.406   0            771.586    0            202.431    0            
1 1 1 -40 0  4  o 0 869     22.4  ?     ?   772.702   180          637.132    180          76.5775    5.83797e-14  
1 1 1 -40 0  3  o 0 450.2   13.2  ?     ?   490.827   180          447.788    180          5.08833    180          
1 1 1 -40 0  2  o 0 -0.7    2.6   ?     ?   58.3914   180          0.454951   180          52.3475    6.0982e-17   
1 1 1 -40 0  1  o 0 96.7    4.7   ?     ?   361.072   0            196.866    0            130.411    180          
1 1 1 40  0  0  o 0 33.4    5.7   ?     ?   199.496   180          62.6394    180          118.564    -2.27633e-14 
1 1 1 40  0  1  o 0 126.4   6.9   ?     ?   88.7246   0            110.367    0            29.6294    0            
1 1 1 40  0  2  o 0 -10.9   4.4   ?     ?   72.0522   180          0.366666   180          65.3031    3.93977e-17  
1 1 1 40  0  3  o 0 38.6    6.3   ?     ?   137.192   180          53.7807    180          74.7987    5.04505e-15  
1 1 1 40  0  4  o 0 947.8   26.3  ?     ?   651.501   0            675.756    0            64.5548    0            
1 1 1 40  0  5  f 1 614.6   24.1  ?     ?   638.132   0            544.285    0            50.6382    180          
1 1 1 40  0  6  o 0 48.7    18.8  ?     ?   363.795   180          115.226    180          222.296    3.63709e-15  
1 1 1 40  0  7  o 0 3.1     7     ?     ?   119.76    0            4.16086    0            106.938    180          
1 1 1 40  0  8  f 1 44.6    8.3   ?     ?   47.3845   180          25.6079    180          17.6329    1.01902e-14  
1 1 1 40  0  9  o 0 328.1   17.2  ?     ?   509.494   180          396.904    180          65.2189    4.27017e-14  
1 1 1 40  0  10 o 0 96      12.3  ?     ?   314.963   180          200.602    180          84.6798    1.66222e-14  
1 1 1 40  0  11 o 0 470.8   28.4  ?     ?   291.31    180          473.242    180          207.563    180          
1 1 1 40  0  12 o 0 1034.6  38.2  ?     ?   814.493   0            700.612    0            40.5117    180          
1 1 1 40  0  13 o 0 4.5     19    ?     ?   12.2853   0            2.04505    0            10.542     180          
1 1 1 40  0  14 o 0 3.4     18.6  ?     ?   118.49    0            22.4336    0            96.465     180          
1 1 1 40  0  15 o 0 -4.1    17.4  ?     ?   22.7042   0            3.83955    0            18.4804    180          
1 1 1 40  0  16 o 0 125.4   20    ?     ?   281.346   180          266.886    180          8.56437    2.18657e-13  
1 1 1 40  0  17 o 0 136.1   25.4  ?     ?   233.913   0            274.185    0            51.8888    0            
1 1 1 40  0  18 o 0 271.5   31.9  ?     ?   231.23    0            389.799    0            170.32     0            
1 1 1 40  0  19 o 0 51.6    33.9  ?     ?   94.9514   180          111.272    180          13.1114    180          
1 1 1 40  0  20 o 0 -23.9   29.3  ?     ?   26.9196   180          8.73569    180          19.1402    3.20246e-15  
1 1 1 -40 2  24 < 0 56.2    7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 2  23 o 0 40.9    5.2   ?     ?   98.8989   -102.376     164.286    -102.376     78.3913    -102.376     
1 1 1 -40 2  22 o 0 50.2    5.7   ?     ?   114.617   -76.2252     174.019    -76.2252     72.2819    -76.2252     
1 1 1 -40 2  21 o 0 248.4   7.7   ?     ?   326.184   -6.91098     403.015    -6.91098     104.213    -6.91098     
1 1 1 -40 2  20 o 0 467.1   10.6  ?     ?   466.531   20.993       535.799    20.993       89.0943    20.993       
1 1 1 -40 2  19 o 0 242     6.7   ?     ?   253.917   62.0027      440.029    62.0027      215.594    62.0027      
1 1 1 -40 2  18 o 0 44.5    4     ?     ?   44.3807   119.939      90.722     119.939      51.4796    119.939      
1 1 1 -40 2  17 o 0 42.8    3.2   ?     ?   104.14    -116.148     120.359    -116.148     27.8258    -116.148     
1 1 1 -40 2  16 o 0 59.6    3.2   ?     ?   190.856   -130.485     130.505    -130.485     44.8372    49.5149      
1 1 1 -40 2  15 o 0 38.9    2.9   ?     ?   139.238   122.696      71.8393    122.696      59.2627    -57.304      
1 1 1 -40 2  14 o 0 214.3   5.3   ?     ?   381.831   130.801      287.671    130.801      74.4712    -49.1994     
1 1 1 -40 2  13 f 1 264.7   6     ?     ?   190.335   -166.414     502.08     -166.414     316.144    -166.414     
1 1 1 -40 2  12 o 0 226.8   5.4   ?     ?   302.42    -65.1237     314.053    -65.1237     52.0805    -65.1237     
1 1 1 -40 2  11 o 0 142.2   5.4   ?     ?   298.921   106.961      186.47     106.961      74.0082    -73.0387     
1 1 1 -40 2  10 o 0 236.1   5.5   ?     ?   443.133   -17.7624     217.82     -17.7624     167.079    162.238      
1 1 1 -40 2  9  o 0 616.9   11.7  ?     ?   629.667   -45.0896     469.598    -45.0896     80.0991    134.91       
1 1 1 -40 2  8  o 0 307.4   7.1   ?     ?   309.311   -44.8281     409.78     -44.8281     138.491    -44.8281     
1 1 1 -40 2  7  o 0 536.1   10.5  ?     ?   456.713   -175.882     528.429    -175.882     117.58     -175.882     
1 1 1 -40 2  6  o 0 454.5   9.1   ?     ?   388.567   -98.9997     504.734    -98.9997     153.818    -98.9997     
1 1 1 -40 2  5  o 0 140.2   4     ?     ?   428.77    49.3022      66.9668    49.3022      321.639    -130.698     
1 1 1 -40 2  4  o 0 156     4.2   ?     ?   185.496   36.4458      232.539    36.4458      63.8743    36.4458      
1 1 1 -40 2  3  o 0 729.5   13.7  ?     ?   680.882   89.6425      506.399    89.6425      122.037    -90.3575     
1 1 1 -40 2  2  o 0 342.8   7.6   ?     ?   474.711   -90.8128     315.799    -90.8129     123.502    89.1871      
1 1 1 -40 2  1  o 0 567.1   12.6  ?     ?   435.38    -56.8859     563.859    -56.8859     170.616    -56.8859     
1 1 1 40  2  0  o 0 2121.2  38.8  ?     ?   1047      4.41287      983.732    4.41287      35.2137    4.41287      
1 1 1 40  2  1  o 0 627.6   12.9  ?     ?   644.982   18.6165      457.595    18.6165      143.596    -161.383     
1 1 1 40  2  2  o 0 914.8   19    ?     ?   610.901   -36.3611     715.131    -36.3611     144.808    -36.3611     
1 1 1 40  2  3  o 0 724.8   18    ?     ?   482.29    31.8218      686.453    31.8218      241.011    31.8218      
1 1 1 40  2  4  o 0 91.5    5.1   ?     ?   278.513   70.3047      70.7605    70.3047      186.724    -109.695     
1 1 1 40  2  5  o 0 489.6   12.2  ?     ?   577.956   -26.3206     396.608    -26.3206     138.047    153.679      
1 1 1 40  2  6  o 0 774.1   16.9  ?     ?   651.113   23.3312      583.138    23.3312      19.3458    -156.669     
1 1 1 40  2  7  o 0 1191.7  24    ?     ?   872.3     92.005       680.517    92.005       126.518    -87.995      
1 1 1 40  2  8  o 0 244     8.9   ?     ?   476.226   11.7839      211.414    11.7839      219.759    -168.216     
1 1 1 40  2  9  o 0 188.1   8     ?     ?   366.926   -27.0536     213.132    -27.0536     118.747    152.946      
1 1 1 40  2  10 o 0 95.8    8.9   ?     ?   325.468   -94.5689     80.8128    -94.5689     215.712    85.4311      
1 1 1 40  2  11 o 0 508     15.7  ?     ?   784.389   -163.592     249.664    -163.592     463.597    16.4076      
1 1 1 40  2  12 o 0 231.8   11.3  ?     ?   282.563   -67.696      407.758    -67.696      118.34     -67.696      
1 1 1 40  2  13 f 1 56.2    10.6  ?     ?   105.694   69.7488      107.93     69.7488      0.573269   -110.251     
1 1 1 40  2  14 o 0 35.9    13.7  ?     ?   60.4331   34.7978      48.3817    34.7978      12.0614    -145.202     
1 1 1 40  2  15 o 0 22.9    13.8  ?     ?   103.261   -124.182     24.7859    -124.182     76.3822    55.8183      
1 1 1 40  2  16 o 0 85      14.2  ?     ?   114.748   -82.4795     257.301    -82.4795     148.142    -82.4795     
1 1 1 40  2  17 o 0 135.2   17.8  ?     ?   297.665   -144.929     244.202    -144.929     38.6992    35.0707      
1 1 1 40  2  18 o 0 33.5    19.6  ?     ?   154.359   -109.549     65.1065    -109.549     82.1236    70.4507      
1 1 1 40  2  19 o 0 81.8    21.5  ?     ?   288.606   -57.4607     117.571    -57.4607     179.592    122.539      
1 1 1 40  2  20 o 0 43.6    27.9  ?     ?   90.8589   -25.7636     134.997    -25.7636     41.3048    -25.7636     
1 1 1 40  2  21 o 0 124     34.8  ?     ?   184.347   -28.0519     279.004    -28.0519     96.48      -28.0519     
1 1 1 40  2  22 o 0 -15.9   29.6  ?     ?   154.513   -56.0284     4.88521    123.972      151.728    123.972      
1 1 1 -40 4  23 < 0 120.1   6.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 4  22 o 0 143.6   7.5   ?     ?   213.445   159.567      327.602    159.567      143.643    159.567      
1 1 1 -40 4  21 o 0 99.3    6.4   ?     ?   179.385   60.4836      261.767    60.4836      103.423    60.4836      
1 1 1 -40 4  20 o 0 20.5    5.4   ?     ?   157.74    -53.133      19.6929    -53.133      128.994    126.867      
1 1 1 -40 4  19 o 0 11.6    4.5   ?     ?   53.3444   -21.8192     1.43295    -21.8192     48.9715    158.181      
1 1 1 -40 4  18 o 0 15.3    4     ?     ?   19.5323   151.86       6.55347    151.86       10.6093    -28.14       
1 1 1 -40 4  17 o 0 101.1   4.1   ?     ?   244.258   -151.953     203.244    -151.953     11.438     28.0468      
1 1 1 -40 4  16 o 0 77.8    3.5   ?     ?   219.255   93.3012      167.684    93.3012      25.9435    -86.6988     
1 1 1 -40 4  15 o 0 62.2    3.2   ?     ?   206.844   84.2078      126.536    84.2078      62.3111    -95.7922     
1 1 1 -40 4  14 o 0 120.1   5.4   ?     ?   327.099   128.844      172.847    128.844      128.075    -51.1563     
1 1 1 -40 4  13 o 0 169.2   4.6   ?     ?   385.417   -55.0702     207.822    -55.0702     155.363    124.93       
1 1 1 -40 4  12 o 0 22.2    2     ?     ?   24.3671   -129.373     0.167446   50.6268      23.6942    50.6268      
1 1 1 -40 4  11 f 1 56.5    2.5   ?     ?   111.922   20.5308      106.492    20.5308      2.80729    -159.469     
1 1 1 -40 4  10 f 1 292     6.3   ?     ?   305.368   138.554      395.147    138.554      129.492    138.554      
1 1 1 -40 4  9  o 0 36.7    2.2   ?     ?   206.273   20.6198      11.7482    -159.38      191.241    -159.38      
1 1 1 -40 4  8  o 0 941.6   17.3  ?     ?   749.882   -116.502     611.995    -116.502     38.0825    63.4979      
1 1 1 -40 4  7  f 1 189.7   4.8   ?     ?   327.071   -88.7912     234.476    -88.7912     51.8215    91.2088      
1 1 1 -40 4  6  o 0 101.9   3.9   ?     ?   162.425   -63.1845     146.649    -63.1845     4.60957    -63.1845     
1 1 1 -40 4  5  o 0 402.2   9.7   ?     ?   506.716   -35.3485     354.755    -35.3485     99.5037    144.652      
1 1 1 -40 4  4  o 0 1152.6  24.4  ?     ?   724.798   -86.0686     764.946    -86.0686     112.962    -86.0686     
1 1 1 -40 4  3  o 0 154.4   3.9   ?     ?   302.565   -137.354     181.09     -137.354     91.9128    42.6458      
1 1 1 -40 4  2  o 0 81.5    2.8   ?     ?   279.42    -25.1497     44.9357    -25.1497     207.87     154.85       
1 1 1 -40 4  1  o 0 844.5   16.9  ?     ?   462.086   -142.826     782.346    -142.826     363.273    -142.826     
1 1 1 40  4  0  o 0 622     14.2  ?     ?   458.797   -101.308     610.775    -101.308     192.652    -101.308     
1 1 1 40  4  1  o 0 62.5    4.5   ?     ?   203.395   44.3132      27.7307    44.3132      157.959    -135.687     
1 1 1 40  4  2  o 0 1265.2  25.3  ?     ?   670.553   31.3312      894.837    31.3312      281.754    31.3312      
1 1 1 40  4  3  o 0 734.2   16.7  ?     ?   640.679   74.3597      554.327    74.3597      32.1239    -105.64      
1 1 1 40  4  4  o 0 601     13.3  ?     ?   710.085   100.618      382.628    100.618      267.894    -79.3816     
1 1 1 40  4  5  o 0 558.9   13.2  ?     ?   622.235   27.5408      437.019    27.5408      121.41     -152.459     
1 1 1 40  4  6  o 0 649.7   16.3  ?     ?   459.643   -58.9281     651.935    -58.9281     239.39     -58.9281     
1 1 1 40  4  7  f 1 426.2   10.9  ?     ?   484.015   73.4352      419.615    73.4352      16.8989    -106.565     
1 1 1 40  4  8  o 0 404.9   11.3  ?     ?   403.053   40.7921      462.738    40.7921      101.371    40.7921      
1 1 1 40  4  9  o 0 441.5   13.4  ?     ?   400.201   -12.839      510.22     -12.839      148.699    -12.839      
1 1 1 40  4  10 f 1 41.1    8     ?     ?   45.6889   -82.847      15.9716    -82.847      25.4453    97.153       
1 1 1 40  4  11 f 1 115.9   9     ?     ?   252.611   29.4249      210.267    29.4249      47.7398    -150.575     
1 1 1 40  4  12 o 0 30.8    10.2  ?     ?   189.659   -3.8285      12.0363    176.171      204.258    176.171      
1 1 1 40  4  13 o 0 86.4    12.1  ?     ?   229.591   103.94       172.26     103.94       55.6731    -76.0598     
1 1 1 40  4  14 o 0 99.4    14.1  ?     ?   173.391   4.4074       256.279    4.4074       87.6109    4.4074       
1 1 1 40  4  15 o 0 54.4    13.9  ?     ?   218.476   -144.255     105.36     -144.255     101.047    35.7448      
1 1 1 40  4  16 o 0 -17.6   17.1  ?     ?   101.439   84.1589      46.1281    -95.8411     141.898    -95.8411     
1 1 1 40  4  17 o 0 56.1    17.6  ?     ?   122.158   126.448      171.205    126.448      55.4322    126.448      
1 1 1 40  4  18 o 0 14.3    22.3  ?     ?   110.202   -170.64      35.3849    -170.64      77.3857    9.36049      
1 1 1 40  4  19 o 0 15.7    26    ?     ?   80.8049   144.502      59.932     144.502      22.8968    -35.4978     
1 1 1 40  4  20 o 0 75.6    25.4  ?     ?   177.12    -147.409     194.273    -147.409     19.914     -147.409     
1 1 1 40  4  21 o 0 70.5    25.3  ?     ?   168.537   -123.25      177.84     -123.25      16.4613    -123.25      
1 1 1 40  4  22 o 0 18.8    25.8  ?     ?   203.122   -178.12      5.5788     -178.12      185.468    1.87971      
1 1 1 -40 6  22 < 1 21      7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 6  21 o 0 29.4    6.7   ?     ?   113.508   -14.9238     101.128    -14.9238     4.59328    -14.9238     
1 1 1 -40 6  20 o 0 65.8    6.2   ?     ?   206.573   -58.7887     155.569    -58.7887     24.3452    121.211      
1 1 1 -40 6  19 o 0 7       5.5   ?     ?   48.1921   43.4971      9.20288    -136.503     52.5097    -136.503     
1 1 1 -40 6  18 o 0 18.6    4.3   ?     ?   55.18     14.1535      41.229     14.1535      10.5889    -165.846     
1 1 1 -40 6  17 o 0 24      3.8   ?     ?   138.163   58.9511      46.4708    58.9511      83.5126    -121.049     
1 1 1 -40 6  16 o 0 188     6.1   ?     ?   357.625   157.413      270.901    157.413      41.8021    -22.5868     
1 1 1 -40 6  15 f 1 29      3     ?     ?   102.907   97.2159      68.2762    97.2159      22.138     -82.7841     
1 1 1 -40 6  14 f 1 58.3    3.1   ?     ?   202.059   79.4061      124.776    79.4061      53.4989    -100.594     
1 1 1 -40 6  13 o 0 14.2    2.6   ?     ?   133.088   -70.1411     22.7307    109.859      143.436    109.859      
1 1 1 -40 6  12 o 0 441.5   10.2  ?     ?   438.494   164.48       520.215    164.48       112.906    164.48       
1 1 1 -40 6  11 o 0 429.6   11.1  ?     ?   475.256   92.8175      477.932    92.8176      33.5588    92.8176      
1 1 1 -40 6  10 o 0 96.3    2.9   ?     ?   195.138   50.4722      193.413    50.4722      6.56906    50.4722      
1 1 1 -40 6  9  o 0 196.7   4.3   ?     ?   218.081   -124.807     376.616    -124.807     166.612    -124.807     
1 1 1 -40 6  8  o 0 56.6    2.4   ?     ?   264.816   117.289      20.7114    117.289      206.332    -62.7114     
1 1 1 -40 6  7  o 0 253.9   8.6   ?     ?   251.623   139.024      381.602    139.024      164.825    139.024      
1 1 1 -40 6  6  o 0 175     7     ?     ?   265.22    145.644      261.823    145.644      32.3215    145.644      
1 1 1 -40 6  5  f 1 263.1   8.9   ?     ?   498.66    6.65641      210.865    6.65641      224.597    -173.344     
1 1 1 -40 6  4  o 0 212.9   8.2   ?     ?   283.666   -3.33696     295.728    -3.33696     50.536     -3.33696     
1 1 1 -40 6  3  o 0 8.1     4.8   ?     ?   80.2087   27.5304      54.5402    -152.47      124.093    -152.47      
1 1 1 -40 6  2  o 0 208.7   6.6   ?     ?   306.424   -61.0606     277.343    -61.0606     10.8727    -61.0606     
1 1 1 -40 6  1  o 0 871.2   16.3  ?     ?   399.974   -179.021     849.012    -179.021     500.334    -179.021     
1 1 1 40  6  0  o 0 415.6   9.6   ?     ?   401.864   36.7202      465.963    36.7202      112.779    36.7202      
1 1 1 40  6  1  o 0 162.1   5.4   ?     ?   282.923   6.27607      221.541    6.27607      27.5068    -173.724     
1 1 1 40  6  2  o 0 838.8   16.9  ?     ?   234.336   -81.5235     945.631    -81.5236     739.089    -81.5236     
1 1 1 40  6  3  o 0 15.3    3.6   ?     ?   144.165   145.822      76.1154    -34.178      203.301    -34.178      
1 1 1 40  6  4  o 0 374.9   9.4   ?     ?   290.336   -40.4645     503.131    -40.4645     246.839    -40.4645     
1 1 1 40  6  5  f 1 67.2    5     ?     ?   130.018   -40.5694     96.4162    -40.5694     19.9807    139.431      
1 1 1 40  6  6  o 0 361.4   10    ?     ?   348.603   166.929      457.746    166.929      147.317    166.929      
1 1 1 40  6  7  o 0 159.6   8     ?     ?   80.6447   -76.1013     245.802    -76.1013     174.031    -76.1013     
1 1 1 40  6  8  o 0 189     8.7   ?     ?   331.047   -84.6722     287.281    -84.6722     45.0311    95.3278      
1 1 1 40  6  9  o 0 43.6    7.8   ?     ?   174.261   -1.69034     53.2103    -1.69034     121.459    178.31       
1 1 1 40  6  10 o 0 291     10.8  ?     ?   291.863   119.352      493.375    119.352      206.488    119.352      
1 1 1 40  6  11 o 0 39.1    8.6   ?     ?   171.353   72.9906      60.7207    72.9906      107.31     -107.009     
1 1 1 40  6  12 o 0 20.6    10    ?     ?   117.25    85.5569      10.0955    85.5569      102.638    -94.4431     
1 1 1 40  6  13 o 0 68.1    12.1  ?     ?   219.227   -52.0152     147.439    -52.0152     57.4166    127.985      
1 1 1 40  6  14 f 1 179.2   13.8  ?     ?   231.889   88.2771      379.972    88.2771      162.993    88.2771      
1 1 1 40  6  15 f 1 5.5     16.6  ?     ?   143.303   -51.3681     29.8134    128.632      163.838    128.632      
1 1 1 40  6  16 o 0 162.1   19.6  ?     ?   289.165   -70.5195     295.91     -70.5195     25.7648    -70.5195     
1 1 1 40  6  17 o 0 204.4   19.2  ?     ?   224.204   -81.5733     438.005    -81.5733     211.799    -81.5733     
1 1 1 40  6  18 o 0 -0.7    19.8  ?     ?   87.4004   -108.457     5.81272    -108.457     82.5346    71.5433      
1 1 1 40  6  19 o 0 75.1    27.4  ?     ?   139.926   -122.85      195.74     -122.85      59.8813    -122.85      
1 1 1 40  6  20 o 0 12.2    27.8  ?     ?   69.7655   -72.4123     68.6753    -72.4123     3.63504    -72.4123     
1 1 1 40  6  21 o 0 21.6    28.2  ?     ?   63.4887   -93.9434     99.7081    -93.9434     40.7919    -93.9434     
1 1 1 -40 8  21 < 0 45.3    7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 8  20 o 0 107.5   7     ?     ?   209.985   46.6952      252.821    46.6952      77.6153    46.6952      
1 1 1 -40 8  19 f 1 28.7    5.8   ?     ?   141.607   106.042      81.6177    106.042      38.1306    -73.9581     
1 1 1 -40 8  18 o 0 31.8    5.5   ?     ?   111.115   -19.4432     105.495    -19.4432     9.81874    -19.4432     
1 1 1 -40 8  17 o 0 61.2    7.6   ?     ?   243.836   -91.764      106.736    -91.764      109.766    88.236       
1 1 1 -40 8  16 o 0 129.9   5.1   ?     ?   206.567   73.8028      292.002    73.8028      100.452    73.8028      
1 1 1 -40 8  15 o 0 101.7   4.5   ?     ?   214.254   0.469465     227.768    0.469465     28.8432    0.469465     
1 1 1 -40 8  14 f 1 38.2    3.2   ?     ?   104.548   147.069      110.085    147.069      19.4608    147.069      
1 1 1 -40 8  13 o 0 260.4   6.4   ?     ?   224.447   121.87       479.051    121.87       285.67     121.87       
1 1 1 -40 8  12 o 0 261.7   6.2   ?     ?   368.678   85.2231      371.81     85.2231      53.0225    85.2231      
1 1 1 -40 8  11 o 0 733.2   13.7  ?     ?   633.093   106.946      633.259    106.946      82.0549    106.946      
1 1 1 -40 8  10 o 0 496.3   10.4  ?     ?   474.052   127.554      547.709    127.554      121.706    127.554      
1 1 1 -40 8  9  o 0 50.8    5.1   ?     ?   150.943   -141.313     123.322    -141.313     13.1353    38.6871      
1 1 1 -40 8  8  o 0 77.2    4.9   ?     ?   118.602   135.065      192.328    135.065      82.6816    135.065      
1 1 1 -40 8  7  f 1 201.8   8.1   ?     ?   183.638   34.4143      416.754    34.4143      245.239    34.4143      
1 1 1 -40 8  6  o 0 14.8    5     ?     ?   36.0115   32.3962      6.12039    -147.604     39.7386    -147.604     
1 1 1 -40 8  5  o 0 76.5    5.8   ?     ?   206.156   -154.349     136.285    -154.349     60.419     25.6511      
1 1 1 -40 8  4  o 0 125.2   7.5   ?     ?   232.626   -170.175     233.335    -170.175     10.5301    -170.175     
1 1 1 -40 8  3  o 0 922.1   27.6  ?     ?   433.63    149.778      947.828    149.778      531.098    149.778      
1 1 1 -40 8  2  o 0 32.2    5.7   ?     ?   56.8772   110.111      20.8658    110.111      33.9572    -69.8892     
1 1 1 -40 8  1  o 0 486.3   10.4  ?     ?   453.258   52.9933      553.174    52.9933      115.165    52.9933      
1 1 1 40  8  0  o 0 1211.3  22.7  ?     ?   691.894   157.016      932.193    157.016      255.059    157.016      
1 1 1 40  8  1  o 0 256.9   6.9   ?     ?   353.172   -43.6926     368.627    -43.6926     22.5126    -43.6926     
1 1 1 40  8  2  o 0 8.2     3.6   ?     ?   99.5857   30.0191      64.4116    -149.981     162.108    -149.981     
1 1 1 40  8  3  o 0 82.6    4.7   ?     ?   71.2726   82.3666      151.172    82.3666      81.2056    82.3666      
1 1 1 40  8  4  o 0 5.4     4.2   ?     ?   213.818   -126.335     162.561    53.6649      372.523    53.6649      
1 1 1 40  8  5  o 0 101.7   6.1   ?     ?   309.889   27.0534      126.45     27.0534      177.82     -152.947     
1 1 1 40  8  6  o 0 154.1   7     ?     ?   190.301   -0.202614    344.267    -0.202614    160.772    -0.202614    
1 1 1 40  8  7  f 1 2.7     7.3   ?     ?   115.199   -170.462     75.6107    9.5384       187.158    9.5384       
1 1 1 40  8  8  o 0 36.7    6.8   ?     ?   80.2348   85.0091      64.1586    85.0091      13.0309    -94.9909     
1 1 1 40  8  9  o 0 59.5    7.6   ?     ?   236.896   -115.833     99.075     -115.833     124.621    64.1666      
1 1 1 40  8  10 o 0 248.5   10.4  ?     ?   423.762   -37.7874     327.121    -37.7874     62.1922    142.213      
1 1 1 40  8  11 o 0 -0.9    9.8   ?     ?   108.954   58.2491      54.8988    -121.751     154.727    -121.751     
1 1 1 40  8  12 o 0 117.6   12.2  ?     ?   216.421   131.882      267.374    131.882      68.9615    131.882      
1 1 1 40  8  13 o 0 23.2    14.1  ?     ?   43.9282   141.356      33.8417    141.356      6.63774    -38.6436     
1 1 1 40  8  14 f 1 26.7    16.7  ?     ?   228.584   56.6612      16.5775    -123.339     237.645    -123.339     
1 1 1 40  8  15 o 0 108.2   18.3  ?     ?   177.459   -84.0254     280.684    -84.0254     104.689    -84.0254     
1 1 1 40  8  16 o 0 10.6    20.4  ?     ?   138.722   -77.2061     8.2637     -77.2061     129.659    102.794      
1 1 1 40  8  17 o 0 52.9    22.7  ?     ?   125.221   -141.388     144.56     -141.388     24.9018    -141.388     
1 1 1 40  8  18 o 0 37.4    20    ?     ?   129.909   -25.952      107.849    -25.952      11.4154    154.048      
1 1 1 40  8  19 f 1 90.5    29.3  ?     ?   145.629   -28.157      238.305    -28.157      104.464    -28.157      
1 1 1 -40 10 18 < 0 41.8    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 10 17 o 0 16.4    4.2   ?     ?   47.6517   47.2223      57.1604    47.2223      17.7698    47.2223      
1 1 1 -40 10 16 o 0 37.4    3.8   ?     ?   124.151   32.6795      125.805    32.6795      22.436     32.6795      
1 1 1 -40 10 15 o 0 18.2    4     ?     ?   143.063   -43.5193     27.7298    -43.5193     94.049     136.481      
1 1 1 -40 10 14 f 1 53.3    4.3   ?     ?   170.95    -17.0233     138.463    -17.0233     12.1949    162.977      
1 1 1 -40 10 13 f 1 65.8    3.8   ?     ?   211.006   110.46       139.042    110.46       54.9554    -69.5399     
1 1 1 -40 10 12 f 1 68.9    3.2   ?     ?   218.738   74.1509      140.915    74.1509      60.2174    -105.849     
1 1 1 -40 10 11 o 0 81.9    3.1   ?     ?   258.469   -45.0947     149.251    -45.0947     80.7472    134.905      
1 1 1 -40 10 10 o 0 13.6    2.2   ?     ?   162.92    -16.8221     24.2401    163.178      163.449    163.178      
1 1 1 -40 10 9  f 1 90.9    6.6   ?     ?   278.798   -0.463647    147.062    -0.463647    91.7885    179.536      
1 1 1 -40 10 8  f 1 300.4   11.9  ?     ?   324.332   -20.1215     449.682    -20.1215     170.214    -20.1215     
1 1 1 -40 10 7  o 0 106     6.7   ?     ?   208.755   17.4743      234.327    17.4743      55.0908    17.4743      
1 1 1 -40 10 6  o 0 351.2   12.2  ?     ?   350.653   109.486      496.83     109.486      194.29     109.486      
1 1 1 -40 10 5  f 1 15.1    5.2   ?     ?   58.9496   -84.4785     4.71578    -84.4785     46.6335    95.5215      
1 1 1 -40 10 4  o 0 122.9   9.2   ?     ?   177.555   84.8304      284.202    84.8304      125.771    84.8304      
1 1 1 -40 10 3  o 0 587.6   20.8  ?     ?   392.089   59.3492      700.559    59.3492      349.458    59.3492      
1 1 1 -40 10 2  o 0 97      4.4   ?     ?   124.098   18.2563      256.724    18.2563      145.252    18.2563      
1 1 1 -40 10 1  o 0 27.9    2.5   ?     ?   182.126   -96.1664     21.958     -96.1664     142.08     83.8336      
1 1 1 40  10 0  f 1 58.9    3.4   ?     ?   172.654   -77.2275     138.952    -77.2275     20.2102    102.773      
1 1 1 40  10 1  o 0 207.1   6.2   ?     ?   250.232   -65.4919     391.381    -65.4919     161.624    -65.4919     
1 1 1 40  10 2  o 0 346.5   8.9   ?     ?   474.651   -87.2976     392.958    -87.2976     43.1864    92.7024      
1 1 1 40  10 3  o 0 23.9    5.3   ?     ?   127.808   70.1476      28.5119    70.1476      88.9712    -109.852     
1 1 1 40  10 4  o 0 31.9    4.7   ?     ?   144.858   -5.2235      68.6062    -5.2235      61.2328    174.777      
1 1 1 40  10 5  f 1 251.4   10.3  ?     ?   350.802   -70.6271     383.282    -70.6271     67.3685    -70.6271     
1 1 1 40  10 6  o 0 255.9   9.9   ?     ?   291.997   -12.1276     439.447    -12.1276     178.054    -12.1276     
1 1 1 40  10 7  o 0 207.2   9.1   ?     ?   327.036   -48.0629     337.077    -48.0629     43.583     -48.0629     
1 1 1 40  10 8  f 1 290.1   11.8  ?     ?   331.965   -80.647      450.035    -80.647      151.091    -80.647      
1 1 1 40  10 9  f 1 301.4   13.7  ?     ?   333.536   -126.986     461.74     -126.986     159.393    -126.986     
1 1 1 40  10 10 o 0 81.9    10.8  ?     ?   237.63    -169.879     164.406    -169.879     49.3498    10.1209      
1 1 1 40  10 11 o 0 22.8    12.4  ?     ?   168.12    52.9246      12.3288    52.9246      151.342    -127.075     
1 1 1 40  10 12 f 1 11.8    16.2  ?     ?   108.413   -33.4517     16.033     -33.4517     90.479     146.548      
1 1 1 40  10 13 f 1 67.3    19.2  ?     ?   108.025   84.3798      213.757    84.3799      108.041    84.3799      
1 1 1 40  10 14 f 1 48.4    18.2  ?     ?   150.474   109.587      127.257    109.587      14.4218    -70.4128     
1 1 1 40  10 15 o 0 95.2    22.6  ?     ?   190.574   168.534      234.386    168.534      60.4304    168.534      
1 1 1 40  10 16 o 0 73.8    25.1  ?     ?   207.493   140.048      154.151    140.048      31.7975    -39.9521     
1 1 1 40  10 17 o 0 33.7    23.7  ?     ?   165.289   -161.5       69.3633    -161.5       78.2519    18.4996      
1 1 1 -40 12 15 < 0 150.1   6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 12 14 o 0 115.7   5.2   ?     ?   207.273   46.5255      264.494    46.5255      96.5988    46.5255      
1 1 1 -40 12 13 o 0 10.4    3.6   ?     ?   110.257   -6.21357     10.987     -6.21357     79.0683    173.786      
1 1 1 -40 12 12 f 1 9.6     3.3   ?     ?   50.5392   -157.822     10.214     -157.822     31.51      22.1784      
1 1 1 -40 12 11 o 0 38.5    3.3   ?     ?   195.047   150.753      77.6125    150.753      85.9075    -29.2473     
1 1 1 -40 12 10 o 0 -6.1    2.6   ?     ?   23.1225   150.854      18.3088    -29.1463     38.2439    -29.1463     
1 1 1 -40 12 9  f 1 132.4   4.9   ?     ?   200.586   -35.224      297.582    -35.224      122.633    -35.224      
1 1 1 -40 12 8  f 1 36.5    3.6   ?     ?   154.755   -23.858      88.7887    -23.858      51.7279    156.142      
1 1 1 -40 12 7  o 0 99.9    5.9   ?     ?   170.902   -156.677     251.729    -156.677     96.4892    -156.677     
1 1 1 -40 12 6  o 0 49.9    3.9   ?     ?   197.596   99.1046      102.037    99.1046      77.0193    -80.8954     
1 1 1 -40 12 5  o 0 87.2    4.8   ?     ?   218.843   101.529      186.575    101.529      12.652     -78.4708     
1 1 1 -40 12 4  o 0 14.3    2.8   ?     ?   67.9252   124.383      15.8366    124.383      46.2585    -55.6171     
1 1 1 -40 12 3  o 0 15.4    2.7   ?     ?   148.142   81.5685      4.91626    -98.4315     140.848    -98.4315     
1 1 1 -40 12 2  o 0 55.5    3.6   ?     ?   158.883   157.677      149.171    157.677      7.90831    157.677      
1 1 1 -40 12 1  o 0 199.6   6.2   ?     ?   338.342   82.1415      296.589    82.1415      8.83876    82.1415      
1 1 1 40  12 0  o 0 174.6   6.5   ?     ?   251.489   153.827      333.109    153.827      114.012    153.827      
1 1 1 40  12 1  o 0 42.3    4.8   ?     ?   210.555   -179.802     69.756     -179.802     113.84     0.197545     
1 1 1 40  12 2  o 0 11.3    5.3   ?     ?   68.1613   -21.8947     6.10315    158.105      68.4436    158.105      
1 1 1 40  12 3  o 0 28      6     ?     ?   69.5441   105.114      78.5035    105.114      12.6399    105.114      
1 1 1 40  12 4  o 0 82.4    7.4   ?     ?   198.512   -79.9153     197.651    -79.9153     9.70533    -79.9153     
1 1 1 40  12 5  o 0 86.3    7.5   ?     ?   217.775   -44.0908     191.595    -44.0908     14.4368    135.909      
1 1 1 40  12 6  o 0 20.1    8.4   ?     ?   121.987   -67.3626     27.3855    -67.3626     87.8898    112.637      
1 1 1 40  12 7  o 0 29.1    10.3  ?     ?   131.267   -10.6936     69.887     -10.6936     54.8911    169.306      
1 1 1 40  12 8  f 1 17.6    12.3  ?     ?   121.465   49.9801      20.3464    49.9801      95.4739    -130.02      
1 1 1 40  12 9  f 1 211.5   15.6  ?     ?   275.247   45.2504      386.7      45.2504      133.702    45.2504      
1 1 1 40  12 10 o 0 301.7   18.3  ?     ?   405.943   83.5877      407.092    83.5877      44.6633    83.5877      
1 1 1 40  12 11 o 0 30.7    14.4  ?     ?   152.045   125.051      65.2249    125.05       70.0699    -54.9495     
1 1 1 40  12 12 f 1 137.5   19.1  ?     ?   295.388   168.466      242.584    168.466      17.1853    -11.5341     
1 1 1 40  12 13 o 0 47      19.6  ?     ?   134.672   -140.19      135.06     -140.19      17.4673    -140.19      
1 1 1 40  12 14 < 0 50.3    23.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 14 10 < 0 42.8    5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 14 9  < 0 1.4     3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -40 14 8  o 0 33      4.6   ?     ?   142.179   -23.7301     99.9857    -23.7301     13.8547    156.27       
1 1 1 -40 14 7  o 0 126.7   6.5   ?     ?   210.263   -124.339     280.895    -124.339     111.575    -124.339     
1 1 1 -40 14 6  o 0 13.6    4.5   ?     ?   64.3612   -124.672     42.9371    -124.672     9.16494    55.3282      
1 1 1 -40 14 5  o 0 58.2    5.2   ?     ?   221.03    -168.38      121.285    -168.38      58.102     11.6198      
1 1 1 -40 14 4  o 0 31.5    5     ?     ?   125.167   -74.8967     100.406    -74.8967     1.62175    105.103      
1 1 1 -40 14 3  o 0 44.5    5.6   ?     ?   137.608   90.9615      138.737    90.9615      26.1304    90.9615      
1 1 1 -40 14 2  o 0 33.9    4.7   ?     ?   152.72    144.378      94.0217    144.378      31.3825    -35.6221     
1 1 1 -40 14 1  o 0 120.8   6.5   ?     ?   182.503   120.49       288.772    120.49       136.475    120.49       
1 1 1 40  14 0  o 0 30.1    5.6   ?     ?   64.623    78.8753      101.201    78.8753      45.6143    78.8753      
1 1 1 40  14 1  o 0 48.4    6.4   ?     ?   122.133   147.384      158.8      147.384      53.681     147.384      
1 1 1 40  14 2  o 0 101.4   7.6   ?     ?   99.0452   -132.815     314.055    -132.815     229.901    -132.815     
1 1 1 40  14 3  o 0 7.6     7.3   ?     ?   48.5406   -105.801     4.53155    -105.801     36.703     74.1993      
1 1 1 40  14 4  o 0 134.1   9.5   ?     ?   279.074   -10.1988     252.397    -10.1988     15.4741    -10.1988     
1 1 1 40  14 5  o 0 53.1    11.4  ?     ?   137.975   65.677       165.981    65.677       48.9678    65.677       
1 1 1 40  14 6  o 0 179     13.3  ?     ?   380.993   66.7467      246.275    66.7467      77.0889    -113.253     
1 1 1 40  14 7  o 0 161.8   14.2  ?     ?   290.622   50.7271      290.136    50.7271      43.9401    50.7271      
1 1 1 40  14 8  < 0 22.9    14.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 40  14 9  < 0 -8.5    19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 1  24 < 0 65.4    6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 1  23 o 0 69.2    5.5   ?     ?   168.552   -8.18048     204.246    -8.18048     57.9206    -8.18048     
1 1 1 -41 1  22 o 0 20.3    5     ?     ?   149.836   66.7547      35.0296    66.7547      97.8953    -113.245     
1 1 1 -41 1  21 o 0 43.2    4.6   ?     ?   171.287   25.3686      111.798    25.3686      45.0043    -154.631     
1 1 1 -41 1  20 o 0 258.7   7.2   ?     ?   274.167   -26.4686     458.109    -26.4686     195.803    -26.4686     
1 1 1 -41 1  19 o 0 77.2    4.2   ?     ?   232.237   -70.9779     159.706    -70.9779     62.9183    109.022      
1 1 1 -41 1  18 o 0 7.7     3.2   ?     ?   21.4697   -34.2345     7.48756    145.765      26.4517    145.765      
1 1 1 -41 1  17 o 0 4.4     3.3   ?     ?   70.1305   133.906      40.4989    -46.0936     102.74     -46.0936     
1 1 1 -41 1  16 o 0 353     7.6   ?     ?   445.867   123.339      425.791    123.339      16.6917    123.339      
1 1 1 -41 1  15 o 0 381.2   8.4   ?     ?   330.032   122.674      563.367    122.674      258.238    122.674      
1 1 1 -41 1  14 o 0 72.9    3.2   ?     ?   230.809   -27.9526     130.167    -27.9526     88.4095    152.047      
1 1 1 -41 1  13 o 0 293.3   6.5   ?     ?   358.075   -55.245      411.777    -55.245      64.3325    -55.245      
1 1 1 -41 1  12 o 0 160.9   4.3   ?     ?   285.654   63.9129      267.937    63.9129      10.9765    -116.087     
1 1 1 -41 1  11 o 0 42.9    2.4   ?     ?   53.6832   61.971       20.624     61.971       26.0704    -118.029     
1 1 1 -41 1  10 o 0 503.6   10.3  ?     ?   379.36    158.535      570.367    158.535      238.608    158.535      
1 1 1 -41 1  9  o 0 95.5    4.4   ?     ?   219.671   109.148      121.579    109.148      69.8139    -70.8523     
1 1 1 -41 1  8  o 0 12.9    2.1   ?     ?   219.073   0.16213      129.489    -179.838     321.241    -179.838     
1 1 1 -41 1  7  o 0 2039.1  35.7  ?     ?   920.126   178.038      1070.6     178.038      244.611    178.038      
1 1 1 -41 1  6  o 0 1158.1  20.8  ?     ?   674.46    55.783       813.147    55.783       205.34     55.783       
1 1 1 -41 1  5  o 0 1007.8  18.6  ?     ?   550.344   50.4387      823.111    50.4387      325.395    50.4387      
1 1 1 -41 1  4  o 0 104.3   3.4   ?     ?   290.349   -175.639     91.7425    -175.639     171.689    4.36069      
1 1 1 -41 1  3  o 0 207.2   4.9   ?     ?   457.044   -165.917     155.783    -165.917     260.109    14.0834      
1 1 1 -41 1  2  o 0 47.5    2.5   ?     ?   121.099   130.422      2.98104    130.422      108.845    -49.5779     
1 1 1 -41 1  1  o 0 12.6    2.2   ?     ?   144.261   40.2233      95.3363    -139.777     228.869    -139.777     
1 1 1 41  1  0  o 0 1856    33.8  ?     ?   1121.86   63.0968      810.551    63.0968      230.638    -116.903     
1 1 1 41  1  1  o 0 20.9    2.8   ?     ?   220.493   -41.4622     115.526    138.538      320.545    138.538      
1 1 1 41  1  2  o 0 209.3   6.7   ?     ?   352       -41.586      241.406    -41.586      82.4936    138.414      
1 1 1 41  1  3  o 0 1145.9  24.1  ?     ?   717.248   44.9791      785.961    44.9791      125.108    44.9791      
1 1 1 41  1  4  o 0 55.3    4.1   ?     ?   334.704   43.5663      59.9188    -136.434     368.612    -136.434     
1 1 1 41  1  5  o 0 488.1   11.6  ?     ?   209.636   32.0289      661.34     32.0289      467.87     32.0289      
1 1 1 41  1  6  o 0 1700.9  31.7  ?     ?   789.011   99.9656      1046.97    99.9656      318.593    99.9656      
1 1 1 41  1  7  o 0 1295.3  27.6  ?     ?   887.304   55.4004      749.579    55.4004      52.3858    -124.6       
1 1 1 41  1  8  o 0 820.2   20.9  ?     ?   591.637   -22.3439     684.024    -22.3439     149.567    -22.3439     
1 1 1 41  1  9  o 0 168.1   9.6   ?     ?   305.961   -41.8173     222.452    -41.8173     53.6762    138.183      
1 1 1 41  1  10 o 0 122.9   10.1  ?     ?   318.664   -14.1939     142.811    -14.1939     146.897    165.806      
1 1 1 41  1  11 o 0 103     9     ?     ?   278.614   146.279      129.468    146.279      123.362    -33.721      
1 1 1 41  1  12 o 0 921.6   21.6  ?     ?   620.162   3.12813      827.389    3.12813      193.428    3.12813      
1 1 1 41  1  13 o 0 178.2   11.6  ?     ?   306.081   1.35027      308.701    1.35027      2.12141    1.35027      
1 1 1 41  1  14 o 0 41.3    13.2  ?     ?   171.355   -48.9884     68.219     -48.9884     102.863    131.012      
1 1 1 41  1  15 o 0 181.4   15.8  ?     ?   268.918   -132.049     353.574    -132.049     90.5372    -132.049     
1 1 1 41  1  16 o 0 29.2    15.7  ?     ?   106.897   66.1434      59.5105    66.1434      42.0255    -113.857     
1 1 1 41  1  17 o 0 53.7    19.7  ?     ?   158.092   -97.205      131.135    -97.205      18.9089    82.795       
1 1 1 41  1  18 o 0 60      20.8  ?     ?   150.961   -135.603     158.735    -135.603     14.9253    -135.603     
1 1 1 41  1  19 o 0 -12.6   21    ?     ?   48.2064   -141.256     3.84467    38.7444      53.426     38.7444      
1 1 1 41  1  20 o 0 33.6    19.3  ?     ?   43.2907   -8.14715     81.2013    -8.14715     36.6026    -8.14715     
1 1 1 41  1  21 o 0 35.5    18.3  ?     ?   93.2789   38.6656      118.479    38.6656      28.1192    38.6656      
1 1 1 41  1  22 o 0 35.2    26.8  ?     ?   163.442   -179.103     77.7258    -179.103     77.5068    0.896837     
1 1 1 -41 3  23 < 0 25.5    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 3  22 f 1 66      5.2   ?     ?   282.756   -36.2065     100.751    -36.2065     145.009    143.793      
1 1 1 -41 3  21 o 0 220.9   7.8   ?     ?   324.27    -5.896       366.135    -5.896       78.9869    -5.896       
1 1 1 -41 3  20 o 0 21      5     ?     ?   184.079   -20.0327     3.51162    -20.0327     170.533    159.967      
1 1 1 -41 3  19 o 0 89.8    4.9   ?     ?   72.0955   131.509      277.153    131.509      208.832    131.509      
1 1 1 -41 3  18 o 0 75.1    4     ?     ?   166.933   112.534      197.172    112.534      50.0808    112.534      
1 1 1 -41 3  17 o 0 44.6    3.4   ?     ?   29.0511   -50.0783     64.6125    -50.0783     39.0114    -50.0783     
1 1 1 -41 3  16 o 0 158.8   4.7   ?     ?   298.667   66.9052      277.334    66.9052      12.9155    66.9052      
1 1 1 -41 3  15 o 0 51.8    3     ?     ?   203.709   39.8078      97.3696    39.8078      89.0577    -140.192     
1 1 1 -41 3  14 o 0 289.9   6.5   ?     ?   421.046   141.909      358.987    141.909      35.8269    -38.0911     
1 1 1 -41 3  13 o 0 69.2    2.7   ?     ?   110.34    59.6843      174.042    59.6843      69.848     59.6843      
1 1 1 -41 3  12 f 1 49.2    2.4   ?     ?   127.078   -6.12335     83.7337    -6.12335     39.8373    173.877      
1 1 1 -41 3  11 o 0 199.2   4.8   ?     ?   511.683   71.9947      119.184    71.9947      323.332    -108.005     
1 1 1 -41 3  10 o 0 546.5   10.8  ?     ?   619.295   -11.7829     411.586    -11.7829     125.349    168.217      
1 1 1 -41 3  9  o 0 250.2   5.6   ?     ?   305.38    -5.85782     345.772    -5.85782     79.6035    -5.85782     
1 1 1 -41 3  8  f 1 13.3    1.8   ?     ?   76.5301   -145.824     42.5521    34.1765      109.341    34.1765      
1 1 1 -41 3  7  o 0 1852.2  33.1  ?     ?   636.631   2.6371       1230.77    2.6371       675.542    2.6371       
1 1 1 -41 3  6  o 0 1620.1  28.2  ?     ?   1004.78   -38.7693     806.49     -38.7693     73.4042    141.231      
1 1 1 -41 3  5  o 0 2171.4  38.1  ?     ?   1005.94   62.8098      1056.75    62.8098      153.737    62.8098      
1 1 1 -41 3  4  o 0 158.1   4.6   ?     ?   364.162   125.273      146.097    125.273      181.908    -54.7274     
1 1 1 -41 3  3  f 1 262.3   5.9   ?     ?   64.2889   -98.5245     264.111    -98.5245     205.73     -98.5245     
1 1 1 -41 3  2  o 0 1509.8  27.3  ?     ?   592.019   -43.1262     1094.57    -43.1262     558.246    -43.1262     
1 1 1 -41 3  1  o 0 148.4   5.5   ?     ?   187.141   -46.3024     218.335    -46.3024     48.3912    -46.3024     
1 1 1 41  3  0  o 0 112.5   4.4   ?     ?   293.773   8.03273      107.741    8.03273      160.154    -171.967     
1 1 1 41  3  1  o 0 88.6    3.8   ?     ?   164.24    46.9841      98.4311    46.9841      51.615     -133.016     
1 1 1 41  3  2  o 0 156.7   5.6   ?     ?   133.817   -11.3334     224.336    -11.3334     101.895    -11.3334     
1 1 1 41  3  3  f 1 44.7    3.9   ?     ?   354.164   58.0309      107.575    -121.969     433.7      -121.969     
1 1 1 41  3  4  o 0 308.8   7.8   ?     ?   350.503   -22.7307     377.44     -22.7307     56.0447    -22.7307     
1 1 1 41  3  5  o 0 1348.1  25.5  ?     ?   509.373   -22.4681     1085.21    -22.4681     617.873    -22.4681     
1 1 1 41  3  6  o 0 240     7.3   ?     ?   390.539   -45.8536     271.772    -45.8536     79.1371    134.146      
1 1 1 41  3  7  o 0 90.2    6     ?     ?   78.7955   162.989      91.2222    162.989      20.4378    162.989      
1 1 1 41  3  8  f 1 638.7   15.5  ?     ?   534.307   -80.9416     579.224    -80.9416     97.0772    -80.9416     
1 1 1 41  3  9  o 0 560.1   14.4  ?     ?   397.039   -79.0723     628.821    -79.0723     269.64     -79.0723     
1 1 1 41  3  10 o 0 584.2   14.8  ?     ?   643.758   -115.436     441.601    -115.436     139.89     64.5638      
1 1 1 41  3  11 o 0 346.7   11.6  ?     ?   309.412   -66.4275     547.808    -66.4275     232.868    -66.4275     
1 1 1 41  3  12 f 1 145     11.3  ?     ?   259.467   48.233       266.537    48.233       1.72512    48.233       
1 1 1 41  3  13 o 0 28.8    11.3  ?     ?   84.2911   -163.742     32.7631    -163.742     51.0851    16.2582      
1 1 1 41  3  14 o 0 31.1    11.3  ?     ?   72.829    -53.7547     56.7053    -53.7547     14.2906    126.245      
1 1 1 41  3  15 o 0 102.6   14.7  ?     ?   133.583   -48.5575     294.985    -48.5575     168.493    -48.5575     
1 1 1 41  3  16 o 0 28.2    15.2  ?     ?   136.515   -11.3604     48.411     -11.3604     80.7891    168.64       
1 1 1 41  3  17 o 0 82.9    19.7  ?     ?   140.629   -122.554     240.925    -122.554     107.3      -122.554     
1 1 1 41  3  18 o 0 8.1     19.8  ?     ?   100.541   93.5331      15.587     93.5331      87.5814    -86.4669     
1 1 1 41  3  19 o 0 100.1   21.9  ?     ?   115.257   -32.3394     312.595    -32.3394     194.105    -32.3394     
1 1 1 41  3  20 o 0 128.5   31.8  ?     ?   151.258   -158.176     349.609    -158.176     200.246    -158.176     
1 1 1 41  3  21 o 0 28.9    28.8  ?     ?   45.37     -84.648      80.7078    -84.648      37.1222    -84.648      
1 1 1 41  3  22 f 1 65.1    29.7  ?     ?   35.7161   -120.481     185.891    -120.481     152.008    -120.481     
1 1 1 -41 5  22 o 0 65.5    6.3   ?     ?   148.956   -170.11      203.588    -170.11      77.1049    -170.11      
1 1 1 -41 5  21 f 1 15.1    6     ?     ?   22.6122   -114.998     19.9141    -114.998     0.445222   -114.998     
1 1 1 -41 5  20 o 0 72.4    5.4   ?     ?   192.728   -67.0084     185.315    -67.0084     16.2746    -67.0084     
1 1 1 -41 5  19 o 0 12.4    4.7   ?     ?   93.4563   -99.2673     3.54289    -99.2673     83.9679    80.7327      
1 1 1 -41 5  18 o 0 69      4.6   ?     ?   126.304   20.593       211.193    20.593       92.6688    20.593       
1 1 1 -41 5  17 o 0 74.4    4.2   ?     ?   256.933   -14.9014     128.673    -14.9014     95.4862    165.099      
1 1 1 -41 5  16 f 1 122.5   4.4   ?     ?   180.734   94.2398      290.889    94.2398      132.397    94.2398      
1 1 1 -41 5  15 o 0 186.2   5.6   ?     ?   233.588   -9.53656     371.088    -9.53656     166.373    -9.53656     
1 1 1 -41 5  14 o 0 40.2    2.9   ?     ?   104.027   168.166      110.375    168.166      18.4907    168.166      
1 1 1 -41 5  13 o 0 81.5    3.3   ?     ?   203.446   -102.454     180.894    -102.454     4.75446    77.546       
1 1 1 -41 5  12 o 0 4.3     2.1   ?     ?   71.5696   120.798      51.0688    -59.2021     117.947    -59.2021     
1 1 1 -41 5  11 o 0 230.5   5.3   ?     ?   429.498   -23.7576     268.228    -23.7576     135.723    156.242      
1 1 1 -41 5  10 o 0 90.6    3.3   ?     ?   222.308   16.7973      164.07     16.7973      50.0152    -163.203     
1 1 1 -41 5  9  o 0 69.5    2.3   ?     ?   105.953   30.1033      142.095    30.1033      39.4888    30.1033      
1 1 1 -41 5  8  o 0 72.2    2.6   ?     ?   391.241   -66.8687     25.0111    113.131      362.307    113.131      
1 1 1 -41 5  7  o 0 172.6   4.5   ?     ?   192.285   -147.083     296.736    -147.083     130.175    -147.083     
1 1 1 -41 5  6  o 0 134     4.2   ?     ?   174.131   160.349      208.127    160.349      57.9507    160.349      
1 1 1 -41 5  5  o 0 225     5.4   ?     ?   290.957   25.6887      309.31     25.6887      57.3884    25.6887      
1 1 1 -41 5  4  o 0 63.6    2.6   ?     ?   393.686   -34.5164     58.5543    145.484      400.637    145.484      
1 1 1 -41 5  3  o 0 272.5   6     ?     ?   360.271   177.625      328.751    177.625      14.7043    177.625      
1 1 1 -41 5  2  o 0 84.7    3     ?     ?   351.671   -123.633     23.8156    -123.633     283.601    56.3673      
1 1 1 -41 5  1  o 0 18      2.2   ?     ?   160.544   22.5207      75.5163    -157.479     216.204    -157.479     
1 1 1 41  5  0  o 0 102.3   3.4   ?     ?   349.163   -17.7936     65.4132    -17.7936     242.681    162.206      
1 1 1 41  5  1  o 0 421.8   9.2   ?     ?   320.627   -69.099      534.289    -69.099      250.894    -69.099      
1 1 1 41  5  2  o 0 118     4.2   ?     ?   361.402   14.698       89.4838    14.698       230.395    -165.302     
1 1 1 41  5  3  o 0 437.3   10.5  ?     ?   486.452   115.632      425.939    115.632      5.08008    -64.368      
1 1 1 41  5  4  o 0 65.3    4.6   ?     ?   158.588   90.9229      62.8615    90.9229      77.7564    -89.0771     
1 1 1 41  5  5  o 0 151.9   5.7   ?     ?   385.691   22.5862      135.211    22.5862      206.897    -157.414     
1 1 1 41  5  6  o 0 50.7    5.1   ?     ?   73.2472   -119.546     42.084     -119.546     23.453     60.4544      
1 1 1 41  5  7  o 0 651.5   15.7  ?     ?   573.437   154.051      555.424    154.051      42.5748    154.051      
1 1 1 41  5  8  o 0 14.6    6     ?     ?   126.39    -118.993     61.4385    61.0074      174.377    61.0074      
1 1 1 41  5  9  o 0 165.5   8.8   ?     ?   280.252   175.739      289.203    175.739      6.81775    175.739      
1 1 1 41  5  10 o 0 294.4   10.5  ?     ?   477.812   -175.755     316.815    -175.755     163.789    4.24474      
1 1 1 41  5  11 o 0 90.9    9.4   ?     ?   180.479   -32.2248     217.968    -32.2248     39.9988    -32.2248     
1 1 1 41  5  12 o 0 130.2   11.1  ?     ?   129.218   -137.693     331.62     -137.693     204.539    -137.693     
1 1 1 41  5  13 o 0 83.6    12.4  ?     ?   351.194   92.5768      70.3785    92.5768      268.172    -87.4232     
1 1 1 41  5  14 o 0 27.8    13.2  ?     ?   203.291   39.6041      7.21976    39.6041      183.186    -140.396     
1 1 1 41  5  15 o 0 104.7   16    ?     ?   206.167   -52.9961     249.058    -52.9961     56.017     -52.9961     
1 1 1 41  5  16 f 1 43.1    14.5  ?     ?   90.1943   -113.684     126.903    -113.684     41.659     -113.684     
1 1 1 41  5  17 o 0 36      18.7  ?     ?   97.1978   105.482      104.702    105.482      5.9836     105.482      
1 1 1 41  5  18 o 0 79.1    21.3  ?     ?   261.547   141.801      133.125    141.801      133.065    -38.1991     
1 1 1 41  5  19 o 0 279.6   27.2  ?     ?   280.529   130.886      509.786    130.886      235.495    130.886      
1 1 1 41  5  20 o 0 36.2    32    ?     ?   157.664   -159.465     81.0555    -159.465     68.9462    20.5349      
1 1 1 41  5  21 f 1 84.1    27.3  ?     ?   213.365   -125.005     177.92     -125.005     22.57      54.9946      
1 1 1 -41 7  21 < 0 148.6   7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 7  20 o 0 128.9   7     ?     ?   253.452   26.5989      264.48     26.5989      50.6427    26.5989      
1 1 1 -41 7  19 f 1 11.2    5.1   ?     ?   132.644   81.9175      12.6252    -98.0825     127.532    -98.0825     
1 1 1 -41 7  18 o 0 146.6   7.4   ?     ?   242.499   126.151      298.982    126.151      83.3966    126.151      
1 1 1 -41 7  17 o 0 89.2    4.8   ?     ?   208.124   140.704      203.862    140.704      10.5607    140.704      
1 1 1 -41 7  16 o 0 92.8    5.2   ?     ?   257.443   140.879      171.939    140.879      67.5464    -39.1208     
1 1 1 -41 7  15 o 0 13.3    3.3   ?     ?   205.997   34.3019      53.7786    -145.698     231.831    -145.698     
1 1 1 -41 7  14 o 0 35      3.3   ?     ?   129.793   -15.2647     85.9188    -15.2647     26.2016    164.735      
1 1 1 -41 7  13 o 0 8.6     2.5   ?     ?   126.73    -30.2728     44.9422    149.727      154.847    149.727      
1 1 1 -41 7  12 o 0 94.3    3.3   ?     ?   187.87    137.3        227.072    137.3        62.9631    137.3        
1 1 1 -41 7  11 o 0 197.7   4.7   ?     ?   310.897   124.405      321.527    124.405      41.1223    124.405      
1 1 1 -41 7  10 o 0 9.6     1.5   ?     ?   199.26    -61.0173     89.5677    118.983      270.424    118.983      
1 1 1 -41 7  9  o 0 18.9    1.3   ?     ?   164.335   -53.6763     26.0288    126.324      178.616    126.324      
1 1 1 -41 7  8  o 0 20.2    4.4   ?     ?   98.4922   -45.3385     3.08341    -45.3385     88.8665    134.662      
1 1 1 -41 7  7  f 1 372.7   11.1  ?     ?   202.461   11.1638      624.657    11.1638      430.326    11.1638      
1 1 1 -41 7  6  o 0 41.8    4     ?     ?   59.677    -119.154     43.7901    -119.154     13.4593    60.8463      
1 1 1 -41 7  5  o 0 400.1   12.2  ?     ?   361.804   76.0435      537.723    76.0435      189.19     76.0435      
1 1 1 -41 7  4  o 0 85.5    5.5   ?     ?   386.584   95.5974      9.48342    95.5974      321.58     -84.4026     
1 1 1 -41 7  3  o 0 156.1   7.8   ?     ?   304.449   147.615      203.508    147.615      58.0901    -32.385      
1 1 1 -41 7  2  o 0 641.4   19.4  ?     ?   361.047   -51.9859     694.331    -51.9859     383.186    -51.9859     
1 1 1 -41 7  1  o 0 206.5   6.3   ?     ?   165.485   -172.454     355.89     -172.454     212.912    -172.454     
1 1 1 41  7  0  o 0 1402.8  25.8  ?     ?   850.093   174.869      808.447    174.869      65.9051    174.869      
1 1 1 41  7  1  o 0 120.6   4.2   ?     ?   128.275   1.71034      212.054    1.71034      99.8391    1.71034      
1 1 1 41  7  2  o 0 87.6    5.1   ?     ?   93.001    -141.769     127.036    -141.769     45.5837    -141.769     
1 1 1 41  7  3  o 0 482.7   13.3  ?     ?   475.35    100.661      475.409    100.661      58.7458    100.661      
1 1 1 41  7  4  o 0 265.4   7.7   ?     ?   312.507   37.3124      420.199    37.3124      110.769    37.3124      
1 1 1 41  7  5  o 0 90.9    5.2   ?     ?   231.567   -6.57757     162.881    -6.57757     66.4217    173.422      
1 1 1 41  7  6  o 0 267     8.9   ?     ?   337.792   116.441      400.434    116.441      66.0532    116.441      
1 1 1 41  7  7  f 1 198.7   8     ?     ?   212.203   45.4653      393.095    45.4653      182.111    45.4653      
1 1 1 41  7  8  o 0 388.2   10.4  ?     ?   418.404   36.7151      500.169    36.715       93.9972    36.715       
1 1 1 41  7  9  o 0 145     8.5   ?     ?   291.261   -40.979      249.969    -40.979      32.3239    139.021      
1 1 1 41  7  10 o 0 86.1    8.9   ?     ?   186.293   81.3777      211.247    81.3777      34.0701    81.3777      
1 1 1 41  7  11 o 0 166.5   10.2  ?     ?   343.098   172.592      254.698    172.592      70.7943    -7.40776     
1 1 1 41  7  12 o 0 216.6   13.8  ?     ?   263.009   173.106      415.279    173.106      172.697    173.106      
1 1 1 41  7  13 o 0 204.1   14.5  ?     ?   345.828   -124.592     323.24     -124.592     4.16189    -124.592     
1 1 1 41  7  14 o 0 40.5    15    ?     ?   166.358   -105.029     86.2874    -105.029     67.9488    74.9714      
1 1 1 41  7  15 o 0 235.4   18.2  ?     ?   300.577   -106.998     417.963    -106.998     116.759    -106.998     
1 1 1 41  7  16 o 0 150     20.5  ?     ?   241.872   -108.542     316.806    -108.542     73.7746    -108.542     
1 1 1 41  7  17 o 0 -9.4    18.9  ?     ?   171.834   -143.446     58.2602    36.5537      224.234    36.5537      
1 1 1 41  7  18 o 0 60.2    19.4  ?     ?   193.306   -64.3428     140.615    -64.3428     41.1742    115.657      
1 1 1 41  7  19 f 1 255.4   31.3  ?     ?   249.223   -37.3764     485.252    -37.3764     254.157    -37.3764     
1 1 1 -41 9  19 < 0 21.6    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 9  18 o 0 40.2    5.3   ?     ?   184.316   -44.0708     99.0504    -44.0708     54.0978    135.929      
1 1 1 -41 9  17 o 0 13.6    4.6   ?     ?   28.9764   -77.6272     20.3216    -77.6272     3.93739    102.373      
1 1 1 -41 9  16 f 1 132.4   5.4   ?     ?   296.436   116.121      229.81     116.121      25.3094    -63.879      
1 1 1 -41 9  15 o 0 0.1     3.1   ?     ?   42.1909   113.752      28.2416    -66.2483     65.4648    -66.2483     
1 1 1 -41 9  14 o 0 -1.5    3     ?     ?   36.3302   73.2738      27.5977    -106.726     61.0477    -106.726     
1 1 1 -41 9  13 o 0 81.9    3.6   ?     ?   120.119   176.151      244.277    176.151      133.626    176.151      
1 1 1 -41 9  12 o 0 44.1    2.8   ?     ?   92.8394   165.317      130.235    165.317      50.8585    165.317      
1 1 1 -41 9  11 o 0 21.2    1.9   ?     ?   117.761   -115.52      30.2645    -115.52      70.252     64.4804      
1 1 1 -41 9  10 o 0 12.6    1.3   ?     ?   96.9104   -117.39      7.61796    62.6105      90.8845    62.6105      
1 1 1 -41 9  9  f 1 289.8   9.9   ?     ?   346.764   -31.6333     423.026    -31.6333     122.836    -31.6333     
1 1 1 -41 9  8  o 0 300.9   10.7  ?     ?   427.968   -68.6243     374.452    -68.6243     3.75485    -68.6243     
1 1 1 -41 9  7  o 0 0.4     4.5   ?     ?   106.403   -12.1452     74.6414    167.855      169.656    167.855      
1 1 1 -41 9  6  o 0 109.7   6.7   ?     ?   226.854   80.4706      225.345    80.4706      21.7956    80.4706      
1 1 1 -41 9  5  o 0 118.9   8     ?     ?   134.099   135.155      301.756    135.155      180.907    135.155      
1 1 1 -41 9  4  o 0 106.5   8.2   ?     ?   205.242   131.426      235.595    131.426      49.9021    131.426      
1 1 1 -41 9  3  o 0 31.2    6.7   ?     ?   152.793   162.756      34.7815    162.756      106.3      -17.2438     
1 1 1 -41 9  2  o 0 120.7   8.3   ?     ?   268.577   141.014      209.205    141.014      39.5539    -38.9863     
1 1 1 -41 9  1  o 0 364     8.7   ?     ?   354.162   132.852      505.93     132.852      177.021    132.852      
1 1 1 41  9  0  o 0 109.2   4     ?     ?   216.451   116.945      228.643    116.945      24.3758    116.945      
1 1 1 41  9  1  o 0 110.2   4.4   ?     ?   267.405   -91.0076     192.408    -91.0076     60.2683    88.9924      
1 1 1 41  9  2  o 0 47.9    3.9   ?     ?   104.078   -163.1       107.5      -163.1       9.06518    -163.1       
1 1 1 41  9  3  o 0 263.5   7.9   ?     ?   321.44    -90.3528     412.397    -90.3528     108.22     -90.3528     
1 1 1 41  9  4  o 0 148.5   6.3   ?     ?   354.951   -77.3622     207.439    -77.3622     122.89     102.638      
1 1 1 41  9  5  o 0 105.3   6.5   ?     ?   251.214   8.17096      204.982    8.17096      28.7507    -171.829     
1 1 1 41  9  6  o 0 311.9   11    ?     ?   295.207   14.2687      509.552    14.2687      235.066    14.2687      
1 1 1 41  9  7  o 0 14.3    7.4   ?     ?   97.0875   -88.6065     5.38264    91.3935      93.3142    91.3935      
1 1 1 41  9  8  o 0 243     11.1  ?     ?   325.194   -108.17      397.384    -108.17      103.297    -108.17      
1 1 1 41  9  9  f 1 93.2    9.8   ?     ?   268.677   -121.658     168.786    -121.658     75.8872    58.3418      
1 1 1 41  9  10 o 0 279.9   13.5  ?     ?   378.681   -65.439      401.507    -65.439      59.2347    -65.439      
1 1 1 41  9  11 o 0 23.6    12.6  ?     ?   176.312   16.3522      10.7759    16.3522      149.528    -163.648     
1 1 1 41  9  12 o 0 4.7     14.8  ?     ?   19.8548   -125.518     0.14344    54.4824      19.0075    54.4824      
1 1 1 41  9  13 o 0 20.6    16.8  ?     ?   82.7701   57.601       45.0021    57.601       36.1206    -122.399     
1 1 1 41  9  14 o 0 38.4    16.5  ?     ?   53.6552   -122.866     107.338    -122.866     54.5767    -122.866     
1 1 1 41  9  15 o 0 141     21.5  ?     ?   166.606   -179.898     361.081    -179.898     203.497    -179.898     
1 1 1 41  9  16 f 1 -54.6   19.8  ?     ?   82.6563   175.984      36.8396    -4.01551     113.395    -4.01551     
1 1 1 41  9  17 o 0 -4.5    21.8  ?     ?   65.1301   -130.553     24.536     -130.553     34.3708    49.4473      
1 1 1 41  9  18 o 0 95.6    27.4  ?     ?   124.648   -128.724     271.959    -128.724     159.637    -128.724     
1 1 1 -41 11 16 < 0 28.6    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 11 15 o 0 50.3    4     ?     ?   219.993   16.6324      103.622    16.6324      76.4007    -163.368     
1 1 1 -41 11 14 o 0 53.6    3.7   ?     ?   210.817   16.5775      118.174    16.5775      55.4539    -163.423     
1 1 1 -41 11 13 o 0 30.4    3.1   ?     ?   189.385   38.5068      52.1907    38.5068      107.15     -141.493     
1 1 1 -41 11 12 o 0 37.4    3.3   ?     ?   123.756   22.7032      114.802    22.7032      7.63313    22.7032      
1 1 1 -41 11 11 o 0 39.7    3     ?     ?   124.459   -9.75798     123.554    -9.75798     14.9876    -9.75798     
1 1 1 -41 11 10 o 0 2.7     2.2   ?     ?   33.702    87.2096      21.0881    -92.7904     51.7196    -92.7904     
1 1 1 -41 11 9  o 0 42.4    6.4   ?     ?   133.747   11.8481      119.186    11.8481      2.24202    -168.152     
1 1 1 -41 11 8  o 0 75.1    7.1   ?     ?   195.849   109.757      174.527    109.757      4.33831    -70.243      
1 1 1 -41 11 7  f 1 151.8   8.1   ?     ?   285.516   156.757      257.941    156.757      15.1729    156.757      
1 1 1 -41 11 6  o 0 216.7   10.3  ?     ?   257.11    127.775      384.299    127.775      165.71     127.775      
1 1 1 -41 11 5  o 0 17      5.8   ?     ?   86.2294   -34.2809     18.4992    -34.2809     55.1465    145.719      
1 1 1 -41 11 4  o 0 225.5   12.7  ?     ?   280.18    15.7994      381.497    15.7994      143.304    15.7994      
1 1 1 -41 11 3  o 0 26.6    2.8   ?     ?   286.811   43.9087      46.9238    -136.091     291.653    -136.091     
1 1 1 -41 11 2  o 0 91.6    4.1   ?     ?   286.063   -36.2492     145.368    -36.2492     99.5161    143.751      
1 1 1 -41 11 1  o 0 21.8    2.9   ?     ?   58.2896   -5.66321     32.3758    -5.66321     17.6637    174.337      
1 1 1 41  11 0  f 1 169.4   5.5   ?     ?   237.341   -24.7065     338.682    -24.7065     129.357    -24.7065     
1 1 1 41  11 1  o 0 217.5   7     ?     ?   322.563   -14.9802     349.782    -14.9802     66.4601    -14.9802     
1 1 1 41  11 2  o 0 161.9   6.2   ?     ?   308.993   -6.45996     271.031    -6.45996     0.546882   173.54       
1 1 1 41  11 3  o 0 108.3   6     ?     ?   219.513   105.982      237.006    105.982      44.0241    105.982      
1 1 1 41  11 4  o 0 62.4    6.5   ?     ?   236.482   178.547      113.694    178.547      95.9967    -1.45251     
1 1 1 41  11 5  o 0 26.6    7.7   ?     ?   178.416   -101.911     30.5808    -101.911     127.535    78.0888      
1 1 1 41  11 6  o 0 70.2    7.8   ?     ?   122.041   17.8803      207.638    17.8803      99.5881    17.8803      
1 1 1 41  11 7  f 1 135.1   10.6  ?     ?   107.197   67.4255      378.907    67.4255      275.495    67.4255      
1 1 1 41  11 8  o 0 53.2    11.2  ?     ?   144.773   38.4777      152.981    38.4777      14.2872    38.4777      
1 1 1 41  11 9  o 0 -2.3    11.9  ?     ?   38.2043   48.4024      9.32042    -131.598     46.1119    -131.598     
1 1 1 41  11 10 o 0 92.8    14.1  ?     ?   147.569   -40.5547     261.792    -40.5547     120.063    -40.5547     
1 1 1 41  11 11 o 0 383.5   29.7  ?     ?   286.838   10.4925      605.778    10.4925      340.403    10.4925      
1 1 1 41  11 12 o 0 -4.5    15.3  ?     ?   26.4872   137.52       0.494072   137.52       23.4145    -42.4805     
1 1 1 41  11 13 o 0 -6.5    15    ?     ?   30.5923   146.284      1.83814    -33.7157     29.3411    -33.7157     
1 1 1 41  11 14 o 0 57      20.8  ?     ?   215.305   176.803      106.69     176.803      83.4969    -3.19749     
1 1 1 41  11 15 o 0 69.3    23.4  ?     ?   123.1     -142.084     205.608    -142.084     97.1597    -142.084     
1 1 1 -41 13 12 < 0 11.4    3.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 13 11 < 1 26.7    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 13 10 o 0 11.2    3.1   ?     ?   8.69335   108.634      7.35867    108.634      0.328573   108.634      
1 1 1 -41 13 9  o 0 120.5   4.6   ?     ?   210.476   -67.9362     269.794    -67.9362     98.8476    -67.9362     
1 1 1 -41 13 8  o 0 1.8     3.7   ?     ?   47.9928   -95.8171     21.4886    84.1829      60.7074    84.1829      
1 1 1 -41 13 7  o 0 104.8   5.7   ?     ?   205.895   -136.673     239.78     -136.673     68.3362    -136.673     
1 1 1 -41 13 6  o 0 19.3    2.7   ?     ?   115.483   74.8465      47.2868    74.8465      49.375     -105.153     
1 1 1 -41 13 5  o 0 8       2.7   ?     ?   59.1866   -176.558     8.49487    3.44206      59.3312    3.44206      
1 1 1 -41 13 4  o 0 22.3    3.1   ?     ?   163.26    110.403      30.5014    110.403      110.329    -69.5973     
1 1 1 -41 13 3  o 0 269.5   9.7   ?     ?   395.098   133.9        351.756    133.9        9.6245     133.9        
1 1 1 -41 13 2  o 0 224.9   8.3   ?     ?   318.054   120.171      355.536    120.171      79.1793    120.171      
1 1 1 -41 13 1  o 0 93.5    5.4   ?     ?   192.187   -138.805     225.784    -138.805     58.2969    -138.805     
1 1 1 41  13 0  o 0 44.2    5.3   ?     ?   142.396   -94.105      131.321    -94.105      3.69024    -94.105      
1 1 1 41  13 1  o 0 23.8    5.7   ?     ?   177.887   -90.5831     26.3743    -90.5831     133.19     89.4169      
1 1 1 41  13 2  o 0 1.8     6.6   ?     ?   132.1     -57.2944     62.8013    122.706      181.339    122.706      
1 1 1 41  13 3  o 0 88.7    9.2   ?     ?   87.0374   94.9614      280.555    94.9614      202.456    94.9614      
1 1 1 41  13 4  o 0 42.5    8.8   ?     ?   168.875   34.5162      105.983    34.5162      45.4828    -145.484     
1 1 1 41  13 5  o 0 190.3   10.8  ?     ?   302.784   58.4464      331.323    58.4464      65.6441    58.4464      
1 1 1 41  13 6  o 0 0.1     10.7  ?     ?   116.33    35.105       32.1995    -144.895     134.143    -144.895     
1 1 1 41  13 7  o 0 305.8   14.1  ?     ?   339.642   -38.3445     462.82     -38.3445     165.688    -38.3445     
1 1 1 41  13 8  o 0 261.1   13.5  ?     ?   283.785   -13.0852     454.045    -13.0852     209.539    -13.0852     
1 1 1 41  13 9  o 0 137.3   14.5  ?     ?   183.403   66.3864      332.942    66.3864      175.33     66.3864      
1 1 1 41  13 10 o 0 20.4    15.5  ?     ?   81.6392   173.284      73.2191    173.284      3.11434    173.284      
1 1 1 41  13 11 < 1 -10.7   15.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 41  13 12 < 0 11.3    27.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 15 4  < 0 53.2    6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 15 3  < 0 4.9     6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 15 2  < 0 2.4     5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -41 15 1  < 0 17.8    6.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 41  15 0  < 0 5.3     7.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 41  15 1  < 0 86.1    8.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 41  15 2  < 0 6.8     9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 41  15 3  < 0 65.2    10.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 0  23 o 0 126.1   9     ?     ?   255.943   0            248.443    0            26.7796    0            
1 1 1 -42 0  22 o 0 253.4   10.5  ?     ?   351.422   0            356.842    0            49.916     0            
1 1 1 -42 0  21 f 1 7.2     5.3   ?     ?   181.356   0            36.0547    0            130.382    180          
1 1 1 -42 0  20 o 0 -3.8    5.7   ?     ?   31.552    180          2.12231    180          27.9826    5.32175e-16  
1 1 1 -42 0  19 f 1 113.7   6.4   ?     ?   223.668   0            246.202    0            31.2999    0            
1 1 1 -42 0  18 o 0 2.4     4.3   ?     ?   113.547   0            9.42537    0            91.4524    180          
1 1 1 -42 0  17 o 0 27.7    5     ?     ?   15.1751   180          14.9669    180          1.48912    180          
1 1 1 -42 0  16 o 0 127     6.3   ?     ?   168.306   180          253.465    180          103.356    180          
1 1 1 -42 0  15 o 0 2.3     3.7   ?     ?   12.7683   180          0.79085    180          10.9759    5.05579e-16  
1 1 1 -42 0  14 o 0 8.9     3.9   ?     ?   144.368   0            26.1579    0            110.105    180          
1 1 1 -42 0  13 o 0 5.6     3.3   ?     ?   213.308   0            17.3978    0            188.873    180          
1 1 1 -42 0  12 o 0 343.4   10.1  ?     ?   578.624   180          430.871    180          132.133    2.28807e-14  
1 1 1 -42 0  11 o 0 127.9   6     ?     ?   632.098   180          234.856    180          313.002    5.26486e-15  
1 1 1 -42 0  10 o 0 1779.6  44    ?     ?   1105.32   180          880.793    180          82.3524    7.50466e-14  
1 1 1 -42 0  9  o 0 494.7   13.6  ?     ?   612.099   180          466.943    180          64.4122    5.08662e-14  
1 1 1 -42 0  8  o 0 5.9     4     ?     ?   125.022   180          6.03592    180          102.99     4.11228e-16  
1 1 1 -42 0  7  o 0 3.1     2.4   ?     ?   184.876   180          4.64967    180          157.25     2.07474e-16  
1 1 1 -42 0  6  o 0 717.2   19.6  ?     ?   254.43    0            568.184    0            339.754    0            
1 1 1 -42 0  5  o 0 52.9    4.4   ?     ?   284.054   0            120.286    0            135.644    180          
1 1 1 -42 0  4  o 0 1210.9  42.1  ?     ?   827.757   180          744.406    180          3.80993    1.37096e-12  
1 1 1 -42 0  3  o 0 72.7    5.3   ?     ?   248.862   0            144.01     0            81.6032    180          
1 1 1 -42 0  2  o 0 6.8     3.6   ?     ?   240.411   0            12.6917    0            205.844    180          
1 1 1 -42 0  1  o 0 54.3    4.3   ?     ?   67.3112   180          38.7382    180          22.5961    1.20293e-14  
1 1 1 42  0  0  o 0 246.5   8.5   ?     ?   309.401   -1.52954e-14 334.436    0            51.9014    8.32633e-14  
1 1 1 42  0  1  o 0 2.1     5.6   ?     ?   105.093   0            2.75066    0            93.397     180          
1 1 1 42  0  2  o 0 62      5     ?     ?   350.781   0            150.481    0            170.958    180          
1 1 1 42  0  3  o 0 14.1    4.5   ?     ?   172.035   180          23.1044    180          134.746    1.20313e-15  
1 1 1 42  0  4  o 0 140.8   7.7   ?     ?   281.381   180          240.536    180          17.8998    9.42897e-14  
1 1 1 42  0  5  o 0 104.9   7.4   ?     ?   12.7768   0            14.6128    0            2.87028    0            
1 1 1 42  0  6  o 0 745.1   22.3  ?     ?   426.701   0            594.163    0            210.065    0            
1 1 1 42  0  7  o 0 5227.2  130   ?     ?   1446.6    0            1571.32    0            269.276    0            
1 1 1 42  0  8  o 0 1572.8  52.9  ?     ?   681.63    0            861.85     0            248.643    0            
1 1 1 42  0  9  o 0 72.9    10.9  ?     ?   269.946   0            170.728    0            74.0214    180          
1 1 1 42  0  10 o 0 1145.5  33.9  ?     ?   771.717   0            734.18     0            35.4404    0            
1 1 1 42  0  11 o 0 639.7   23.2  ?     ?   518.362   0            616.297    0            87.3114    0            
1 1 1 42  0  12 o 0 1015.4  34.2  ?     ?   635.361   0            774.466    0            127.533    0            
1 1 1 42  0  13 o 0 20.4    13.7  ?     ?   62.6686   0            24.1421    0            38.3856    180          
1 1 1 42  0  14 o 0 422.1   23.3  ?     ?   563.505   180          495.693    180          55.4219    6.27575e-14  
1 1 1 42  0  15 o 0 97      29.3  ?     ?   64.2122   0            153.355    0            90.7792    0            
1 1 1 42  0  16 o 0 40.5    20.4  ?     ?   77.7375   180          74.1944    180          0.61981    180          
1 1 1 42  0  17 o 0 -9.1    40.2  ?     ?   40.4202   0            16.3682    0            21.8613    180          
1 1 1 42  0  18 o 0 4       27.2  ?     ?   31.9724   0            12.5039    0            17.8523    180          
1 1 1 42  0  19 f 1 9.7     27.4  ?     ?   52.7723   0            27.2738    0            27.1078    180          
1 1 1 42  0  20 o 0 71      38.3  ?     ?   61.3315   0            114.883    0            54.0129    0            
1 1 1 42  0  21 f 1 -40.9   39.8  ?     ?   21.9421   180          8.96631    180          12.3361    5.1e-15      
1 1 1 -42 2  23 < 0 99      5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 2  22 o 0 14.4    5.1   ?     ?   135.339   -174.37      13.9554    -174.37      103.227    5.62973      
1 1 1 -42 2  21 o 0 12.8    4.2   ?     ?   94.3231   131.124      16.2554    131.124      67.3678    -48.8756     
1 1 1 -42 2  20 o 0 189.9   7     ?     ?   262.135   -100.634     358.72     -100.634     110.614    -100.634     
1 1 1 -42 2  19 o 0 28.2    4.1   ?     ?   111.956   -157.472     78.3779    -157.472     27.814     22.5284      
1 1 1 -42 2  18 o 0 241.3   6.3   ?     ?   278.628   -176.561     418.534    -176.561     172.832    -176.561     
1 1 1 -42 2  17 o 0 -2.2    3.1   ?     ?   90.4587   -118.404     70.0528    61.5965      149.822    61.5965      
1 1 1 -42 2  16 o 0 48.2    3.3   ?     ?   276.523   -143.157     40.0081    -143.157     204.938    36.843       
1 1 1 -42 2  15 o 0 88.1    3.5   ?     ?   183.16    48.5961      211.462    48.5961      43.7702    48.5961      
1 1 1 -42 2  14 f 1 148.7   4.6   ?     ?   191.685   68.3524      323.547    68.3524      142.827    68.3524      
1 1 1 -42 2  13 o 0 57      2.8   ?     ?   138.559   -41.4943     134.774    -41.4943     3.90829    -41.4943     
1 1 1 -42 2  12 o 0 167.4   4.4   ?     ?   210.102   93.5831      332.991    93.5831      129.719    93.5831      
1 1 1 -42 2  11 o 0 41      3.1   ?     ?   223.988   0.04026      15.8423    0.04026      202.173    -179.96      
1 1 1 -42 2  10 o 0 425.9   9     ?     ?   401.497   28.6181      473.329    28.6181      125.276    28.6181      
1 1 1 -42 2  9  o 0 237.3   5.3   ?     ?   483.717   33.7403      191.726    33.7403      229.781    -146.26      
1 1 1 -42 2  8  o 0 297.3   6.4   ?     ?   312.017   -33.5224     391.473    -33.5224     120.651    -33.5224     
1 1 1 -42 2  7  o 0 134.5   3.9   ?     ?   59.1483   -85.3218     126.809    -85.3218     75.2436    -85.3218     
1 1 1 -42 2  6  o 0 79.9    2.7   ?     ?   209.403   46.248       89.0507    46.248       94.2448    -133.752     
1 1 1 -42 2  5  o 0 1503.5  27    ?     ?   750.085   83.4194      946.428    83.4194      273.417    83.4194      
1 1 1 -42 2  4  f 1 274.1   6     ?     ?   335.809   -83.4003     336.065    -83.4003     32.1951    -83.4003     
1 1 1 -42 2  3  o 0 702.4   13.6  ?     ?   560.541   -69.2496     589.053    -69.2496     82.8848    -69.2496     
1 1 1 -42 2  2  o 0 825.9   16.1  ?     ?   484.122   7.96334      749.545    7.96334      311.188    7.96334      
1 1 1 -42 2  1  o 0 406.9   11.9  ?     ?   496.449   70.7079      372.541    70.7079      78.0759    -109.292     
1 1 1 42  2  0  o 0 533.1   13.9  ?     ?   670.84    93.1191      352.766    93.1191      258.332    -86.8809     
1 1 1 42  2  1  o 0 520     10.8  ?     ?   678.396   -156.782     334.68     -156.782     284.454    23.2178      
1 1 1 42  2  2  o 0 127.7   4.8   ?     ?   209.087   -157.517     176.523    -157.517     14.6023    22.4829      
1 1 1 42  2  3  o 0 -2.7    3.8   ?     ?   284.978   52.0966      249.578    -127.903     510.41     -127.903     
1 1 1 42  2  4  f 1 71.2    5.3   ?     ?   171.289   142.443      57.1192    142.443      100.615    -37.5573     
1 1 1 42  2  5  o 0 144.4   5.9   ?     ?   380.558   -31.8124     112.132    -31.8124     236.735    148.188      
1 1 1 42  2  6  o 0 305.9   14    ?     ?   301.418   134.927      422.483    134.927      151.854    134.927      
1 1 1 42  2  7  o 0 232.6   9.2   ?     ?   290.696   95.5699      331.684    95.5699      70.7186    95.5699      
1 1 1 42  2  8  o 0 81.5    7.2   ?     ?   316.345   -124.073     40.2142    -124.073     243.619    55.9266      
1 1 1 42  2  9  o 0 428     12.4  ?     ?   477.418   85.2776      433.238    85.2776      1.56037    85.2776      
1 1 1 42  2  10 o 0 57.1    7.5   ?     ?   293.638   -177.552     4.01476    -177.552     261.113    2.44794      
1 1 1 42  2  11 o 0 53.4    8.4   ?     ?   149.305   -16.5291     98.2098    -16.5291     53.7161    163.471      
1 1 1 42  2  12 o 0 1050.8  23.9  ?     ?   594.625   1.40295      946.069    1.40295      342.417    1.40295      
1 1 1 42  2  13 o 0 152.9   11.5  ?     ?   244.723   9.55984      310.766    9.55984      67.3463    9.55984      
1 1 1 42  2  14 f 1 38.4    12.1  ?     ?   194.361   -64.9134     56.4669    -64.9134     133.987    115.087      
1 1 1 42  2  15 o 0 184     14.7  ?     ?   261.195   2.94952      372.045    2.94952      124.669    2.94952      
1 1 1 42  2  16 o 0 18.9    15.7  ?     ?   111.703   28.9459      20.7786    28.9459      84.9738    -151.054     
1 1 1 42  2  17 o 0 40.8    16.3  ?     ?   81.029    40.5449      114.833    40.5449      37.8034    40.5449      
1 1 1 42  2  18 o 0 150.9   20.7  ?     ?   203.405   -22.8772     362.7      -22.8772     153.849    -22.8772     
1 1 1 42  2  19 o 0 192.2   24.3  ?     ?   248.46    33.9239      395.5      33.9239      139.871    33.9239      
1 1 1 42  2  20 o 0 165.8   29    ?     ?   213.977   150.618      380.907    150.618      169.413    150.618      
1 1 1 42  2  21 o 0 11.4    30.6  ?     ?   114.24    -109.747     55.9903    -109.747     53.8784    70.253       
1 1 1 42  2  22 o 0 80      29.3  ?     ?   198.179   -176.27      173.774    -176.27      13.5069    3.72953      
1 1 1 -42 4  23 < 0 23.8    6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 4  22 o 0 147.1   7.6   ?     ?   263.903   -67.6772     292.807    -67.6772     67.5452    -67.6772     
1 1 1 -42 4  21 o 0 111.3   6.6   ?     ?   229.516   -27.1738     251.37     -27.1738     53.7668    -27.1738     
1 1 1 -42 4  20 o 0 44.1    5     ?     ?   199.139   -73.0431     91.6135    -73.0431     87.6565    106.957      
1 1 1 -42 4  19 f 1 170.9   5.9   ?     ?   262.307   -176.89      323.607    -176.89      75.5298    -176.89      
1 1 1 -42 4  18 o 0 4.7     3.5   ?     ?   96.6016   155.776      51.6236    -24.2235     142.702    -24.2235     
1 1 1 -42 4  17 o 0 4       2.7   ?     ?   32.8932   -92.2852     18.4045    87.7148      47.2331    87.7148      
1 1 1 -42 4  16 f 1 60.8    3.3   ?     ?   221.722   126.178      118.068    126.178      77.2301    -53.8218     
1 1 1 -42 4  15 o 0 104.9   3.8   ?     ?   232.458   53.7203      221.278    53.7203      16.6765    53.7203      
1 1 1 -42 4  14 o 0 194.6   5.3   ?     ?   245.422   147.185      371.666    147.185      148.429    147.185      
1 1 1 -42 4  13 o 0 137.5   4     ?     ?   367.764   68.7089      172.709    68.7089      164.239    -111.291     
1 1 1 -42 4  12 o 0 19.1    2     ?     ?   107.332   43.9065      3.27611    -136.094     103.966    -136.094     
1 1 1 -42 4  11 o 0 67.8    2.6   ?     ?   141.526   61.4459      139.079    61.4459      3.0915     61.4459      
1 1 1 -42 4  10 o 0 358.2   7.3   ?     ?   282.283   61.7322      557.03     61.7322      284.187    61.7322      
1 1 1 -42 4  9  o 0 37.3    2.1   ?     ?   18.5456   94.5551      4.61715    94.5551      11.3459    -85.4449     
1 1 1 -42 4  8  o 0 10.4    1.8   ?     ?   111.555   157.843      62.8463    -22.1567     159.354    -22.1567     
1 1 1 -42 4  7  f 1 1310    23.7  ?     ?   753.583   9.55942      830.644    9.55942      172.296    9.55942      
1 1 1 -42 4  6  o 0 1662.8  29.9  ?     ?   1082.55   78.3513      752.495    78.3513      184.227    -101.649     
1 1 1 -42 4  5  o 0 655.3   13    ?     ?   773.963   33.0141      379.457    33.0141      292.855    -146.986     
1 1 1 -42 4  4  f 1 139.4   3.8   ?     ?   221.038   69.7136      209.636    69.7136      15.9618    69.7136      
1 1 1 -42 4  3  o 0 89.8    3.1   ?     ?   209.072   88.4517      112.58     88.4517      70.25      -91.5483     
1 1 1 -42 4  2  o 0 192.9   5.6   ?     ?   184.007   8.21823      312.412    8.21823      151.047    8.21823      
1 1 1 -42 4  1  f 1 811     18.1  ?     ?   594.918   50.1731      653.864    50.1731      128.164    50.1731      
1 1 1 42  4  0  o 0 722.4   15.1  ?     ?   621.196   81.335       569.995    81.335       20.6742    81.335       
1 1 1 42  4  1  f 1 234.2   7     ?     ?   417.187   98.4048      237.954    98.4048      133.52     -81.5952     
1 1 1 42  4  2  o 0 123.6   4.5   ?     ?   303.805   28.1074      139.901    28.1074      129.629    -151.893     
1 1 1 42  4  3  o 0 114.1   4.4   ?     ?   321.479   -28.1589     109.504    -28.1589     176.039    151.841      
1 1 1 42  4  4  f 1 242.1   6.9   ?     ?   409.676   -69.09       255.632    -69.09       110.423    110.91       
1 1 1 42  4  5  o 0 785.6   15.6  ?     ?   532.479   -57.3227     696.391    -57.3227     222.819    -57.3227     
1 1 1 42  4  6  o 0 25.9    5.1   ?     ?   225.914   -92.8735     81.5315    87.1265      282.471    87.1265      
1 1 1 42  4  7  f 1 80.2    5.9   ?     ?   188.463   140.652      122.64     140.652      47.2735    -39.3479     
1 1 1 42  4  8  o 0 57.4    7     ?     ?   162.398   -14.6194     68.2861    -14.6194     77.2726    165.381      
1 1 1 42  4  9  o 0 136.5   8.7   ?     ?   289.173   -155.719     225.264    -155.719     67.0451    24.2806      
1 1 1 42  4  10 o 0 248.7   10.1  ?     ?   330.618   178.921      386.89     178.921      53.2227    178.921      
1 1 1 42  4  11 o 0 28.7    8.4   ?     ?   56.9273   32.8153      31.0388    32.8153      25.2941    -147.185     
1 1 1 42  4  12 o 0 196.5   11.3  ?     ?   376.207   148.668      273.635    148.668      97.7058    -31.3318     
1 1 1 42  4  13 o 0 55.5    11    ?     ?   166.517   -164.415     137.23     -164.415     23.9058    15.5845      
1 1 1 42  4  14 o 0 2.4     14.4  ?     ?   31.4195   20.6359      6.06928    -159.364     35.6146    -159.364     
1 1 1 42  4  15 o 0 301.6   16.7  ?     ?   352.974   -168.559     469.509    -168.559     137.636    -168.559     
1 1 1 42  4  16 f 1 137.1   16.1  ?     ?   184.221   -127.211     335.533    -127.211     162.19     -127.211     
1 1 1 42  4  17 o 0 99      21.4  ?     ?   195.772   -151.024     250.324    -151.024     57.429     -151.024     
1 1 1 42  4  18 o 0 51.6    21.6  ?     ?   117.113   137.073      157.658    137.073      37.9101    137.073      
1 1 1 42  4  19 f 1 -27.6   24.8  ?     ?   59.0441   117.145      2.6171     -62.8551     60.9256    -62.8551     
1 1 1 42  4  20 o 0 13      30.8  ?     ?   60.4748   -70.9746     66.3947    -70.9746     8.57029    -70.9746     
1 1 1 42  4  21 o 0 0.2     23.3  ?     ?   100.596   -117.501     31.8839    -117.501     62.4353    62.4994      
1 1 1 42  4  22 < 0 -33.5   26.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 6  22 < 0 159.3   7.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 6  21 o 0 -0.3    6.4   ?     ?   36.1412   -176.543     8.5236     3.45713      38.963     3.45713      
1 1 1 -42 6  20 o 0 16.6    5.4   ?     ?   38.02     -74.2687     36.7832    -74.2687     4.48848    -74.2687     
1 1 1 -42 6  19 o 0 22.8    4.9   ?     ?   67.6624   38.4613      72.3496    38.4613      13.5152    38.4613      
1 1 1 -42 6  18 o 0 127     5.4   ?     ?   320.557   64.1112      199.31     64.1112      88.1724    -115.889     
1 1 1 -42 6  17 o 0 140.3   5.2   ?     ?   301.443   88.4061      234.015    88.4061      46.2781    -91.5939     
1 1 1 -42 6  16 o 0 205.3   5.7   ?     ?   346.132   58.827       318.604    58.827       4.98033    58.827       
1 1 1 -42 6  15 o 0 151     4.8   ?     ?   320.75    -8.79952     238.163    -8.79952     41.4042    171.2        
1 1 1 -42 6  14 o 0 82.9    3.4   ?     ?   258.989   -77.5501     148.384    -77.5501     77.1927    102.45       
1 1 1 -42 6  13 o 0 207.3   5.4   ?     ?   387.678   -126.524     281.37     -126.524     57.579     53.4758      
1 1 1 -42 6  12 o 0 107.5   3.7   ?     ?   216.894   -91.7256     229.795    -91.7256     33.934     -91.7256     
1 1 1 -42 6  11 o 0 137.2   3.7   ?     ?   294.555   -10.5327     231.781    -10.5327     35.9885    169.467      
1 1 1 -42 6  10 f 1 220     5.4   ?     ?   266.066   -12.6301     386.199    -12.6301     137.412    -12.6301     
1 1 1 -42 6  9  o 0 47.8    2     ?     ?   117.345   -133.556     106.896    -133.556     2.90055    46.4439      
1 1 1 -42 6  8  o 0 129.4   4.1   ?     ?   140.81    -90.2883     287.513    -90.2883     152.702    -90.2883     
1 1 1 -42 6  7  o 0 4.7     3.2   ?     ?   114.636   30.976       87.6655    -149.024     197.96     -149.024     
1 1 1 -42 6  6  o 0 95.3    5.4   ?     ?   132.12    -110.653     157        -110.653     43.909     -110.653     
1 1 1 -42 6  5  f 1 409.5   12.2  ?     ?   634.282   23.7646      263.189    23.7646      284.77     -156.235     
1 1 1 -42 6  4  o 0 37.3    4.9   ?     ?   168.313   -68.1078     4.3737     -68.1078     140.825    111.892      
1 1 1 -42 6  3  o 0 227.7   8.5   ?     ?   433.627   -85.8448     216.862    -85.8448     158.458    94.1552      
1 1 1 -42 6  2  o 0 25.7    1.6   ?     ?   113.024   160.471      17.3911    -19.5293     115.504    -19.5293     
1 1 1 -42 6  1  o 0 81.5    2.8   ?     ?   173.959   86.2949      126.608    86.2949      24.7887    -93.7051     
1 1 1 42  6  0  o 0 13.6    2.3   ?     ?   154.083   -94.2355     76.4076    85.7645      211.769    85.7645      
1 1 1 42  6  1  o 0 176.3   5.4   ?     ?   241.049   -124.573     283.256    -124.573     71.1516    -124.573     
1 1 1 42  6  2  o 0 937.3   18.3  ?     ?   653.889   146.862      694.696    146.862      118.58     146.862      
1 1 1 42  6  3  o 0 1102.6  21.1  ?     ?   660.713   134.098      798.947    134.098      216.261    134.098      
1 1 1 42  6  4  o 0 152.2   5.5   ?     ?   104.308   155.096      259.587    155.096      167.543    155.096      
1 1 1 42  6  5  f 1 138.7   6.1   ?     ?   32.6694   51.6818      105.166    51.6818      76.1821    51.6818      
1 1 1 42  6  6  o 0 114.9   6     ?     ?   254.627   87.8208      203.859    87.8208      49.8579    -92.1792     
1 1 1 42  6  7  o 0 124.6   6.7   ?     ?   320.731   32.8161      170.589    32.8161      148.813    -147.184     
1 1 1 42  6  8  o 0 511.2   12.6  ?     ?   457.925   -78.8333     591.35     -78.8333     135.774    -78.8333     
1 1 1 42  6  9  o 0 60.3    7.4   ?     ?   64.2584   -81.0587     125.119    -81.0587     62.3959    -81.0587     
1 1 1 42  6  10 f 1 28.1    8     ?     ?   177.301   179.788      9.74272    179.788      163.886    -0.212221    
1 1 1 42  6  11 o 0 23.6    8     ?     ?   179.603   -109.603     1.83047    70.3968      173.491    70.3968      
1 1 1 42  6  12 o 0 233.9   12.3  ?     ?   294.452   157.48       420.398    157.48       146.735    157.48       
1 1 1 42  6  13 o 0 80.7    13.3  ?     ?   279.554   -147.469     132.086    -147.469     126.891    32.5308      
1 1 1 42  6  14 o 0 18.9    12.8  ?     ?   135.5     117.617      8.00365    117.617      117.531    -62.3831     
1 1 1 42  6  15 o 0 114.9   16.9  ?     ?   246.729   -143.955     237.423    -143.955     7.79094    -143.955     
1 1 1 42  6  16 o 0 97.7    18.2  ?     ?   241.321   162.98       203.883    162.98       38.8097    -17.0198     
1 1 1 42  6  17 o 0 406.9   23.4  ?     ?   414.623   129.514      538.888    129.514      120.892    129.514      
1 1 1 42  6  18 o 0 159.2   26.6  ?     ?   220.506   95.4498      355.15     95.4498      141.508    95.4498      
1 1 1 42  6  19 o 0 53.6    27.2  ?     ?   165.468   -4.29849     121.659    -4.29849     34.3915    175.702      
1 1 1 42  6  20 o 0 57.1    27.8  ?     ?   187.813   -23.6505     117.035    -23.6505     57.0676    156.349      
1 1 1 -42 8  20 < 0 39.3    7.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 8  19 f 1 47.1    5.5   ?     ?   164.178   -142.701     135.879    -142.701     1.61379    37.2992      
1 1 1 -42 8  18 o 0 4.7     4.2   ?     ?   134.669   -81.874      50.6695    98.126       163.762    98.126       
1 1 1 -42 8  17 o 0 4.3     4     ?     ?   61.1506   95.9904      22.8191    -84.0096     75.3568    -84.0096     
1 1 1 -42 8  16 f 1 88      4.9   ?     ?   227.094   125.583      189.061    125.583      13.084     -54.4169     
1 1 1 -42 8  15 f 1 54.7    3.9   ?     ?   115.733   70.0767      175.699    70.0767      68.1513    70.0767      
1 1 1 -42 8  14 o 0 57.9    3.2   ?     ?   39.3283   160.278      142.016    160.278      105.625    160.278      
1 1 1 -42 8  13 f 1 144.7   4.3   ?     ?   269.99    103.882      262.573    103.882      29.4258    103.882      
1 1 1 -42 8  12 o 0 115.6   3.5   ?     ?   329.144   165.322      163.394    165.322      119.009    -14.6782     
1 1 1 -42 8  11 o 0 89.8    2.8   ?     ?   250.644   -167.157     169.848    -167.157     46.7039    12.8425      
1 1 1 -42 8  10 o 0 383.3   8.9   ?     ?   478.309   -70.4545     431.271    -70.4545     16.8869    -70.4545     
1 1 1 -42 8  9  o 0 262.4   9.5   ?     ?   416.182   -57.5227     325.048    -57.5227     46.9635    122.477      
1 1 1 -42 8  8  o 0 143.6   6.8   ?     ?   337.297   -107.743     205.866    -107.743     97.3283    72.2568      
1 1 1 -42 8  7  o 0 38.7    4.9   ?     ?   220.069   -59.087      40.0677    -59.087      158.777    120.913      
1 1 1 -42 8  6  o 0 424.1   13.2  ?     ?   398.386   -166.252     532.665    -166.252     164.847    -166.252     
1 1 1 -42 8  5  f 1 139.1   6.8   ?     ?   199.317   124.148      296.396    124.148      110.627    124.148      
1 1 1 -42 8  4  o 0 82.5    5.9   ?     ?   240.375   165.107      145.51     165.107      78.2485    -14.8927     
1 1 1 -42 8  3  o 0 82.8    7.2   ?     ?   198.18    -177.911     176.091    -177.911     9.03066    2.08922      
1 1 1 -42 8  2  o 0 469.6   15.7  ?     ?   542.473   102.295      460.915    102.295      47.37      -77.7051     
1 1 1 -42 8  1  o 0 6.8     2.2   ?     ?   44.078    -30.3776     29.3655    149.622      71.5116    149.622      
1 1 1 42  8  0  o 0 255.1   6.3   ?     ?   438.379   -159.126     286.642    -159.126     138.469    20.8739      
1 1 1 42  8  1  o 0 639.2   13.3  ?     ?   523.268   -62.6985     641.349    -62.6985     133.201    -62.6985     
1 1 1 42  8  2  o 0 136.3   5.4   ?     ?   218.324   -166.578     287.254    -166.578     78.719     -166.578     
1 1 1 42  8  3  o 0 349.3   8.9   ?     ?   336.543   -128.195     517.925    -128.195     196.247    -128.195     
1 1 1 42  8  4  o 0 68      5.2   ?     ?   126.381   74.4678      172.183    74.4678      51.3455    74.4678      
1 1 1 42  8  5  f 1 12.6    5.2   ?     ?   119.506   90.6155      43.2486    -89.3845     158.093    -89.3845     
1 1 1 42  8  6  o 0 31.8    6.2   ?     ?   183.235   -149.891     23.8324    -149.891     151.273    30.1085      
1 1 1 42  8  7  o 0 51      6.6   ?     ?   327.344   -174.008     2.28756    5.99213      309.612    5.99213      
1 1 1 42  8  8  o 0 51.6    7.9   ?     ?   225.248   60.5779      82.1445    60.5779      129.053    -119.422     
1 1 1 42  8  9  o 0 59.5    9     ?     ?   175.368   -149.7       150.215    -149.7       9.84172    30.3003      
1 1 1 42  8  10 o 0 -6      8.8   ?     ?   44.907    -64.6209     27.2197    115.379      68.1166    115.379      
1 1 1 42  8  11 o 0 286.4   12.8  ?     ?   347.045   104.871      441.207    104.871      124.793    104.871      
1 1 1 42  8  12 o 0 50.9    11.7  ?     ?   230.445   151.565      83.9046    151.565      127.391    -28.4345     
1 1 1 42  8  13 f 1 5.4     13.9  ?     ?   87.4672   -55.667      11.6937    124.333      95.909     124.333      
1 1 1 42  8  14 o 0 16.7    15.1  ?     ?   193.961   -104.748     29.6665    75.2524      221.279    75.2524      
1 1 1 42  8  15 f 1 119.3   19.5  ?     ?   195.471   -100.678     288.321    -100.678     93.6314    -100.678     
1 1 1 42  8  16 f 1 57.4    20.8  ?     ?   124.383   -24.0223     173.175    -24.0223     54.0423    -24.0223     
1 1 1 42  8  17 o 0 16.9    17.4  ?     ?   103.867   55.3605      43.8334    55.3605      52.5641    -124.639     
1 1 1 42  8  18 o 0 21.2    20.3  ?     ?   52.2034   26.3824      69.3851    26.3824      21.8414    26.3824      
1 1 1 42  8  19 < 1 20.6    26    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 10 17 < 0 20.7    5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 10 16 o 0 15.2    4.2   ?     ?   74.0833   -151.673     55.0385    -151.673     6.05336    28.327       
1 1 1 -42 10 15 o 0 -0.6    3.6   ?     ?   8.97136   132.841      5.01908    -47.1589     12.4677    -47.1589     
1 1 1 -42 10 14 o 0 48.3    3.7   ?     ?   157.84    23.8041      136.566    23.8041      2.64       23.8041      
1 1 1 -42 10 13 o 0 40.9    3     ?     ?   93.3387   62.4364      138.996    62.4364      57.4523    62.4364      
1 1 1 -42 10 12 o 0 157.4   4.5   ?     ?   277.98    -8.21204     278.434    -8.21204     25.1847    -8.21204     
1 1 1 -42 10 11 o 0 126.7   4.7   ?     ?   273.598   11.1367      226.811    11.1367      22.3804    -168.863     
1 1 1 -42 10 10 f 1 25.6    5.9   ?     ?   174.381   115.512      28.5101    115.512      132.214    -64.4875     
1 1 1 -42 10 9  o 0 8.9     6.1   ?     ?   77.6318   164.234      17.5798    -15.766      83.571     -15.766      
1 1 1 -42 10 8  o 0 191.3   9.4   ?     ?   295.596   -92.7976     318.796    -92.7976     66.0506    -92.7976     
1 1 1 -42 10 7  o 0 139.4   7.7   ?     ?   154.782   129.4        331.405    129.4        199.501    129.4        
1 1 1 -42 10 6  o 0 183.9   8.7   ?     ?   324.9     131.63       287.255    131.63       9.00173    131.63       
1 1 1 -42 10 5  o 0 29.8    5.2   ?     ?   87.5978   -34.9272     69.3857    -34.9272     5.97444    145.073      
1 1 1 -42 10 4  f 1 69.7    8.1   ?     ?   86.2157   -141.387     194.114    -141.387     119.538    -141.387     
1 1 1 -42 10 3  o 0 47.2    7.2   ?     ?   117.207   135.941      129.465    135.941      28.2333    135.941      
1 1 1 -42 10 2  o 0 194.3   10    ?     ?   229.236   -94.2189     382.027    -94.2189     183.399    -94.2189     
1 1 1 -42 10 1  o 0 202.6   5.1   ?     ?   321.151   -100.039     326.389    -100.039     47.3417    -100.039     
1 1 1 42  10 0  o 0 125.7   4.6   ?     ?   177.349   -82.3594     304.905    -82.3594     147.743    -82.3594     
1 1 1 42  10 1  o 0 289.9   7.4   ?     ?   302.424   -52.872      474.04     -52.872      205.725    -52.872      
1 1 1 42  10 2  o 0 7.9     4.1   ?     ?   40.1273   4.96758      14.4522    -175.032     50.0823    -175.032     
1 1 1 42  10 3  o 0 234.2   7.4   ?     ?   318.455   81.9071      383.845    81.9071      100.962    81.9071      
1 1 1 42  10 4  f 1 118.3   6.6   ?     ?   178.035   166.892      289.017    166.892      130.051    166.892      
1 1 1 42  10 5  o 0 20.1    6.3   ?     ?   43.8595   -61.9082     21.8869    -61.9082     17.2068    118.092      
1 1 1 42  10 6  o 0 221.3   9.8   ?     ?   343.305   75.6679      342.605    75.6679      36.8426    75.6679      
1 1 1 42  10 7  o 0 88.2    9     ?     ?   151.755   43.388       237.333    43.388       102.336    43.388       
1 1 1 42  10 8  o 0 13.4    9.9   ?     ?   104.768   -126.699     1.8572     53.3006      95.7195    53.3006      
1 1 1 42  10 9  o 0 4       8.7   ?     ?   43.8451   -138.587     14.8743    41.4134      55.9717    41.4134      
1 1 1 42  10 10 f 1 311.7   13    ?     ?   310.994   -15.9154     503.977    -15.9154     201.352    -15.9154     
1 1 1 42  10 11 o 0 400.1   17.7  ?     ?   438.818   20.7972      492.255    20.7972      65.5001    20.7972      
1 1 1 42  10 12 o 0 59.5    16.4  ?     ?   104.159   36.6146      193.966    36.6147      93.0121    36.6147      
1 1 1 42  10 13 o 0 102.1   16.9  ?     ?   99.7611   78.6225      314.223    78.6225      221.145    78.6225      
1 1 1 42  10 14 o 0 74.5    20.6  ?     ?   252.735   144.683      132.47     144.683      97.4323    -35.3173     
1 1 1 42  10 15 o 0 6.2     22.6  ?     ?   95.7004   135.573      39.4078    135.573      46.1072    -44.4268     
1 1 1 42  10 16 o 0 36      24.8  ?     ?   58.2183   82.0318      126.195    82.0318      74.3248    82.0318      
1 1 1 -42 12 14 < 0 106.4   5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 12 13 o 0 18.1    3.3   ?     ?   109.987   -48.5963     57.6153    -48.5963     31.172     131.404      
1 1 1 -42 12 12 o 0 31.3    3     ?     ?   135.913   -117.46      100.24     -117.46      10.3462    62.5396      
1 1 1 -42 12 11 o 0 15.9    3.1   ?     ?   80.9207   -89.5153     46.4943    -89.5153     19.6905    90.4847      
1 1 1 -42 12 10 o 0 14.9    2.9   ?     ?   61.5393   -104.468     32.3394    -104.468     19.0153    75.5324      
1 1 1 -42 12 9  o 0 15.9    7.3   ?     ?   141.678   73.7049      8.86012    73.7049      110.144    -106.295     
1 1 1 -42 12 8  o 0 234.1   11.7  ?     ?   313.26    130.541      369.833    130.541      99.47      130.541      
1 1 1 -42 12 7  o 0 -1.1    7.6   ?     ?   53.8637   -159.373     22.7925    20.6266      69.5414    20.6266      
1 1 1 -42 12 6  o 0 105.6   8     ?     ?   261.432   44.5134      189.948    44.5134      46.0695    -135.487     
1 1 1 -42 12 5  o 0 6.2     6.7   ?     ?   102.269   12.9307      31.0859    -167.069     123.848    -167.069     
1 1 1 -42 12 4  o 0 116.1   5     ?     ?   285.168   54.4042      194.537    54.4042      65.2222    -125.596     
1 1 1 -42 12 3  o 0 346.5   11.3  ?     ?   416.358   34.9405      425.564    34.9405      47.6916    34.9405      
1 1 1 -42 12 2  o 0 40.3    3.2   ?     ?   84.7937   97.0742      127.127    97.0742      49.9112    97.0742      
1 1 1 -42 12 1  o 0 6.9     3.6   ?     ?   115.704   1.01861      46.9514    -178.981     152.624    -178.981     
1 1 1 42  12 0  o 0 48.3    4.4   ?     ?   96.1466   106.477      158.526    106.477      68.417     106.477      
1 1 1 42  12 1  o 0 15.5    5.1   ?     ?   153.385   63.6705      11.7423    -116.33      155.628    -116.33      
1 1 1 42  12 2  o 0 20.8    5.7   ?     ?   115.925   52.7376      39.7787    52.7376      69.0251    -127.262     
1 1 1 42  12 3  o 0 76.4    6.6   ?     ?   252.797   88.8517      136.259    88.8517      101.042    -91.1483     
1 1 1 42  12 4  o 0 125.5   9.3   ?     ?   253.438   63.4074      247.664    63.4074      8.04103    63.4074      
1 1 1 42  12 5  o 0 79.6    9.4   ?     ?   154.804   1.22578      223.167    1.22578      76.9       1.22578      
1 1 1 42  12 6  o 0 11.1    9.7   ?     ?   101.698   -86.4627     2.36886    93.5373      98.3527    93.5373      
1 1 1 42  12 7  o 0 74.2    11.1  ?     ?   156.934   -56.9125     210.469    -56.9125     67.5576    -56.9125     
1 1 1 42  12 8  o 0 169.4   13.6  ?     ?   281.563   -16.9231     310.134    -16.9231     54.2271    -16.9231     
1 1 1 42  12 9  o 0 63.6    13.5  ?     ?   153.771   -35.9046     185.129    -35.9046     48.61      -35.9046     
1 1 1 42  12 10 o 0 17      13.2  ?     ?   142.348   -37.9865     23.2153    -37.9865     101.165    142.013      
1 1 1 42  12 11 o 0 19.4    15.6  ?     ?   68.023    -34.9598     60.4256    -34.9598     1.18227    -34.9598     
1 1 1 42  12 12 o 0 135.9   18    ?     ?   161.088   73.456       349.031    73.456       208.938    73.456       
1 1 1 42  12 13 < 0 36.3    20.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 14 8  < 0 48.4    5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 14 7  < 0 3.3     3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -42 14 6  o 0 122.4   5.5   ?     ?   196.158   18.0417      282.006    18.0417      124.989    18.0417      
1 1 1 -42 14 5  o 0 9.8     3.2   ?     ?   62.8802   159.794      23.0795    159.794      27.4999    -20.2064     
1 1 1 -42 14 4  o 0 87.3    4.9   ?     ?   247.726   -149.016     174.746    -149.016     25.4034    30.9844      
1 1 1 -42 14 3  o 0 132.7   6.3   ?     ?   178.534   179.743      317.431    179.743      172.611    179.743      
1 1 1 -42 14 2  o 0 22.9    4.8   ?     ?   108.905   -103.162     72.4039    -103.162     16.0499    76.8381      
1 1 1 -42 14 1  o 0 36.2    5.6   ?     ?   60.5399   -56.4964     129.622    -56.4964     80.2983    -56.4964     
1 1 1 42  14 0  f 1 55.2    6.5   ?     ?   90.9433   -30.13       198.282    -30.13       121.366    -30.13       
1 1 1 42  14 1  o 0 27.9    6.7   ?     ?   134.925   -12.8298     82.2915    -12.8298     31.314     167.17       
1 1 1 42  14 2  o 0 25.1    8.9   ?     ?   179.607   -75.7904     38.7021    -75.7904     112.906    104.21       
1 1 1 42  14 3  o 0 22      9.1   ?     ?   136.061   -18.1902     53.6153    -18.1902     61.2189    161.81       
1 1 1 42  14 4  o 0 -1.1    9.4   ?     ?   47.6545   -49.6989     1.93024    130.301      42.1278    130.301      
1 1 1 42  14 5  o 0 95.5    11    ?     ?   220.091   154.318      218.523    154.318      33.0521    154.318      
1 1 1 42  14 6  < 0 6.4     12.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 42  14 7  < 0 18.3    16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 42  14 8  < 0 10.4    16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 1  23 < 0 9.4     5.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 1  22 o 0 54      4.5   ?     ?   192.797   72.6023      138.866    72.6023      27.9531    -107.398     
1 1 1 -43 1  21 o 0 78.5    5     ?     ?   175.469   -161.678     216.15     -161.678     60.7089    -161.678     
1 1 1 -43 1  20 o 0 74.9    4.3   ?     ?   269.165   -105.939     128.23     -105.939     117.727    74.0615      
1 1 1 -43 1  19 o 0 319.1   7.7   ?     ?   374.823   111.316      448.611    111.316      93.4511    111.316      
1 1 1 -43 1  18 o 0 109     4.4   ?     ?   319.251   122.671      160.16     122.671      121.044    -57.3288     
1 1 1 -43 1  17 f 1 137.1   4.4   ?     ?   246.848   -170.031     274.573    -170.031     56.0513    -170.031     
1 1 1 -43 1  16 o 0 376.7   8.2   ?     ?   432.027   -131.699     472.23     -131.699     90.0609    -131.699     
1 1 1 -43 1  15 o 0 221     5.8   ?     ?   353.116   -70.0643     326.823    -70.0643     4.00734    -70.0643     
1 1 1 -43 1  14 o 0 202.7   5.1   ?     ?   242.112   -77.6663     392.024    -77.6663     169.077    -77.6663     
1 1 1 -43 1  13 o 0 111.7   3.6   ?     ?   206.952   168.642      240.618    168.642      45.486     168.642      
1 1 1 -43 1  12 f 1 307     6.9   ?     ?   484.728   168.646      312.827    168.646      157.717    -11.3541     
1 1 1 -43 1  11 o 0 356.4   7.3   ?     ?   493.487   -91.3664     372.035    -91.3664     107.401    88.6336      
1 1 1 -43 1  10 o 0 422.9   10    ?     ?   603.568   -102.398     306.883    -102.398     215.327    77.6016      
1 1 1 -43 1  9  o 0 429.9   9.1   ?     ?   542.925   -131.141     365.647    -131.141     106.504    48.859       
1 1 1 -43 1  8  f 1 200.5   5     ?     ?   639.77    -74.9212     7.16933    -74.9212     549.834    105.079      
1 1 1 -43 1  7  o 0 664.1   12.8  ?     ?   440.391   56.6149      658.813    56.6149      275.693    56.6149      
1 1 1 -43 1  6  o 0 19.2    1.9   ?     ?   81.2799   81.8877      34.0758    -98.1123     105.069    -98.1123     
1 1 1 -43 1  5  o 0 45      2.2   ?     ?   87.6678   -75.9918     13.7388    -75.9918     63.1149    104.008      
1 1 1 -43 1  4  o 0 267.4   5.7   ?     ?   388.227   -90.5273     290.239    -90.5273     58.5034    89.4727      
1 1 1 -43 1  3  o 0 1592.7  29.2  ?     ?   913.684   -16.5674     856.478    -16.5674     33.22      -16.5674     
1 1 1 -43 1  2  o 0 324     7.1   ?     ?   281.786   36.2817      435.689    36.2817      181.092    36.2817      
1 1 1 -43 1  1  o 0 373.7   8.1   ?     ?   482.999   79.7517      346.67     79.7517      90.8001    -100.248     
1 1 1 43  1  0  o 0 124.9   4     ?     ?   575.14    -24.8608     80.3287    155.139      602.806    155.139      
1 1 1 43  1  1  o 0 43.4    3.5   ?     ?   208.132   -45.6567     28.8873    134.343      218.321    134.343      
1 1 1 43  1  2  o 0 139.6   4.7   ?     ?   337.806   116.742      133.112    116.742      174.842    -63.258      
1 1 1 43  1  3  o 0 238.2   6.4   ?     ?   159.169   -134.942     363.41     -134.942     218.117    -134.942     
1 1 1 43  1  4  o 0 430     10.1  ?     ?   480.06    -124.467     412.991    -124.467     25.6559    55.5326      
1 1 1 43  1  5  o 0 410.6   10.1  ?     ?   277.799   -25.8582     557.555    -25.8582     308.847    -25.8582     
1 1 1 43  1  6  o 0 278.5   8.2   ?     ?   399.653   -40.4091     315.896    -40.4091     42.0072    139.591      
1 1 1 43  1  7  o 0 882.9   18.8  ?     ?   535.87    -8.48908     771.177    -8.48908     291.335    -8.48908     
1 1 1 43  1  8  f 1 258.6   9.3   ?     ?   242.456   9.46914      411.26     9.46914      191.237    9.46914      
1 1 1 43  1  9  o 0 689.6   16.2  ?     ?   551.843   96.8351      610.41     96.8351      112.65     96.8351      
1 1 1 43  1  10 o 0 417.5   12.5  ?     ?   489.469   -6.07568     410.291    -6.07568     30.6088    173.924      
1 1 1 43  1  11 o 0 732.3   20.3  ?     ?   395.419   -58.6203     877.704    -58.6203     476.263    -58.6203     
1 1 1 43  1  12 f 1 118.9   11.2  ?     ?   199.982   -44.0134     273.215    -44.0134     73.1564    -44.0134     
1 1 1 43  1  13 o 0 143.8   13.4  ?     ?   300.446   -121.873     244.293    -121.873     53.9253    58.1269      
1 1 1 43  1  14 o 0 152.2   16    ?     ?   296.455   167.893      273.002    167.893      15.4301    -12.1072     
1 1 1 43  1  15 o 0 17.6    13.3  ?     ?   70.9284   70.8454      16.2909    70.8454      50.7587    -109.155     
1 1 1 43  1  16 o 0 79.9    16.4  ?     ?   206.737   50.5961      187.574    50.5961      7.80521    -129.404     
1 1 1 43  1  17 f 1 7.2     16.5  ?     ?   113.48    -116.598     6.68794    63.4023      114.944    63.4023      
1 1 1 43  1  18 o 0 232     22.6  ?     ?   253.255   -27.729      463.131    -27.729      203.483    -27.729      
1 1 1 43  1  19 o 0 43      23.4  ?     ?   113.574   -57.887      127.646    -57.887      10.9521    -57.887      
1 1 1 43  1  20 o 0 -33     22.5  ?     ?   176.362   -114.005     77.6638    65.995       251.769    65.995       
1 1 1 43  1  21 o 0 -7.4    24    ?     ?   93.1232   156.149      23.3557    156.149      64.9443    -23.8514     
1 1 1 -43 3  23 < 0 76.6    5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 3  22 o 0 67.8    6.1   ?     ?   243.367   -151.345     139.096    -151.345     69.299     28.6546      
1 1 1 -43 3  21 f 1 26.6    4.5   ?     ?   95.6507   -109.425     99.1014    -109.425     16.0736    -109.425     
1 1 1 -43 3  20 f 1 147     6     ?     ?   217.796   174.314      323.685    174.314      126.034    174.314      
1 1 1 -43 3  19 o 0 2.9     3.7   ?     ?   128.323   131.895      77.939     -48.1055     199.018    -48.1055     
1 1 1 -43 3  18 o 0 53.8    3.8   ?     ?   198.216   143.32       118.491    143.32       68.8908    -36.68       
1 1 1 -43 3  17 f 1 29      3.5   ?     ?   60.003    -99.7134     67.8667    -99.7134     14.8736    -99.7134     
1 1 1 -43 3  16 o 0 45.9    3.2   ?     ?   189.491   31.945       95.529     31.945       70.926     -148.055     
1 1 1 -43 3  15 o 0 348.4   8.1   ?     ?   416.634   124.325      450.549    124.325      83.0046    124.325      
1 1 1 -43 3  14 o 0 264.4   6.6   ?     ?   342.057   131.384      398.107    131.384      86.2987    131.384      
1 1 1 -43 3  13 o 0 39.6    2.5   ?     ?   178.168   -104.723     57.6854    -104.723     108.665    75.2774      
1 1 1 -43 3  12 o 0 24.3    2.2   ?     ?   218.289   -7.82192     30.9084    172.178      236.082    172.178      
1 1 1 -43 3  11 o 0 181.5   4.5   ?     ?   300.859   122.944      288.241    122.944      1.36631    -57.0565     
1 1 1 -43 3  10 o 0 438     8.9   ?     ?   550.442   99.8872      413.121    99.8873      119.818    -80.1127     
1 1 1 -43 3  9  o 0 116.9   3.4   ?     ?   420.164   91.8058      49.2847    91.8058      312.95     -88.1942     
1 1 1 -43 3  8  o 0 117.7   3.4   ?     ?   143.941   6.99661      207.126    6.99661      82.4116    6.99661      
1 1 1 -43 3  7  o 0 427.8   8.5   ?     ?   440.633   -16.1465     446.498    -16.1465     62.9688    -16.1465     
1 1 1 -43 3  6  o 0 382.3   7.7   ?     ?   480.42    106.697      364.288    106.697      51.9877    -73.3026     
1 1 1 -43 3  5  o 0 94.8    3     ?     ?   278.811   -15.6534     92.407     -15.6534     150.107    164.347      
1 1 1 -43 3  4  o 0 1708.1  31    ?     ?   1025.39   -89.5731     831.606    -89.5731     63.4043    90.4269      
1 1 1 -43 3  3  o 0 378.9   8.2   ?     ?   348.766   73.5992      464.164    73.5992      158.783    73.5992      
1 1 1 -43 3  2  o 0 1591.2  28.9  ?     ?   796.146   83.6634      971.586    83.6634      272.51     83.6634      
1 1 1 -43 3  1  o 0 1009.3  27.1  ?     ?   504.321   81.6361      856.369    81.6361      402.983    81.6361      
1 1 1 43  3  0  o 0 130.8   5.2   ?     ?   388.682   111.619      79.4531    111.619      271.715    -68.381      
1 1 1 43  3  1  o 0 195.7   6.5   ?     ?   214.388   0.798033     312.217    0.798033     122.206    0.798033     
1 1 1 43  3  2  o 0 755.7   15.6  ?     ?   524.442   -7.77815     678.602    -7.77815     213.07     -7.77815     
1 1 1 43  3  3  o 0 662.3   17.2  ?     ?   412.301   7.10566      693.281    7.10566      326.839    7.10566      
1 1 1 43  3  4  o 0 31.6    4.2   ?     ?   28.0429   147.684      3.26492    -32.316      28.2114    -32.316      
1 1 1 43  3  5  o 0 256.5   10.5  ?     ?   294.956   -105.449     359.252    -105.449     96.7169    -105.449     
1 1 1 43  3  6  o 0 145.2   6.2   ?     ?   384.101   112.405      124.917    112.405      217.028    -67.5947     
1 1 1 43  3  7  o 0 42.1    5.8   ?     ?   274.168   -148.921     30.5801    31.0786      276.744    31.0786      
1 1 1 43  3  8  o 0 712.7   17.3  ?     ?   449.675   124.333      711.268    124.333      307.775    124.333      
1 1 1 43  3  9  o 0 131.4   7.5   ?     ?   178.417   74.2482      237.325    74.2482      77.3983    74.2482      
1 1 1 43  3  10 o 0 169.8   8.9   ?     ?   134.059   85.7865      386.091    85.7865      250.614    85.7865      
1 1 1 43  3  11 o 0 251.4   10.8  ?     ?   421.099   48.7255      322.236    48.7255      95.0778    -131.274     
1 1 1 43  3  12 o 0 591.9   17    ?     ?   499.733   95.4749      654.752    95.4749      160.694    95.4749      
1 1 1 43  3  13 o 0 116.1   11.9  ?     ?   199.512   111.901      277.385    111.901      83.984     111.901      
1 1 1 43  3  14 o 0 545.8   17.4  ?     ?   513.639   100.663      616.298    100.663      132.389    100.663      
1 1 1 43  3  15 o 0 6.1     13.1  ?     ?   33.0378   103.163      5.00702    -76.8366     36.0161    -76.8366     
1 1 1 43  3  16 o 0 100     16.1  ?     ?   155.502   -165.453     273.368    -165.453     127.479    -165.453     
1 1 1 43  3  17 f 1 41.8    19.4  ?     ?   118.387   -91.5765     114.582    -91.5764     2.93941    88.4236      
1 1 1 43  3  18 o 0 71.2    20.4  ?     ?   155.423   88.5383      202.627    88.5383      44.4971    88.5383      
1 1 1 43  3  19 o 0 -73.2   24.6  ?     ?   130.199   129.916      66.1403    -50.0836     194.401    -50.0836     
1 1 1 43  3  20 f 1 -1      24.8  ?     ?   103.497   -175.231     25.2264    -175.231     74.526     4.76882      
1 1 1 43  3  21 f 1 31.5    30.5  ?     ?   125.249   -101.026     97.8464    -101.026     20.5473    78.9735      
1 1 1 -43 5  22 < 0 76.9    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 5  21 o 0 13.9    5.4   ?     ?   129.634   15.2458      20.207     15.2458      89.7452    -164.754     
1 1 1 -43 5  20 f 1 5.9     4.8   ?     ?   184.74    -77.1557     75.0547    102.844      233.873    102.844      
1 1 1 -43 5  19 o 0 43.9    4.8   ?     ?   103.317   -150.422     149.705    -150.422     57.332     -150.422     
1 1 1 -43 5  18 o 0 95.7    5.1   ?     ?   178.665   32.7693      243.623    32.7693      76.7056    32.7693      
1 1 1 -43 5  17 o 0 48.6    3.8   ?     ?   134.766   35.1285      144.658    35.1285      18.5295    35.1285      
1 1 1 -43 5  16 o 0 22      2.8   ?     ?   172.511   100.498      14.8832    100.498      135.165    -79.5018     
1 1 1 -43 5  15 f 1 201.2   6     ?     ?   155.942   -39.4514     442.533    -39.4514     306.252    -39.4514     
1 1 1 -43 5  14 o 0 169.7   4.8   ?     ?   316.411   129.534      278.246    129.534      2.00297    129.534      
1 1 1 -43 5  13 o 0 189     4.8   ?     ?   401.457   119.286      242.663    119.286      110.447    -60.7139     
1 1 1 -43 5  12 o 0 13.2    2     ?     ?   156.32    63.2119      39.7927    -116.788     181.787    -116.788     
1 1 1 -43 5  11 o 0 34.7    2.1   ?     ?   135.93    -14.5878     55.8696    -14.5878     70.526     165.412      
1 1 1 -43 5  10 o 0 11.4    1.7   ?     ?   181.361   70.1641      79.3721    -109.836     249.045    -109.836     
1 1 1 -43 5  9  o 0 264.7   6     ?     ?   296.769   166.501      418.405    166.501      134.219    166.501      
1 1 1 -43 5  8  o 0 58.1    2.4   ?     ?   298.558   -48.773      19.0917    -48.773      268.313    131.227      
1 1 1 -43 5  7  o 0 42.3    1.9   ?     ?   139.608   79.142       26.4377    79.142       93.1664    -100.858     
1 1 1 -43 5  6  o 0 394.2   8.2   ?     ?   503.807   11.8046      357.021    11.8046      76.5173    -168.195     
1 1 1 -43 5  5  o 0 905.2   18    ?     ?   620.895   -3.37434     686.623    -3.37434     150.165    -3.37434     
1 1 1 -43 5  4  o 0 3.1     1.3   ?     ?   89.3616   36.3692      69.5433    -143.631     147.036    -143.631     
1 1 1 -43 5  3  o 0 33.6    2     ?     ?   141.821   71.7564      0.185173   -108.244     123.573    -108.244     
1 1 1 -43 5  2  o 0 5.7     1.6   ?     ?   69.7826   -33.2193     50.9049    146.781      111.267    146.781      
1 1 1 -43 5  1  o 0 241.3   5.8   ?     ?   369.756   13.4916      279.198    13.4916      41.4602    -166.508     
1 1 1 43  5  0  o 0 814.3   16.7  ?     ?   640.629   -171.195     617.329    -171.195     57.2921    -171.195     
1 1 1 43  5  1  o 0 727.7   14.3  ?     ?   781.169   167.151      434.659    167.151      249.41     -12.8487     
1 1 1 43  5  2  o 0 436.9   9.4   ?     ?   345.727   110.45       537.388    110.45       231.554    110.45       
1 1 1 43  5  3  o 0 328.6   8.1   ?     ?   350.137   104.798      416.593    104.798      106.525    104.798      
1 1 1 43  5  4  o 0 10.8    4.5   ?     ?   137.445   -126.18      80.2777    53.82        202.083    53.82        
1 1 1 43  5  5  o 0 304.2   9.6   ?     ?   224.078   -67.279      473.474    -67.279      274.822    -67.279      
1 1 1 43  5  6  o 0 38.3    6.2   ?     ?   87.592    75.3559      17.966     75.3559      59.6859    -104.644     
1 1 1 43  5  7  o 0 58.2    6.3   ?     ?   34.8346   -41.7277     53.465     -41.7277     18.6114    -41.7277     
1 1 1 43  5  8  o 0 458.8   12.3  ?     ?   428.891   -29.7582     564.474    -29.7582     135.71     -29.7582     
1 1 1 43  5  9  o 0 115.7   8.7   ?     ?   203.038   157.22       261.403    157.22       62.221     157.22       
1 1 1 43  5  10 o 0 -1.5    7.1   ?     ?   75.397    94.0704      55.8557    -85.9296     129.694    -85.9296     
1 1 1 43  5  11 o 0 79      8.9   ?     ?   95.3903   25.8212      227.158    25.8212      135.498    25.8212      
1 1 1 43  5  12 o 0 156.9   11.9  ?     ?   219.885   111.878      342.539    111.878      131.805    111.878      
1 1 1 43  5  13 o 0 78.6    11.6  ?     ?   170.613   -94.5284     210.384    -94.5284     51.4299    -94.5284     
1 1 1 43  5  14 o 0 55.9    16    ?     ?   214.288   168.529      108.895    168.529      90.7977    -11.4709     
1 1 1 43  5  15 f 1 241.9   17.7  ?     ?   428.8     -167.481     307.051    -167.481     96.5094    12.5186      
1 1 1 43  5  16 o 0 146.7   18.1  ?     ?   283.867   -157.496     278.031    -157.496     9.22243    22.5042      
1 1 1 43  5  17 o 0 9.9     20.1  ?     ?   53.2092   -15.9178     29.8113    -15.9178     24.1736    164.082      
1 1 1 43  5  18 o 0 68.9    22.9  ?     ?   204.391   -12.2471     144.696    -12.2471     54.6343    167.753      
1 1 1 43  5  19 o 0 103.8   26.5  ?     ?   315.866   -32.1876     150.531    -32.1876     149.369    147.812      
1 1 1 43  5  20 f 1 79.9    29.3  ?     ?   262.614   -47.5114     119.261    -47.5114     126.58     132.489      
1 1 1 -43 7  20 < 0 39.7    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 7  19 o 0 52      5.4   ?     ?   136.725   -148.329     166.848    -148.329     51.9482    -148.329     
1 1 1 -43 7  18 o 0 -5.9    4.3   ?     ?   45.4924   -151.042     31.2804    28.958       70.4059    28.958       
1 1 1 -43 7  17 f 1 13.3    5.5   ?     ?   25.9437   99.8202      9.8983     99.8202      13.227     -80.1798     
1 1 1 -43 7  16 o 0 30      3.8   ?     ?   100.328   17.7067      94.3187    17.7067      1.40444    17.7067      
1 1 1 -43 7  15 o 0 161.6   5     ?     ?   216.204   67.2753      344.022    67.2753      143.557    67.2753      
1 1 1 -43 7  14 o 0 42.2    3     ?     ?   171.599   25.0879      95.1646    25.0879      52.6137    -154.912     
1 1 1 -43 7  13 o 0 90.8    3.3   ?     ?   206.163   31.4196      203.42     31.4196      26.0485    31.4196      
1 1 1 -43 7  12 o 0 54.2    2.7   ?     ?   153.808   -76.543      141.415    -76.543      8.11793    -76.543      
1 1 1 -43 7  11 o 0 193.4   4.9   ?     ?   287.725   -35.5189     338.56     -35.5189     88.4328    -35.5189     
1 1 1 -43 7  10 o 0 53      2.2   ?     ?   246.583   -15.9987     68.6194    -15.9987     152.628    164.001      
1 1 1 -43 7  9  o 0 6.4     4.5   ?     ?   42.2119   -177.908     21.0809    2.09238      59.1821    2.09238      
1 1 1 -43 7  8  o 0 14.1    4.5   ?     ?   49.3012   -40.4229     9.29037    139.577      54.7972    139.577      
1 1 1 -43 7  7  o 0 70      4.5   ?     ?   124.782   -113.684     173.013    -113.684     57.247     -113.684     
1 1 1 -43 7  6  o 0 458.4   13.8  ?     ?   404.259   149.474      569.698    149.474      192.892    149.474      
1 1 1 -43 7  5  o 0 246.1   8.9   ?     ?   357.965   67.8131      338.442    67.8131      2.59122    -112.187     
1 1 1 -43 7  4  o 0 16.7    4.9   ?     ?   179.53    -54.7302     66.611     125.27       238.307    125.27       
1 1 1 -43 7  3  o 0 46.6    6     ?     ?   121.057   -49.0279     74.2863    -49.0279     41.8869    130.972      
1 1 1 -43 7  2  o 0 81      5.9   ?     ?   234.292   54.4589      131.351    54.4589      94.1743    -125.541     
1 1 1 -43 7  1  o 0 14.3    1.9   ?     ?   172.944   -2.96866     75.8241    177.031      242.739    177.031      
1 1 1 43  7  0  o 0 191.1   5     ?     ?   258.362   97.496       343.151    97.496       90.716     97.496       
1 1 1 43  7  1  o 0 41.2    3     ?     ?   263.6     -17.1044     10.9318    162.896      268.881    162.896      
1 1 1 43  7  2  o 0 221.3   6     ?     ?   413.14    -178.186     261.164    -178.186     143.604    1.81424      
1 1 1 43  7  3  o 0 280     9.5   ?     ?   296.939   -135.493     449.738    -135.493     158.571    -135.493     
1 1 1 43  7  4  o 0 84.2    4.8   ?     ?   148.513   -47.4579     186.35     -47.4579     40.6541    -47.4579     
1 1 1 43  7  5  o 0 150.1   6.2   ?     ?   236.894   178.832      302.999    178.832      74.6335    178.832      
1 1 1 43  7  6  o 0 149.8   6.9   ?     ?   251.4     153.919      290.822    153.919      48.5437    153.919      
1 1 1 43  7  7  o 0 -3.8    6     ?     ?   110.054   11.5104      88.0761    -168.49      194.063    -168.49      
1 1 1 43  7  8  o 0 144.6   8.1   ?     ?   254.782   -125.209     288.137    -125.209     47.1418    -125.209     
1 1 1 43  7  9  o 0 455.3   13.7  ?     ?   304.222   167.113      681.558    167.113      394.245    167.113      
1 1 1 43  7  10 o 0 98.1    9.6   ?     ?   105.412   75.0432      285.198    75.0432      188.317    75.0432      
1 1 1 43  7  11 o 0 44.7    9.3   ?     ?   86.4261   146.588      126.214    146.588      46.9755    146.588      
1 1 1 43  7  12 o 0 19.3    10.8  ?     ?   155.09    -131.1       1.36533    48.8996      143.681    48.8996      
1 1 1 43  7  13 o 0 106.9   14    ?     ?   219.574   129.456      241.73     129.456      39.1534    129.456      
1 1 1 43  7  14 o 0 33.2    13.7  ?     ?   99.0553   83.7798      95.4319    83.7798      3.39697    -96.2202     
1 1 1 43  7  15 o 0 4.6     18    ?     ?   23.6719   123.257      5.40747    123.257      18.1104    -56.7431     
1 1 1 43  7  16 o 0 66.2    17.7  ?     ?   134.309   117.259      201.599    117.259      67.7902    117.259      
1 1 1 43  7  17 f 1 94.6    18.8  ?     ?   304.962   104.871      145.329    104.871      142.149    -75.129      
1 1 1 43  7  18 o 0 -23.4   22.9  ?     ?   100.711   79.601       4.52826    -100.399     97.2322    -100.399     
1 1 1 43  7  19 o 0 39.3    28.4  ?     ?   223.72    56.5794      36.8444    56.5794      168.321    -123.421     
1 1 1 -43 9  18 < 0 74.6    5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 9  17 o 0 1       4.7   ?     ?   70.7721   122.933      25.0777    -57.0665     83.7467    -57.0665     
1 1 1 -43 9  16 o 0 66.8    4.4   ?     ?   143.087   -162.007     198.241    -162.007     77.1933    -162.007     
1 1 1 -43 9  15 o 0 32.8    3.5   ?     ?   145.445   10.045       86.0849    10.045       40.7066    -169.955     
1 1 1 -43 9  14 o 0 20.7    3.3   ?     ?   136.055   24.4781      39.4675    24.4781      80.1496    -155.522     
1 1 1 -43 9  13 o 0 39.2    2.7   ?     ?   51.6772   -133.762     117.178    -133.762     69.7824    -133.762     
1 1 1 -43 9  12 o 0 94.6    3.6   ?     ?   134.923   -101.223     265.708    -101.223     141.951    -101.223     
1 1 1 -43 9  11 o 0 18.5    1.9   ?     ?   71.6847   -97.9036     29.1264    -97.9036     31.8783    82.0964      
1 1 1 -43 9  10 o 0 14      5.2   ?     ?   89.6257   -52.419      3.44211    -52.419      73.341     127.581      
1 1 1 -43 9  9  o 0 109.5   6.7   ?     ?   194.411   -69.8472     249.898    -69.8472     83.7612    -69.8472     
1 1 1 -43 9  8  o 0 77.5    5.9   ?     ?   195.743   -153.397     177.922    -153.397     9.67888    -153.397     
1 1 1 -43 9  7  o 0 106.5   8.2   ?     ?   234.161   113.314      217.699    113.314      16.1208    113.314      
1 1 1 -43 9  6  o 0 14.8    4.9   ?     ?   36.0075   -90.5915     3.53795    -90.5915     27.6112    89.4085      
1 1 1 -43 9  5  o 0 334.2   12.8  ?     ?   395.131   -92.6585     443.782    -92.6585     100.44     -92.6585     
1 1 1 -43 9  4  o 0 417.3   14.7  ?     ?   462.29    -52.7954     472.525    -52.7954     58.9084    -52.7954     
1 1 1 -43 9  3  o 0 28.5    5.7   ?     ?   51.909    -170.576     40.3168    -170.576     6.29433    9.42449      
1 1 1 -43 9  2  o 0 6.1     6     ?     ?   112.573   11.9686      56.4812    -168.031     157.887    -168.031     
1 1 1 -43 9  1  o 0 79.3    3.5   ?     ?   246.752   -88.0654     141.971    -88.0654     80.9204    91.9346      
1 1 1 43  9  0  o 0 278.3   7     ?     ?   407.887   -112.959     364.001    -112.959     10.97      67.0408      
1 1 1 43  9  1  o 0 274     7.1   ?     ?   317.917   -91.024      435.695    -91.024      143.049    -91.024      
1 1 1 43  9  2  o 0 100.5   4.9   ?     ?   276.792   -72.9504     172.051    -72.9504     82.9818    107.05       
1 1 1 43  9  3  o 0 218.5   6.8   ?     ?   262.357   12.8893      401.125    12.8893      159.252    12.8893      
1 1 1 43  9  4  o 0 9.9     5.1   ?     ?   79.18     129.6        27.0985    -50.3996     100.111    -50.3996     
1 1 1 43  9  5  o 0 46.1    6.3   ?     ?   94.8321   -127.027     131.945    -127.027     46.6932    -127.027     
1 1 1 43  9  6  o 0 17.4    7.9   ?     ?   192.003   -40.2196     33.0044    139.78       205.506    139.78       
1 1 1 43  9  7  o 0 83.6    7.8   ?     ?   193.91    177.801      202.046    177.801      28.0078    177.801      
1 1 1 43  9  8  o 0 23.2    7.7   ?     ?   169.692   153.801      12.7226    153.801      139.934    -26.1993     
1 1 1 43  9  9  o 0 133     10.6  ?     ?   243.572   106.807      273.707    106.807      54.9959    106.807      
1 1 1 43  9  10 o 0 59.4    11.7  ?     ?   138.85    32.3879      170.855    32.3879      45.3745    32.3879      
1 1 1 43  9  11 o 0 42.4    13.5  ?     ?   204.81    108.161      71.7055    108.161      128.664    -71.8391     
1 1 1 43  9  12 o 0 128.1   16.3  ?     ?   184.056   152.099      316.574    152.099      137.083    152.099      
1 1 1 43  9  13 o 0 70.7    15.9  ?     ?   69.0854   45.9387      233.883    45.9387      166.252    45.9387      
1 1 1 43  9  14 o 0 88.7    19    ?     ?   65.9021   118.211      284.016    118.211      221.927    118.211      
1 1 1 43  9  15 o 0 161.5   22.4  ?     ?   289.322   43.4571      296.876    43.4571      31.1823    43.4571      
1 1 1 43  9  16 o 0 34.1    22.6  ?     ?   206.84    3.84226      36.7915    3.84226      149.752    -176.158     
1 1 1 43  9  17 o 0 27.9    26.7  ?     ?   67.0672   0.320831     108.958    0.320831     48.6622    0.320831     
1 1 1 -43 11 16 < 0 8.4     4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 11 15 < 0 34.9    4.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 11 14 o 0 7       3.6   ?     ?   44.0633   45.5026      4.58924    45.5026      31.3492    -134.497     
1 1 1 -43 11 13 o 0 29.3    3.2   ?     ?   123.835   133.114      94.1719    133.114      7.44115    -46.8862     
1 1 1 -43 11 12 o 0 55      3     ?     ?   168.659   142.026      147.923    142.026      6.60071    142.026      
1 1 1 -43 11 11 o 0 84.3    3.6   ?     ?   251.414   119.03       157.8      119.03       58.9402    -60.9703     
1 1 1 -43 11 10 o 0 69.2    6.7   ?     ?   264.211   167.869      110.139    167.869      119.212    -12.1315     
1 1 1 -43 11 9  o 0 4.8     6.4   ?     ?   16.4547   -161.527     4.71684    18.4732      19.5938    18.4732      
1 1 1 -43 11 8  o 0 63.1    6.4   ?     ?   199.633   -107.606     139.843    -107.606     41.7334    72.3942      
1 1 1 -43 11 7  o 0 121     7.5   ?     ?   274.676   -40.7604     213.093    -40.7604     36.2553    139.24       
1 1 1 -43 11 6  o 0 14.5    6     ?     ?   142.014   15.6095      11.9742    -164.391     141.551    -164.391     
1 1 1 -43 11 5  o 0 226.2   10.4  ?     ?   303.123   -52.4637     377.264    -52.4637     108.906    -52.4637     
1 1 1 -43 11 4  o 0 33.7    6.7   ?     ?   106.026   -40.6944     89.9938    -40.6944     0.0836231  -40.6944     
1 1 1 -43 11 3  o 0 20.2    8.6   ?     ?   111.931   2.22338      25.9772    2.22338      69.299     -177.777     
1 1 1 -43 11 2  o 0 95.2    4.7   ?     ?   249.72    -48.499      179.968    -48.499      33.3036    131.501      
1 1 1 -43 11 1  o 0 372.5   8.3   ?     ?   417.801   -1.00787     456.077    -1.00787     98.2181    -1.00787     
1 1 1 43  11 0  o 0 500.6   10.8  ?     ?   508.819   1.56275      524.521    1.56275      78.3163    1.56275      
1 1 1 43  11 1  o 0 20.1    4.3   ?     ?   174.44    90.3685      3.87366    90.3685      149.265    -89.6315     
1 1 1 43  11 2  o 0 126.3   5.9   ?     ?   204.056   115.189      284.673    115.189      105.411    115.189      
1 1 1 43  11 3  o 0 94.8    5.9   ?     ?   243.92    169.942      188.396    169.942      25.9508    -10.0583     
1 1 1 43  11 4  o 0 55.3    6     ?     ?   190.14    -129.887     131.935    -129.887     43.2224    50.1131      
1 1 1 43  11 5  o 0 38      7.4   ?     ?   274.872   -62.3983     0.739201   117.602      262.789    117.602      
1 1 1 43  11 6  o 0 24.8    9     ?     ?   129.711   106.681      47.368     106.681      76.1794    -73.319      
1 1 1 43  11 7  o 0 -1.1    10.4  ?     ?   116.411   -74.3391     51.1317    105.661      161.864    105.661      
1 1 1 43  11 8  o 0 34.9    10.5  ?     ?   156.233   -71.1739     82.7059    -71.1739     66.7582    108.826      
1 1 1 43  11 9  o 0 109.9   11.6  ?     ?   180.804   -48.5579     275.887    -48.5579     103.295    -48.5579     
1 1 1 43  11 10 o 0 77      15.5  ?     ?   97.7198   107.002      250.785    107.002      160.881    107.002      
1 1 1 43  11 11 o 0 293.3   17.1  ?     ?   287.155   78.2749      501.84     78.2749      243.95     78.2749      
1 1 1 43  11 12 o 0 1.7     14    ?     ?   89.2845   146.067      3.90556    146.067      74.9578    -33.9329     
1 1 1 43  11 13 o 0 98.2    19.5  ?     ?   159.446   -138.258     269.124    -138.258     128.842    -138.258     
1 1 1 43  11 14 o 0 31.9    19.2  ?     ?   68.4667   152.928      115.883    152.928      55.7747    152.928      
1 1 1 43  11 15 < 0 9.4     28    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 13 11 < 0 39.2    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 13 10 < 0 39.4    4.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -43 13 9  o 0 70.2    4     ?     ?   217.861   152.875      156.821    152.875      18.46      -27.1246     
1 1 1 -43 13 8  f 1 87.5    9.9   ?     ?   256.243   129.67       165.334    129.67       43.1762    -50.3304     
1 1 1 -43 13 7  o 0 37.6    7.3   ?     ?   135.855   114.457      114.498    114.457      4.13072    114.457      
1 1 1 -43 13 6  f 1 182.7   11.7  ?     ?   269.87    86.1179      329.44     86.1179      107.906    86.1179      
1 1 1 -43 13 5  o 0 82.4    4.9   ?     ?   225.891   144.139      175.784    144.139      12.042     -35.8609     
1 1 1 -43 13 4  o 0 115.3   5.1   ?     ?   179.273   137.63       281.069    137.63       131.351    137.63       
1 1 1 -43 13 3  o 0 -0.2    2.9   ?     ?   69.9564   88.1806      44.991     -91.8194     103.644    -91.8194     
1 1 1 -43 13 2  o 0 85.4    4.5   ?     ?   154.355   -31.9474     236.034    -31.9474     106.165    -31.9474     
1 1 1 -43 13 1  o 0 36.9    4.5   ?     ?   181.768   -105.759     81.3463    -105.759     72.0539    74.2408      
1 1 1 43  13 0  o 0 -2.4    4.7   ?     ?   16.0511   -101.743     9.62092    78.2569      23.5789    78.2569      
1 1 1 43  13 1  o 0 28.3    5.6   ?     ?   8.37967   39.4717      18.7495    39.4717      11.4566    39.4717      
1 1 1 43  13 2  o 0 17.5    6.2   ?     ?   142.885   -178.841     19.7609    -178.841     104.647    1.15852      
1 1 1 43  13 3  o 0 98.7    8.3   ?     ?   298.445   111.963      162.399    111.963      97.46      -68.0365     
1 1 1 43  13 4  o 0 25.6    9.5   ?     ?   118.256   11.6317      68.3088    11.6317      34.6182    -168.368     
1 1 1 43  13 5  o 0 18.3    9.3   ?     ?   179.609   -93.7901     1.56881    -93.7901     152.598    86.2099      
1 1 1 43  13 6  f 1 28.4    9.4   ?     ?   177.39    -113.204     49.5585    -113.204     103.3      66.7956      
1 1 1 43  13 7  o 0 122.6   13.6  ?     ?   187.716   2.31136      300.436    2.31136      139.77     2.31136      
1 1 1 43  13 8  f 1 59.6    13.5  ?     ?   172.334   50.5134      162.792    50.5134      14.5084    50.5134      
1 1 1 43  13 9  o 0 27.4    16    ?     ?   37.566    59.6731      81.7717    59.6731      49.6938    59.6731      
1 1 1 43  13 10 < 0 38.3    19.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 43  13 11 < 0 -9      23.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 0  23 < 0 1.9     7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 0  22 o 0 6.7     6.5   ?     ?   55.1856   180          18.5131    180          29.2191    4.44577e-15  
1 1 1 -44 0  21 o 0 354.6   12.8  ?     ?   470.471   180          421.509    180          5.87058    180          
1 1 1 -44 0  20 f 1 62      6.5   ?     ?   197.815   180          177.114    180          4.06127    3.06002e-13  
1 1 1 -44 0  19 o 0 -2.3    4.6   ?     ?   22.5731   0            1.34772    0            20.1387    180          
1 1 1 -44 0  18 o 0 -2.4    4.2   ?     ?   10.1137   0            0.476615   0            9.16442    180          
1 1 1 -44 0  17 o 0 301.2   10.4  ?     ?   372.258   180          384.803    180          55.1102    180          
1 1 1 -44 0  16 o 0 70.1    5.1   ?     ?   296.346   180          186.725    180          75.5618    1.73394e-14  
1 1 1 -44 0  15 o 0 103.4   5.6   ?     ?   294.357   180          228.89     180          32.6408    4.92039e-14  
1 1 1 -44 0  14 o 0 699.8   18.8  ?     ?   463.439   180          600.16     180          174.852    180          
1 1 1 -44 0  13 o 0 14.3    3.1   ?     ?   110.359   180          38.4636    180          65.2311    4.13742e-15  
1 1 1 -44 0  12 o 0 1.8     2.9   ?     ?   43.915    180          1.79992    180          39.7239    3.17933e-16  
1 1 1 -44 0  11 o 0 123.8   6.1   ?     ?   190.294   180          247.805    180          63.5964    180          
1 1 1 -44 0  10 o 0 254.5   7.6   ?     ?   222.043   180          370.135    180          154.014    180          
1 1 1 -44 0  9  o 0 105.9   6.2   ?     ?   301.697   180          208.764    180          52.6329    2.78312e-14  
1 1 1 -44 0  8  o 0 930.3   24.5  ?     ?   708.692   0            636.396    0            19.4824    0            
1 1 1 -44 0  7  o 0 125.5   6.9   ?     ?   338.473   0            228.49     0            64.859     180          
1 1 1 -44 0  6  f 1 387     15.8  ?     ?   80.7614   0            298.686    0            228.051    0            
1 1 1 -44 0  5  o 0 114.7   6.5   ?     ?   243.853   180          204.162    180          8.80063    1.62778e-13  
1 1 1 -44 0  4  o 0 620.8   17.2  ?     ?   283.48    0            527.689    0            279.288    0            
1 1 1 -44 0  3  f 1 27.4    3.1   ?     ?   99.8412   0            28.4948    0            61.5864    180          
1 1 1 -44 0  2  o 0 1053.5  27.9  ?     ?   392.055   0            691.783    0            338.889    0            
1 1 1 -44 0  1  o 0 43.2    5.2   ?     ?   15.4968   180          7.11652    180          6.86707    7.27159e-15  
1 1 1 44  0  0  o 0 1065.5  28.3  ?     ?   1039.36   -5.5863e-14  698.984    0            240.96     180          
1 1 1 44  0  1  o 0 0.2     3.8   ?     ?   85.7253   0            1.21349    0            76.461     180          
1 1 1 44  0  2  o 0 155.9   7.2   ?     ?   389.596   0            264.248    0            89.3357    180          
1 1 1 44  0  3  f 1 67.1    5.3   ?     ?   42.3474   180          34.5041    180          3.37179    7.18031e-14  
1 1 1 44  0  4  o 0 25.3    6.4   ?     ?   108.24    180          30.8415    180          65.5702    3.30037e-15  
1 1 1 44  0  5  o 0 240     10.8  ?     ?   804.241   0            333.776    0            383.051    180          
1 1 1 44  0  6  f 1 -1.5    7.4   ?     ?   83.6714   0            2.24032    0            72.7424    180          
1 1 1 44  0  7  o 0 160.6   11.4  ?     ?   453.945   180          272.537    180          135.697    1.40926e-14  
1 1 1 44  0  8  o 0 27.6    9.3   ?     ?   5.49047   0            2.07458    0            2.86064    180          
1 1 1 44  0  9  o 0 349.1   14.9  ?     ?   407.816   0            401.959    0            35.7117    0            
1 1 1 44  0  10 o 0 109.7   13.8  ?     ?   12.9853   0            31.7775    0            18.6275    0            
1 1 1 44  0  11 o 0 347.3   17.3  ?     ?   273.483   180          449.516    180          173.05     180          
1 1 1 44  0  12 o 0 780     26.5  ?     ?   617.818   180          672.458    180          60.1432    180          
1 1 1 44  0  13 o 0 563.7   24.5  ?     ?   334.689   180          569.749    180          244.436    180          
1 1 1 44  0  14 o 0 225.9   18.9  ?     ?   291.441   180          358.44     180          76.0289    180          
1 1 1 44  0  15 o 0 503.7   26.3  ?     ?   527.852   0            534.348    0            37.3241    0            
1 1 1 44  0  16 o 0 -7.3    23.9  ?     ?   30.3451   180          7.3236     180          21.2445    2.41886e-15  
1 1 1 44  0  17 o 0 121.1   26.5  ?     ?   180.034   180          250.656    180          80.4214    180          
1 1 1 44  0  18 o 0 -7      22.6  ?     ?   70.8687   180          20.1871    180          52.2095    2.71305e-15  
1 1 1 44  0  19 o 0 167.8   38.4  ?     ?   445.157   180          301.067    180          154.733    1.36526e-14  
1 1 1 44  0  20 f 1 93.6    38.2  ?     ?   231.271   180          196.632    180          27.3231    5.0496e-14   
1 1 1 -44 2  23 < 0 107.5   6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 2  22 o 0 39.1    4.6   ?     ?   125.898   138.467      140.566    138.467      32.6324    138.467      
1 1 1 -44 2  21 o 0 23.1    3.7   ?     ?   53.9947   41.8258      80.302     41.8258      33.6234    41.8258      
1 1 1 -44 2  20 o 0 95.6    5.1   ?     ?   165.368   0.869249     259.182    0.869249     109.738    0.869249     
1 1 1 -44 2  19 o 0 528.1   13.1  ?     ?   458.961   67.4393      596.811    67.4393      163.408    67.4393      
1 1 1 -44 2  18 o 0 81.9    3.8   ?     ?   232.809   118.08       169.301    118.08       50.9338    -61.9203     
1 1 1 -44 2  17 o 0 70.1    3.5   ?     ?   252.422   -68.4685     122.176    -68.4685     99.7422    111.531      
1 1 1 -44 2  16 o 0 91.4    3.6   ?     ?   255.881   61.9277      172.385    61.9277      52.4899    -118.072     
1 1 1 -44 2  15 o 0 28.4    2.5   ?     ?   129.675   60.1779      58.8539    60.1779      55.5801    -119.822     
1 1 1 -44 2  14 o 0 188     4.9   ?     ?   266.17    70.3901      345.536    70.3901      102.851    70.3901      
1 1 1 -44 2  13 o 0 410.8   9.1   ?     ?   369.773   -70.9334     559.418    -70.9334     219.902    -70.9334     
1 1 1 -44 2  12 o 0 91.8    3.7   ?     ?   138.321   -89.0714     230.202    -89.0714     100.19     -89.0714     
1 1 1 -44 2  11 o 0 27      2.4   ?     ?   124.853   -20.9701     3.94829    -20.9701     116.224    159.03       
1 1 1 -44 2  10 o 0 272     7     ?     ?   324.216   -123.331     410.387    -123.331     96.5382    -123.331     
1 1 1 -44 2  9  o 0 113.2   3.3   ?     ?   315.652   -128.463     119.399    -128.463     152.66     51.5372      
1 1 1 -44 2  8  o 0 169.5   4.7   ?     ?   253.307   -121.451     260.761    -121.451     41.3634    -121.451     
1 1 1 -44 2  7  o 0 388.2   8.1   ?     ?   358.676   15.8628      468.804    15.8628      156.735    15.8628      
1 1 1 -44 2  6  o 0 146.8   3.8   ?     ?   425.363   157.095      93.9789    157.095      274.425    -22.9051     
1 1 1 -44 2  5  o 0 446.5   9     ?     ?   597.93    -99.36       337.668    -99.36       182.167    80.64        
1 1 1 -44 2  4  o 0 272.2   5.9   ?     ?   234.349   -57.128      406.971    -57.128      202.523    -57.128      
1 1 1 -44 2  3  o 0 150.9   4.1   ?     ?   220.574   95.1643      231.901    95.1643      38.8652    95.1643      
1 1 1 -44 2  2  o 0 281.2   6.5   ?     ?   524.521   29.284       215.382    29.284       244.954    -150.716     
1 1 1 -44 2  1  o 0 61.4    3.1   ?     ?   92.2864   -50.0031     46.0564    -50.0031     35.1413    129.997      
1 1 1 44  2  0  o 0 138.5   4.2   ?     ?   335.203   125.32       146.885    125.32       149.268    -54.6797     
1 1 1 44  2  1  o 0 13.9    2.9   ?     ?   256.475   -143.619     150.726    36.3809      377.752    36.3809      
1 1 1 44  2  2  o 0 1138.6  23.6  ?     ?   893.984   10.6997      633.307    10.6997      159.295    -169.3       
1 1 1 44  2  3  o 0 38.1    4.2   ?     ?   251.051   -10.0114     48.9601    169.989      271.83     169.989      
1 1 1 44  2  4  o 0 228.1   6.8   ?     ?   275.643   -29.6561     331.292    -29.6561     86.3551    -29.6561     
1 1 1 44  2  5  o 0 636.5   14.2  ?     ?   450.248   -61.8472     642.129    -61.8472     241.788    -61.8472     
1 1 1 44  2  6  o 0 146.4   6.2   ?     ?   351.328   -132.691     150.805    -132.691     161.659    47.3095      
1 1 1 44  2  7  o 0 215.4   7.9   ?     ?   226.739   27.5219      357.737    27.5219      154.342    27.5219      
1 1 1 44  2  8  o 0 310.3   9.9   ?     ?   249.005   -126.692     471.405    -126.692     248.157    -126.692     
1 1 1 44  2  9  o 0 161.7   10.2  ?     ?   183.8     -30.3963     352.802    -30.3963     166.918    -30.3963     
1 1 1 44  2  10 o 0 181.3   9.3   ?     ?   381.997   -33.7846     229.277    -33.7846     156.512    146.215      
1 1 1 44  2  11 o 0 275.8   13.4  ?     ?   353.598   -32.2546     419.97     -32.2546     69.7389    -32.2546     
1 1 1 44  2  12 o 0 71.8    9.8   ?     ?   221.185   109.834      138.508    109.834      80.0719    -70.1663     
1 1 1 44  2  13 o 0 282.2   12.7  ?     ?   349.964   69.1379      440.776    69.1379      101.638    69.1379      
1 1 1 44  2  14 o 0 2.8     12    ?     ?   68.7549   85.6178      21.5986    -94.3822     86.3618    -94.3822     
1 1 1 44  2  15 o 0 64.2    15.4  ?     ?   148.984   -85.7475     181.28     -85.7475     40.9267    -85.7475     
1 1 1 44  2  16 o 0 227.4   18.4  ?     ?   382.607   -129.962     332.409    -129.962     26.5732    50.0376      
1 1 1 44  2  17 o 0 139.8   19.3  ?     ?   339.902   -148.638     221.046    -148.638     114.72     31.3615      
1 1 1 44  2  18 o 0 18.3    15.9  ?     ?   105.406   -82.7943     39.7414    -82.7943     68.3452    97.2057      
1 1 1 44  2  19 o 0 -23.2   16.5  ?     ?   60.932    -146.186     23.1627    33.8138      83.2187    33.8138      
1 1 1 44  2  20 o 0 63.7    28.5  ?     ?   209.56    -116.393     119.291    -116.393     81.7895    63.6073      
1 1 1 44  2  21 o 0 9.8     31.2  ?     ?   76.2622   -7.53097     75.1116    -7.53097     3.33201    -7.53097     
1 1 1 44  2  22 < 0 44.9    28.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 4  22 < 0 -2.5    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 4  21 f 1 11.1    5.3   ?     ?   18.8297   176.804      13.9232    176.804      2.20951    -3.19635     
1 1 1 -44 4  20 o 0 41.9    4.9   ?     ?   86.4124   160.535      151.838    160.535      76.5913    160.535      
1 1 1 -44 4  19 o 0 170.3   6.2   ?     ?   246.968   171.112      341.016    171.112      119.168    171.112      
1 1 1 -44 4  18 o 0 126.7   5     ?     ?   247.852   48.2546      254.53     48.2546      21.9125    48.2546      
1 1 1 -44 4  17 o 0 45.6    3.4   ?     ?   278.095   78.2349      24.9915    78.2349      236.44     -101.765     
1 1 1 -44 4  16 f 1 39.5    3     ?     ?   155.725   153.774      96.1294    153.774      40.6035    -26.2256     
1 1 1 -44 4  15 o 0 17.6    2.6   ?     ?   40.5766   -113.32      14.3135    -113.32      21.1141    66.6803      
1 1 1 -44 4  14 o 0 127.6   4.1   ?     ?   283.58    174.848      228.392    174.848      20.1982    -5.15216     
1 1 1 -44 4  13 o 0 75.1    2.9   ?     ?   146.999   157.332      196.483    157.332      63.3608    157.332      
1 1 1 -44 4  12 o 0 122.6   3.6   ?     ?   260.248   -81.5253     231.032    -81.5253     6.27245    98.4747      
1 1 1 -44 4  11 o 0 176.2   4.4   ?     ?   259.493   -173.309     322.839    -173.309     80.6492    -173.309     
1 1 1 -44 4  10 o 0 59.5    2.4   ?     ?   264.168   40.643       65.8354    40.643       182.202    -139.357     
1 1 1 -44 4  9  o 0 39.8    2.2   ?     ?   201.663   -173.421     24.4815    -173.421     169.311    6.57859      
1 1 1 -44 4  8  o 0 22.3    1.9   ?     ?   45.6724   -17.6265     0.74282    162.374      44.86      162.374      
1 1 1 -44 4  7  o 0 54.3    2.3   ?     ?   224.578   -67.5829     35.697     -67.5829     157.347    112.417      
1 1 1 -44 4  6  o 0 4.4     1.5   ?     ?   195.784   158.202      145.078    -21.7978     314.107    -21.7978     
1 1 1 -44 4  5  o 0 243.3   5.8   ?     ?   541.442   -58.6        152.046    -58.6        317.277    121.4        
1 1 1 -44 4  4  o 0 338.7   7.4   ?     ?   286.627   -134.508     466.288    -134.508     216.939    -134.508     
1 1 1 -44 4  3  o 0 235.5   5.5   ?     ?   325.062   88.7725      301.727    88.7725      20.4801    88.7725      
1 1 1 -44 4  2  o 0 92.7    3.3   ?     ?   254.5     173.874      100.15     173.874      120.689    -6.12596     
1 1 1 -44 4  1  o 0 79.4    3.3   ?     ?   116.225   -93.8007     89.2719    -93.8007     11.8408    86.1993      
1 1 1 44  4  0  o 0 579.9   12.6  ?     ?   586.869   104.538      474.25     104.538      39.8046    -75.4624     
1 1 1 44  4  1  o 0 122.5   4.7   ?     ?   484.448   178.645      4.51882    178.645      420.587    -1.35513     
1 1 1 44  4  2  o 0 128.6   5.7   ?     ?   249.599   92.7303      178.815    92.7303      40.5376    -87.2697     
1 1 1 44  4  3  o 0 61.4    4.4   ?     ?   209.597   157.665      41.1155    157.665      143.299    -22.3354     
1 1 1 44  4  4  o 0 60.2    4.4   ?     ?   240.889   63.1489      45.5425    63.1489      168.439    -116.851     
1 1 1 44  4  5  o 0 22.2    4.3   ?     ?   126.774   88.0926      33.2917    -91.9074     145.959    -91.9074     
1 1 1 44  4  6  o 0 522.1   12.7  ?     ?   524.567   56.003       478.99     56.003       12.7483    56.003       
1 1 1 44  4  7  o 0 714.5   15.6  ?     ?   527.778   -175.382     641.386    -175.382     172.428    -175.382     
1 1 1 44  4  8  o 0 59.3    6.4   ?     ?   92.2373   -86.0961     111.27     -86.0961     18.7971    -86.0961     
1 1 1 44  4  9  o 0 237.1   9.7   ?     ?   267.288   -179.115     419.679    -179.115     152.012    -179.115     
1 1 1 44  4  10 o 0 0.8     8.2   ?     ?   55.5473   35.0788      36.7095    -144.921     91.2786    -144.921     
1 1 1 44  4  11 o 0 109.2   9.9   ?     ?   237.371   32.0147      220.424    32.0147      12.2983    -147.985     
1 1 1 44  4  12 o 0 59.9    10.7  ?     ?   233.728   116.481      103.345    116.481      121.423    -63.5186     
1 1 1 44  4  13 o 0 67.3    11    ?     ?   116.847   -109.183     204.321    -109.183     95.07      -109.183     
1 1 1 44  4  14 o 0 81.4    12.6  ?     ?   343.246   -158.61      80.1863    -158.61      240.875    21.3897      
1 1 1 44  4  15 o 0 93      13.6  ?     ?   350.652   -148.424     102.504    -148.424     224.236    31.5762      
1 1 1 44  4  16 f 1 63.1    17    ?     ?   77.2881   -100.724     191.902    -100.724     119.19     -100.724     
1 1 1 44  4  17 o 0 49.2    21.7  ?     ?   109.782   62.7797      145.541    62.7797      34.5214    62.7797      
1 1 1 44  4  18 o 0 -33.5   22.8  ?     ?   83.8101   -74.8448     20.1553    105.155      102.249    105.155      
1 1 1 44  4  19 o 0 68.3    24.3  ?     ?   72.0398   -121.426     222.23     -121.426     153.519    -121.426     
1 1 1 44  4  20 o 0 32.2    25.9  ?     ?   98.1607   -82.0984     107.752    -82.0984     15.8968    -82.0984     
1 1 1 44  4  21 f 1 0.3     27.2  ?     ?   49.0041   -173.355     55.977     -173.355     10.0748    -173.355     
1 1 1 -44 6  21 < 1 151.1   6.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 6  20 o 0 174.6   7.4   ?     ?   333.48    -43.9876     279.427    -43.9876     0.992219   136.012      
1 1 1 -44 6  19 o 0 23.4    4.4   ?     ?   89.235    -108.72      84.5288    -108.72      8.8817     -108.72      
1 1 1 -44 6  18 f 1 42.3    4     ?     ?   131.823   78.367       129.765    78.367       12.3767    78.367       
1 1 1 -44 6  17 o 0 2.4     3.3   ?     ?   88.0654   -108.502     54.2484    71.4979      135.754    71.4979      
1 1 1 -44 6  16 o 0 65.4    3.7   ?     ?   32.825    -44.7633     143.382    -44.7633     112.956    -44.7633     
1 1 1 -44 6  15 o 0 18      2.8   ?     ?   74.448    172.411      28.589     172.411      38.6291    -7.58884     
1 1 1 -44 6  14 o 0 8.6     2.6   ?     ?   104.581   122.038      28.6388    -57.9618     119.436    -57.9618     
1 1 1 -44 6  13 o 0 186.6   5     ?     ?   299.093   73.0305      316.61     73.0305      57.2206    73.0305      
1 1 1 -44 6  12 o 0 122.1   3.4   ?     ?   248.03    -9.01616     243.106    -9.01616     27.2622    -9.01616     
1 1 1 -44 6  11 o 0 13.9    1.7   ?     ?   42.3125   -30.5601     1.46358    149.44       39.4807    149.44       
1 1 1 -44 6  10 o 0 25.3    1.7   ?     ?   133.842   75.4517      33.3996    75.4517      87.6159    -104.548     
1 1 1 -44 6  9  o 0 165.4   3.8   ?     ?   262.525   6.73258      298.971    6.73258      56.1519    6.73258      
1 1 1 -44 6  8  f 1 66.4    2.4   ?     ?   327.813   -49.0874     32.3194    -49.0874     274.106    130.913      
1 1 1 -44 6  7  o 0 99.5    7.6   ?     ?   450.662   -22.2597     10.2558    -22.2597     410.955    157.74       
1 1 1 -44 6  6  o 0 109.9   5.2   ?     ?   276.363   0.784693     168.241    0.784693     95.864     -179.215     
1 1 1 -44 6  5  o 0 586.5   24.1  ?     ?   439.588   35.533       659.003    35.533       237.146    35.533       
1 1 1 -44 6  4  o 0 170.3   6.7   ?     ?   170.513   124.363      358.693    124.363      194.435    124.363      
1 1 1 -44 6  3  o 0 363.3   8.7   ?     ?   236.089   -115.594     598.733    -115.594     370.529    -115.594     
1 1 1 -44 6  2  o 0 260.2   6.3   ?     ?   344.004   -77.7221     326.02     -77.7221     30.632     -77.7221     
1 1 1 -44 6  1  o 0 158.4   5.2   ?     ?   310.19    5.9505       203.997    5.9505       63.0634    -174.049     
1 1 1 44  6  0  o 0 47.4    2.7   ?     ?   249.741   89.6284      2.0521     89.6284      215.26     -90.3716     
1 1 1 44  6  1  o 0 234.5   6     ?     ?   372.209   8.73715      275.516    8.73715      48.8956    -171.263     
1 1 1 44  6  2  o 0 157.4   5     ?     ?   280.576   136.304      267.916    136.304      8.56456    -43.6956     
1 1 1 44  6  3  o 0 285.7   7.2   ?     ?   255.921   -4.80536     493.897    -4.80536     241.465    -4.80536     
1 1 1 44  6  4  o 0 380.3   9.6   ?     ?   326.379   -27.402      558.575    -27.402      236.445    -27.402      
1 1 1 44  6  5  o 0 94.1    5.1   ?     ?   237.368   -124.495     166.243    -124.495     68.0928    55.5053      
1 1 1 44  6  6  o 0 378.9   12    ?     ?   449.379   -44.3564     446.074    -44.3564     2.49599    -44.3564     
1 1 1 44  6  7  o 0 57.1    6.3   ?     ?   205.979   -130.796     103.47     -130.796     96.1914    49.2038      
1 1 1 44  6  8  f 1 141.3   7     ?     ?   230.139   -126.571     291.263    -126.571     67.2496    -126.571     
1 1 1 44  6  9  o 0 284     11.2  ?     ?   436.337   123.624      358.142    123.624      56.7735    -56.3762     
1 1 1 44  6  10 o 0 213.3   10.6  ?     ?   408.49    41.3947      276.794    41.3947      110.935    -138.605     
1 1 1 44  6  11 o 0 61.7    9.1   ?     ?   187.844   66.019       150.488    66.019       22.9771    -113.981     
1 1 1 44  6  12 o 0 120.2   11.7  ?     ?   211.361   112.541      278.987    112.541      84.3335    112.541      
1 1 1 44  6  13 o 0 217     13.8  ?     ?   319.45    109.917      366.715    109.917      72.3406    109.917      
1 1 1 44  6  14 o 0 320     16.5  ?     ?   392.1     92.8254      447.483    92.8254      84.3085    92.8254      
1 1 1 44  6  15 o 0 60      17.6  ?     ?   86.9096   -103.372     199.093    -103.372     112.063    -103.372     
1 1 1 44  6  16 o 0 48.6    15    ?     ?   181.764   -30.1766     114.475    -30.1766     68.0831    149.823      
1 1 1 44  6  17 o 0 78.9    19.8  ?     ?   189.929   46.4044      204.23     46.4044      20.8013    46.4044      
1 1 1 44  6  18 f 1 15.2    24.2  ?     ?   203.813   -15.7324     11.3251    164.268      204.012    164.268      
1 1 1 44  6  19 o 0 -16.6   28.2  ?     ?   155.456   -13.8139     9.0028     166.186      152.481    166.186      
1 1 1 44  6  20 < 0 -24     27.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 8  19 < 0 13.1    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 8  18 o 0 22.4    4.5   ?     ?   96.9966   -4.80265     85.6816    -4.80265     5.0434     -4.80265     
1 1 1 -44 8  17 o 0 15.5    4.7   ?     ?   75.4741   94.6629      44.6717    94.6629      18.5465    -85.3371     
1 1 1 -44 8  16 o 0 4.9     3.4   ?     ?   79.5705   -136.215     29.6196    43.7855      97.7799    43.7855      
1 1 1 -44 8  15 f 1 133.3   4.9   ?     ?   159.013   30.6173      334.944    30.6173      193.876    30.6173      
1 1 1 -44 8  14 o 0 -1.6    2.8   ?     ?   150.785   -15.0869     118.5      164.913      257.381    164.913      
1 1 1 -44 8  13 o 0 68.8    3.3   ?     ?   130.056   -171.584     205.189    -171.584     85.3457    -171.584     
1 1 1 -44 8  12 o 0 11.1    2     ?     ?   116.584   -54.1804     17.3733    125.82       117.08     125.82       
1 1 1 -44 8  11 o 0 297.9   6.7   ?     ?   421.401   0.47678      369.211    0.47678      9.42432    0.47678      
1 1 1 -44 8  10 o 0 26.5    4.6   ?     ?   202.23    33.0657      12.5603    33.0657      161.241    -146.934     
1 1 1 -44 8  9  f 1 86.7    5.4   ?     ?   111.184   -157.267     241.09     -157.267     144.817    -157.267     
1 1 1 -44 8  8  o 0 91      5.6   ?     ?   222.085   20.9936      193.908    20.9936      1.49862    20.9936      
1 1 1 -44 8  7  o 0 113.9   5.9   ?     ?   306.068   76.6835      172.027    76.6835      101.346    -103.317     
1 1 1 -44 8  6  o 0 44      4.3   ?     ?   203.125   151.707      70.1452    151.707      112.159    -28.2932     
1 1 1 -44 8  5  f 1 207.3   8.8   ?     ?   266.66    -20.4006     370.291    -20.4006     128.674    -20.4006     
1 1 1 -44 8  4  o 0 320.6   10.7  ?     ?   515.448   -34.1567     319.441    -34.1567     147.064    145.843      
1 1 1 -44 8  3  o 0 257.1   10.8  ?     ?   419.982   -52.8061     309.26     -52.8061     78.681     127.194      
1 1 1 -44 8  2  o 0 817.9   24    ?     ?   662.381   -1.66857     659.124    -1.66857     45.3424    -1.66857     
1 1 1 -44 8  1  o 0 402.3   11.8  ?     ?   450.532   -23.0492     466.405    -23.0492     47.7774    -23.0492     
1 1 1 44  8  0  f 1 163.7   4.8   ?     ?   166.135   -122.11      368.825    -122.11      211.232    -122.11      
1 1 1 44  8  1  o 0 -2.6    2.8   ?     ?   103.031   153.25       90.4342    -26.7504     187.808    -26.7504     
1 1 1 44  8  2  o 0 162.8   5.8   ?     ?   208.863   65.0007      341.419    65.0007      143.807    65.0007      
1 1 1 44  8  3  o 0 41.3    4.6   ?     ?   132.073   65.728       82.7529    65.728       42.297     -114.272     
1 1 1 44  8  4  o 0 106.3   5.6   ?     ?   161.721   86.7659      271.068    86.7659      120.45     86.7659      
1 1 1 44  8  5  f 1 97.6    6.6   ?     ?   379.777   -118.544     77.6189    -118.544     277.892    61.4558      
1 1 1 44  8  6  o 0 73.5    6.5   ?     ?   213.531   -90.1119     155.517    -90.1119     43.2623    89.8881      
1 1 1 44  8  7  o 0 -4.4    6.1   ?     ?   189.932   -82.4671     136.631    97.5329      308.897    97.5329      
1 1 1 44  8  8  o 0 49.8    7.5   ?     ?   134.967   -169.716     139.476    -169.716     17.2164    -169.716     
1 1 1 44  8  9  f 1 41.9    8.6   ?     ?   110.208   -178.116     119.186    -178.116     18.6327    -178.116     
1 1 1 44  8  10 o 0 -4.7    9     ?     ?   41.8429   -145.158     23.6432    34.8423      61.5451    34.8423      
1 1 1 44  8  11 o 0 53.5    11.9  ?     ?   123.742   157.482      160.618    157.482      47.8378    157.482      
1 1 1 44  8  12 o 0 311.7   15.5  ?     ?   391.054   -153.229     439.137    -153.229     53.3986    -153.229     
1 1 1 44  8  13 o 0 24.2    15.4  ?     ?   32.7602   -34.7776     34.9379    -34.7776     2.73424    -34.7776     
1 1 1 44  8  14 o 0 149.5   17.9  ?     ?   211.786   -14.7599     338.431    -14.7599     129.494    -14.7599     
1 1 1 44  8  15 f 1 62.7    19.8  ?     ?   257.74    17.892       89.7256    17.892       156.182    -162.108     
1 1 1 44  8  16 o 0 -15.2   21.3  ?     ?   30.9992   9.9467       3.7786     9.9467       24.8955    -170.053     
1 1 1 44  8  17 o 0 75.8    20    ?     ?   165.541   117.039      213.335    117.039      62.9916    117.039      
1 1 1 44  8  18 < 0 -15.1   24.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 10 17 < 0 8.6     4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 10 16 < 1 4.6     3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 10 15 o 0 128.2   5     ?     ?   280.909   40.1737      235.783    40.1737      4.87131    40.1737      
1 1 1 -44 10 14 o 0 53.7    3.6   ?     ?   190.724   -2.10429     133.717    -2.10429     24.0693    177.896      
1 1 1 -44 10 13 o 0 28.7    2.7   ?     ?   80.1533   -1.39327     98.7507    -1.39327     31.0111    -1.39327     
1 1 1 -44 10 12 o 0 35.9    2.5   ?     ?   65.7102   -39.925      116.998    -39.925      59.8417    -39.925      
1 1 1 -44 10 11 o 0 35.3    6     ?     ?   109.869   154.481      109.083    154.481      9.46327    154.481      
1 1 1 -44 10 10 o 0 56.6    7     ?     ?   177.018   -133.65      138.84     -133.65      22.7643    46.35        
1 1 1 -44 10 9  o 0 18.4    6     ?     ?   56.045    172.179      29.064     172.179      22.0443    -7.82066     
1 1 1 -44 10 8  o 0 131.1   7.5   ?     ?   285.712   -106.82      232.661    -106.82      20.4655    73.1804      
1 1 1 -44 10 7  o 0 117.3   8.2   ?     ?   325.568   116.655      165.167    116.655      111.465    -63.3453     
1 1 1 -44 10 6  o 0 50.9    6     ?     ?   179.33    -45.1519     116.481    -45.1519     36.6626    134.848      
1 1 1 -44 10 5  o 0 196.9   9.4   ?     ?   370.142   -42.5761     269.538    -42.5761     45.2517    137.424      
1 1 1 -44 10 4  o 0 421.7   17    ?     ?   369.424   -44.5344     550.532    -44.5344     235.044    -44.5344     
1 1 1 -44 10 3  o 0 604.1   26.8  ?     ?   447.756   27.9876      660.486    27.9876      276.674    27.9876      
1 1 1 -44 10 2  o 0 239.4   10.7  ?     ?   475.082   -45.1863     248.709    -45.1863     159.873    134.814      
1 1 1 -44 10 1  o 0 328.7   9     ?     ?   494.267   -73.1826     350.023    -73.1826     76.2836    106.817      
1 1 1 44  10 0  o 0 50.2    3.2   ?     ?   168.468   -18.6649     122.944    -18.6649     25.4879    161.335      
1 1 1 44  10 1  o 0 45.1    4.1   ?     ?   226.384   -32.1716     67.399     -32.1716     132.304    147.828      
1 1 1 44  10 2  o 0 129.1   5.6   ?     ?   214.427   57.9844      284.603    57.9844      95.2878    57.9844      
1 1 1 44  10 3  o 0 17      5.2   ?     ?   113.069   50.9256      10.0092    50.9256      89.8651    -129.074     
1 1 1 44  10 4  o 0 3.9     5.7   ?     ?   13.1625   -120.859     6.46619    59.1407      18.0935    59.1407      
1 1 1 44  10 5  o 0 133.2   8.6   ?     ?   267.639   -20.4168     252.446    -20.4168     14.0291    -20.4168     
1 1 1 44  10 6  o 0 -5.8    7.3   ?     ?   121.827   -159.504     77.7296    20.4959      186.176    20.4959      
1 1 1 44  10 7  o 0 71.9    9.5   ?     ?   213.647   -166.007     155.611    -166.007     34.3526    13.9934      
1 1 1 44  10 8  o 0 69.1    10.3  ?     ?   279.672   -133.436     94.4525    -133.436     175.064    46.564       
1 1 1 44  10 9  o 0 81.5    10.5  ?     ?   195.215   112.984      199.407    112.984      11.657     112.984      
1 1 1 44  10 10 o 0 30.7    13.5  ?     ?   70.0251   -157.958     88.8256    -157.958     21.1373    -157.958     
1 1 1 44  10 11 o 0 -25.9   15    ?     ?   82.8665   17.7764      39.1182    -162.224     116.301    -162.224     
1 1 1 44  10 12 o 0 3.7     17.7  ?     ?   135.632   135.089      13.9707    -44.9107     139.882    -44.9107     
1 1 1 44  10 13 o 0 104.5   20.1  ?     ?   271.219   150.122      193.093    150.122      52.5163    -29.8783     
1 1 1 44  10 14 o 0 80.1    20.6  ?     ?   169.78    163.09       215.544    163.09       64.4339    163.09       
1 1 1 44  10 15 o 0 19.4    25.8  ?     ?   73.1971   -91.9523     87.8033    -91.9523     22.81      -91.9523     
1 1 1 -44 12 13 < 1 98.5    4.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 12 12 < 0 67.2    3.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 12 11 o 0 30.8    2.5   ?     ?   126.275   -148.782     103.996    -148.782     1.72212    -148.782     
1 1 1 -44 12 10 o 0 57.1    9.1   ?     ?   187.203   -141.37      140.232    -141.37      12.1201    38.6298      
1 1 1 -44 12 9  o 0 13.6    6.5   ?     ?   15.5108   150.812      10.6459    150.812      2.06071    -29.1877     
1 1 1 -44 12 8  o 0 37.9    7.5   ?     ?   76.5863   31.4616      129.787    31.4616      65.8266    31.4616      
1 1 1 -44 12 7  o 0 42.1    7.2   ?     ?   158.789   -10.5379     112.337    -10.5379     21.0288    169.462      
1 1 1 -44 12 6  o 0 101.1   8.9   ?     ?   248.572   19.1076      196.447    19.1076      17.8911    -160.892     
1 1 1 -44 12 5  o 0 -5.7    9.4   ?     ?   92.0855   -48.2966     41.716     131.703      121.5      131.703      
1 1 1 -44 12 4  o 0 3.1     9.4   ?     ?   78.1666   -162.728     20.774     17.2716      91.1622    17.2716      
1 1 1 -44 12 3  o 0 29.9    4.2   ?     ?   105.651   -124.959     89.8045    -124.959     5.70377    55.0408      
1 1 1 -44 12 2  f 1 170.8   6.1   ?     ?   203.003   -155.626     360.435    -155.626     175.339    -155.626     
1 1 1 -44 12 1  o 0 19.3    3.8   ?     ?   134.311   28.5063      28.5142    28.5063      93.692     -151.494     
1 1 1 44  12 0  o 0 140.1   5.7   ?     ?   223.719   29.3211      300.008    29.3211      90.7529    29.3211      
1 1 1 44  12 1  o 0 47.3    5.5   ?     ?   58.3323   -96.449      152.918    -96.4491     98.3034    -96.4491     
1 1 1 44  12 2  f 1 29      6.1   ?     ?   115.945   -141.972     83.7095    -141.972     25.4679    38.0281      
1 1 1 44  12 3  o 0 9.2     6.6   ?     ?   99.4529   -95.9164     17.0962    84.0836      110.283    84.0836      
1 1 1 44  12 4  o 0 275.2   12.1  ?     ?   341.028   -94.676      420.69     -94.676      111.974    -94.676      
1 1 1 44  12 5  o 0 520.5   22.2  ?     ?   463.332   -112.978     591.646    -112.978     172.475    -112.978     
1 1 1 44  12 6  o 0 37.4    9.9   ?     ?   136.56    175.06       107.38     175.06       16.0361    -4.94041     
1 1 1 44  12 7  o 0 119.4   11.5  ?     ?   227.851   -32.837      265.359    -32.837      64.0253    -32.837      
1 1 1 44  12 8  o 0 61.1    11.9  ?     ?   142.426   22.5259      185.342    22.5259      59.727     22.5259      
1 1 1 44  12 9  o 0 40.8    13.7  ?     ?   184.881   155.424      86.8681    155.424      73.6924    -24.5757     
1 1 1 44  12 10 o 0 65.5    13.7  ?     ?   234.738   174.538      134.991    174.538      68.7667    -5.46168     
1 1 1 44  12 11 o 0 195.2   17.7  ?     ?   391.106   173.468      264.925    173.468      73.4857    -6.53245     
1 1 1 44  12 12 < 0 -15.3   20.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 14 7  < 0 38      4.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 14 6  < 0 174.8   8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 14 5  < 1 86.6    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 14 4  < 0 1.5     3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 14 3  < 0 9.6     3.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -44 14 2  o 0 7       4.3   ?     ?   29.6538   153.364      4.50897    153.364      19.357     -26.6358     
1 1 1 -44 14 1  o 0 14.3    5     ?     ?   138.584   -78.1109     17.0046    -78.1109     94.8854    101.889      
1 1 1 44  14 0  o 0 31.2    5.7   ?     ?   130.068   115.294      104.514    115.294      4.15576    -64.706      
1 1 1 44  14 1  o 0 30.9    6.2   ?     ?   98.6019   -156.765     120.652    -156.765     38.2112    -156.765     
1 1 1 44  14 2  < 0 22.8    6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 44  14 3  < 0 20.3    8.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 44  14 4  < 0 56.3    9.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 44  14 5  < 1 16.1    13.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 44  14 6  < 0 31.4    14.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 1  23 < 0 87.7    5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 1  22 o 0 86      5.1   ?     ?   174.576   153.329      239.486    153.329      89.9377    153.329      
1 1 1 -45 1  21 o 0 69.5    4.5   ?     ?   237.21    -111.884     148.26     -111.884     56.6235    68.1162      
1 1 1 -45 1  20 o 0 17      3.9   ?     ?   119.566   -22.7615     34.6227    -22.7615     71.069     157.238      
1 1 1 -45 1  19 o 0 388     9.4   ?     ?   417.737   56.6545      485.862    56.6545      91.8332    56.6545      
1 1 1 -45 1  18 o 0 106.2   4.2   ?     ?   162.848   -104.18      281.698    -104.18      127.837    -104.18      
1 1 1 -45 1  17 o 0 98.8    3.9   ?     ?   199.697   -74.8116     230.671    -74.8116     55.3425    -74.8116     
1 1 1 -45 1  16 o 0 12      2.8   ?     ?   171.875   99.4396      45.1211    -80.5604     195.95     -80.5604     
1 1 1 -45 1  15 o 0 83.2    3.6   ?     ?   244.048   58.4513      162.587    58.4513      52.443     -121.549     
1 1 1 -45 1  14 o 0 309.6   6.7   ?     ?   336.401   136.953      462.492    136.953      156.28     136.953      
1 1 1 -45 1  13 o 0 106.8   3.3   ?     ?   285.749   8.52986      178.217    8.52986      83.6924    -171.47      
1 1 1 -45 1  12 o 0 187.5   4.9   ?     ?   367.628   -65.3514     253.664    -65.3514     91.2448    114.649      
1 1 1 -45 1  11 f 1 923.3   17    ?     ?   521.98    -168.494     867.384    -168.494     363.355    -168.494     
1 1 1 -45 1  10 o 0 202.7   4.9   ?     ?   249.115   -164.071     365.486    -164.071     124.815    -164.071     
1 1 1 -45 1  9  o 0 416.2   8.8   ?     ?   510.568   119.473      373.925    119.473      65.2314    -60.527      
1 1 1 -45 1  8  o 0 505.3   11.7  ?     ?   501.78    37.2032      468.919    37.2032      35.223     37.2032      
1 1 1 -45 1  7  f 1 273.6   5.9   ?     ?   291.901   53.9162      382.942    53.9162      128.213    53.9162      
1 1 1 -45 1  6  o 0 376.2   7.8   ?     ?   461.967   -132.485     371.075    -132.485     28.1614    47.5148      
1 1 1 -45 1  5  o 0 159.8   4     ?     ?   238.021   111.286      238.088    111.286      31.6094    111.286      
1 1 1 -45 1  4  o 0 55.1    2.6   ?     ?   181.068   -129.307     31.4936    -129.307     126.123    50.693       
1 1 1 -45 1  3  o 0 213.7   6.1   ?     ?   323.297   -150.741     274.755    -150.741     7.55326    29.2593      
1 1 1 -45 1  2  o 0 322.1   7.1   ?     ?   280.518   -66.6252     445.114    -66.6252     199.465    -66.6252     
1 1 1 -45 1  1  o 0 112     4.8   ?     ?   270.185   122.885      134.994    122.885      102.208    -57.1148     
1 1 1 45  1  0  o 0 204.9   5.7   ?     ?   353.678   126.528      242.967    126.528      68.5569    -53.4722     
1 1 1 45  1  1  o 0 36.7    2.9   ?     ?   154.963   124.44       14.7931    -55.5596     151.55     -55.5596     
1 1 1 45  1  2  o 0 57.6    3.6   ?     ?   340.549   34.5719      39.2658    -145.428     340.298    -145.428     
1 1 1 45  1  3  o 0 190.3   5.8   ?     ?   388.13    -69.7294     196.538    -69.7294     147.01     110.271      
1 1 1 45  1  4  o 0 70.6    4.7   ?     ?   188.83    -46.158      71.9765    -46.158      95.3313    133.842      
1 1 1 45  1  5  o 0 168.9   6.2   ?     ?   373.431   -42.8357     173.2      -42.8358     157.886    137.164      
1 1 1 45  1  6  o 0 10.3    4.8   ?     ?   70.7906   -161.745     42.0138    18.2553      105.345    18.2553      
1 1 1 45  1  7  f 1 39      5.8   ?     ?   112.896   -162.121     20.1608    -162.121     81.3498    17.8793      
1 1 1 45  1  8  o 0 308.4   9.9   ?     ?   167.836   -71.6229     507.023    -71.6229     356.958    -71.6229     
1 1 1 45  1  9  o 0 63.2    7     ?     ?   251.952   -101.338     72.7187    -101.338     181.409    78.6616      
1 1 1 45  1  10 o 0 91.3    7.9   ?     ?   130.174   -111.583     211.776    -111.583     80.6514    -111.583     
1 1 1 45  1  11 f 1 160.3   10.4  ?     ?   353.031   178.429      228.07     178.429      122.51     -1.57078     
1 1 1 45  1  12 o 0 69.5    10.5  ?     ?   268.07    126.958      94.1583    126.958      170.108    -53.0422     
1 1 1 45  1  13 o 0 66.7    10.4  ?     ?   188.034   -60.501      158.825    -60.501      22.9652    119.499      
1 1 1 45  1  14 o 0 34.6    12.1  ?     ?   93.3949   -160.665     84.8804    -160.665     2.89526    19.3353      
1 1 1 45  1  15 o 0 174.2   18.8  ?     ?   287.133   -68.0136     325.403    -68.0136     55.4779    -68.0136     
1 1 1 45  1  16 o 0 379.5   23    ?     ?   359.055   -139.609     559.011    -139.609     219.856    -139.609     
1 1 1 45  1  17 o 0 571.4   28.9  ?     ?   508.483   -167.016     641.832    -167.016     122.724    -167.016     
1 1 1 45  1  18 o 0 136.8   24    ?     ?   289.343   -148.508     246.054    -148.508     50.1285    31.4918      
1 1 1 45  1  19 o 0 218     26.5  ?     ?   311.001   -158.535     388.111    -158.535     82.0732    -158.535     
1 1 1 45  1  20 o 0 26.3    17.2  ?     ?   130.024   112.573      65.1865    112.573      59.3943    -67.4266     
1 1 1 45  1  21 o 0 6.8     20.5  ?     ?   135.366   99.9916      23.0091    99.9916      104.52     -80.0084     
1 1 1 45  1  22 < 0 15      23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 3  22 < 0 52.7    5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 3  21 o 0 25.3    4.7   ?     ?   134.637   62.9178      80.1438    62.9178      34.9558    -117.082     
1 1 1 -45 3  20 o 0 160.4   5.7   ?     ?   324.081   73.4213      264.231    73.4213      18.7658    -106.579     
1 1 1 -45 3  19 o 0 154.6   5.3   ?     ?   244.165   84.2583      316.691    84.2583      96.7718    84.2583      
1 1 1 -45 3  18 o 0 170.3   5.5   ?     ?   256.064   61.398       329.257    61.398       88.3182    61.398       
1 1 1 -45 3  17 o 0 158.1   4.9   ?     ?   346.883   90.5975      230.256    90.5975      96.6363    -89.4025     
1 1 1 -45 3  16 o 0 7.5     2.7   ?     ?   52.5163   117.426      16.4937    -62.574      62.4754    -62.574      
1 1 1 -45 3  15 o 0 102.1   3.6   ?     ?   141.239   -135.701     272.202    -135.701     148.615    -135.701     
1 1 1 -45 3  14 o 0 43.8    2.7   ?     ?   297.49    -19.9616     8.79276    -19.9616     252.532    160.038      
1 1 1 -45 3  13 o 0 27.9    2.1   ?     ?   91.18     0.435787     51.3378    0.435787     31.3964    -179.564     
1 1 1 -45 3  12 o 0 5.4     2.4   ?     ?   112.136   92.5803      67.2401    -87.4197     169.68     -87.4197     
1 1 1 -45 3  11 o 0 11.6    2.1   ?     ?   147.193   60.4677      58.2218    -119.532     195.84     -119.532     
1 1 1 -45 3  10 o 0 392     8.2   ?     ?   490.504   -58.9508     411.284    -58.9508     58.2274    121.049      
1 1 1 -45 3  9  o 0 538.1   10.4  ?     ?   565.754   -95.6903     500.899    -95.6903     43.6224    84.3097      
1 1 1 -45 3  8  o 0 108.5   3.3   ?     ?   173.405   -112.546     234.894    -112.546     67.1465    -112.546     
1 1 1 -45 3  7  o 0 15.6    1.9   ?     ?   113.624   -89.5323     47.5172    90.4677      145.324    90.4677      
1 1 1 -45 3  6  o 0 332.7   7.2   ?     ?   416.351   104.912      361.084    104.912      1.14182    104.912      
1 1 1 -45 3  5  o 0 370.6   7.6   ?     ?   456.058   -162.92      373.341    -162.92      22.4877    17.0796      
1 1 1 -45 3  4  o 0 29.4    2.1   ?     ?   33.5023   99.6158      5.54792    -80.3842     34.477     -80.3842     
1 1 1 -45 3  3  o 0 42.3    2.3   ?     ?   300.957   92.0594      60.8815    -87.9406     321.603    -87.9406     
1 1 1 -45 3  2  o 0 651.4   13.3  ?     ?   520.722   -8.98861     584.378    -8.98861     131.957    -8.98861     
1 1 1 -45 3  1  o 0 129.6   4.6   ?     ?   288.352   -22.267      158.195    -22.267      92.984     157.733      
1 1 1 45  3  0  o 0 145.1   5.5   ?     ?   277.514   118.257      194.028    118.257      49.1011    -61.7434     
1 1 1 45  3  1  o 0 236.7   6.2   ?     ?   350.186   -134.038     290.294    -134.038     17.0777    45.9618      
1 1 1 45  3  2  o 0 307.3   8.2   ?     ?   255.96    122.657      443.19     122.657      218.171    122.657      
1 1 1 45  3  3  o 0 184.5   6.2   ?     ?   350.886   157.734      213.333    157.734      95.5221    -22.2657     
1 1 1 45  3  4  o 0 87.7    4.8   ?     ?   226.217   120.429      124.049    120.429      76.9993    -59.5709     
1 1 1 45  3  5  o 0 103.7   5.5   ?     ?   367.172   -65.7925     65.1839    -65.7925     261.321    114.208      
1 1 1 45  3  6  o 0 23      5.8   ?     ?   69.7623   172.411      14.1859    -7.58929     76.2335    -7.58929     
1 1 1 45  3  7  o 0 468.1   12.5  ?     ?   516.623   -127.406     433.938    -127.406     25.4632    52.5937      
1 1 1 45  3  8  o 0 111.8   8.1   ?     ?   207.767   17.9334      231.551    17.9334      23.0707    17.9334      
1 1 1 45  3  9  o 0 15      6.9   ?     ?   220.434   -127.231     110.511    52.7687      331.477    52.7687      
1 1 1 45  3  10 o 0 40.7    8.1   ?     ?   65.4571   -119.214     70.8957    -119.214     6.51992    -119.214     
1 1 1 45  3  11 o 0 50.2    9.7   ?     ?   56.4773   50.7095      89.1903    50.7095      33.7509    50.7095      
1 1 1 45  3  12 o 0 276.8   12.1  ?     ?   297.634   -158.712     476.501    -158.712     189.887    -158.712     
1 1 1 45  3  13 o 0 -3.3    11    ?     ?   106.878   -156.087     54.2703    23.9126      154.35     23.9126      
1 1 1 45  3  14 o 0 35.9    13.7  ?     ?   136.813   -41.0348     79.7724    -41.0348     47.9259    138.965      
1 1 1 45  3  15 o 0 66.8    14.1  ?     ?   235.079   -111.647     128.962    -111.647     90.4764    68.3528      
1 1 1 45  3  16 o 0 189.7   18.8  ?     ?   340.85    -132.756     301.798    -132.756     17.845     47.2438      
1 1 1 45  3  17 o 0 2.9     17.4  ?     ?   80.6913   176.551      0.487468   176.551      81.2835    -3.44926     
1 1 1 45  3  18 o 0 7.9     23.4  ?     ?   70.1532   26.6191      34.4462    26.6191      36.8242    -153.381     
1 1 1 45  3  19 o 0 30.6    26.3  ?     ?   139.676   -162.624     78.6025    -162.624     54.9396    17.376       
1 1 1 45  3  20 o 0 44.6    27.8  ?     ?   203.541   -29.5418     69.1801    -29.5418     121.775    150.458      
1 1 1 45  3  21 o 0 44.3    27.1  ?     ?   189.254   77.229       81.1617    77.229       95.6899    -102.771     
1 1 1 -45 5  21 < 0 9.7     5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 5  20 o 0 157.3   6.1   ?     ?   319.303   -97.0953     264.38     -97.0953     5.93805    82.9047      
1 1 1 -45 5  19 o 0 102.8   4.9   ?     ?   160.51    162.076      277.849    162.076      139.066    162.076      
1 1 1 -45 5  18 o 0 74.8    4.5   ?     ?   209.923   63.3271      172.738    63.3271      14.4555    -116.673     
1 1 1 -45 5  17 o 0 23.2    3.7   ?     ?   48.1727   105.45       56.6636    105.45       11.7937    105.45       
1 1 1 -45 5  16 o 0 38.3    3.1   ?     ?   90.686    -126.314     122.931    -126.314     38.3448    -126.314     
1 1 1 -45 5  15 o 0 11.2    2.8   ?     ?   181.13    -179.7       51.047     0.300333     207.997    0.300333     
1 1 1 -45 5  14 o 0 15.4    2.4   ?     ?   157.452   -133.815     15.8408    46.1853      152.171    46.1853      
1 1 1 -45 5  13 o 0 35.2    2.4   ?     ?   187.706   -61.9538     57.2676    -61.9538     105.87     118.046      
1 1 1 -45 5  12 f 1 1036.5  19.4  ?     ?   744.001   -48.4684     764.511    -48.4684     109.953    -48.4684     
1 1 1 -45 5  11 o 0 128.7   3.6   ?     ?   314.419   -65.8808     197.682    -65.8808     86.4271    114.119      
1 1 1 -45 5  10 o 0 160     4     ?     ?   222.404   -36.8871     330.39     -36.8871     128.176    -36.8871     
1 1 1 -45 5  9  o 0 70.2    2.5   ?     ?   80.0174   123.184      161.184    123.184      86.7665    123.184      
1 1 1 -45 5  8  o 0 4.1     1.4   ?     ?   161.649   -63.1347     118.578    116.865      269.721    116.865      
1 1 1 -45 5  7  o 0 77.6    2.5   ?     ?   244.148   -82.3167     115.097    -82.3167     118.389    97.6833      
1 1 1 -45 5  6  o 0 148.8   4     ?     ?   114.614   141.976      326.143    141.976      216.037    141.976      
1 1 1 -45 5  5  f 1 171.4   4.4   ?     ?   215.523   43.403       334.89     43.403       125.915    43.403       
1 1 1 -45 5  4  o 0 674.7   13.3  ?     ?   754.918   157.69       401.675    157.69       245.726    -22.3096     
1 1 1 -45 5  3  o 0 1320.2  24    ?     ?   881.105   -164.852     724.186    -164.852     33.9904    15.1484      
1 1 1 -45 5  2  o 0 111.2   4.6   ?     ?   162.634   -129.647     192.57     -129.647     52.2038    -129.647     
1 1 1 -45 5  1  o 0 416.5   10.6  ?     ?   460.159   102.066      416.846    102.066      18.6365    102.066      
1 1 1 45  5  0  f 1 375.3   10    ?     ?   333.672   104.486      473.89     104.486      180.993    104.486      
1 1 1 45  5  1  o 0 417.3   9.2   ?     ?   416.313   71.0945      457.221    71.0945      93.0157    71.0945      
1 1 1 45  5  2  o 0 118.2   4.5   ?     ?   315.852   33.9834      131.019    33.9834      145.694    -146.017     
1 1 1 45  5  3  o 0 228.4   6.3   ?     ?   264.165   40.6173      345.937    40.6173      114.253    40.6173      
1 1 1 45  5  4  o 0 207.5   6.6   ?     ?   237.633   -37.7969     391.426    -37.7969     155.93     -37.7969     
1 1 1 45  5  5  f 1 82.2    5.2   ?     ?   119.243   170.448      183.979    170.448      65.1556    170.448      
1 1 1 45  5  6  o 0 66.2    5.5   ?     ?   217.231   135.768      105.013    135.768      110.345    -44.232      
1 1 1 45  5  7  o 0 372.1   12.6  ?     ?   458.535   -170.669     430.901    -170.669     23.4995    9.3313       
1 1 1 45  5  8  o 0 403.2   11.7  ?     ?   517.54    -145.634     427.129    -145.634     76.3815    34.3665      
1 1 1 45  5  9  o 0 5.7     7.9   ?     ?   119.277   -158.128     68.2167    21.8717      184.118    21.8717      
1 1 1 45  5  10 o 0 96.5    9.2   ?     ?   256.663   -22.1202     184.21     -22.1202     60.6133    157.88       
1 1 1 45  5  11 o 0 81      9.8   ?     ?   171.482   -59.9549     207.291    -59.9549     44.0633    -59.9549     
1 1 1 45  5  12 f 1 44.9    8.7   ?     ?   165.063   60.7221      109.398    60.7221      44.2033    -119.278     
1 1 1 45  5  13 o 0 -2.9    11    ?     ?   146.69    -3.37866     75.9178    176.621      211.829    176.621      
1 1 1 45  5  14 o 0 56.3    16.4  ?     ?   114.222   -27.148      172.799    -27.148      66.4102    -27.148      
1 1 1 45  5  15 o 0 186.4   16.8  ?     ?   300.151   -61.7043     338.218    -61.7043     35.916     -61.7043     
1 1 1 45  5  16 o 0 73      16.6  ?     ?   209.993   -8.51787     167.804    -8.51787     44.3607    171.482      
1 1 1 45  5  17 o 0 108.7   20    ?     ?   175.534   49.168       288.091    49.168       117.527    49.168       
1 1 1 45  5  18 o 0 109.2   23.8  ?     ?   196.985   -139.135     272.092    -139.135     85.6464    -139.135     
1 1 1 45  5  19 o 0 21.5    29.3  ?     ?   167.117   174.09       43.3763    174.09       111.864    -5.91043     
1 1 1 45  5  20 o 0 84.8    28.6  ?     ?   162.719   130.306      216.378    130.306      65.7928    130.306      
1 1 1 -45 7  20 < 1 53.8    5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 7  19 o 0 71.6    5.4   ?     ?   190.711   -166.422     185.624    -166.422     26.9997    -166.422     
1 1 1 -45 7  18 o 0 50.5    4.1   ?     ?   91.6562   126.043      184.378    126.043      107.542    126.043      
1 1 1 -45 7  17 f 1 10.5    4.6   ?     ?   100.21    162.08       1.79241    -17.9196     88.1744    -17.9196     
1 1 1 -45 7  16 o 0 12.8    3.5   ?     ?   115       76.9321      5.4948     76.9321      96.1581    -103.068     
1 1 1 -45 7  15 f 1 84.8    3.6   ?     ?   193.605   -51.9504     203.101    -51.9504     23.5324    -51.9504     
1 1 1 -45 7  14 o 0 26.4    2.8   ?     ?   52.4784   -87.7578     62.759     -87.7578     14.2957    -87.7578     
1 1 1 -45 7  13 o 0 40      2.5   ?     ?   103.077   172.568      116.253    172.568      27.8742    172.568      
1 1 1 -45 7  12 o 0 37.2    2.3   ?     ?   221.602   -48.4937     42.1582    -48.4937     147.588    131.506      
1 1 1 -45 7  11 o 0 7.7     1.6   ?     ?   34.5791   -30.5477     11.0172    149.452      40.8313    149.452      
1 1 1 -45 7  10 o 0 266.1   6.6   ?     ?   437.222   113.143      321.448    113.143      56.5517    -66.8572     
1 1 1 -45 7  9  o 0 102.7   8.3   ?     ?   262.671   -57.513      190.419    -57.513      38.0494    122.487      
1 1 1 -45 7  8  o 0 451.7   16.5  ?     ?   441.849   -2.14801     527.576    -2.14801     131.232    -2.14801     
1 1 1 -45 7  7  o 0 73      6.5   ?     ?   213.265   1.81963      149.548    1.81963      42.7466    -178.18      
1 1 1 -45 7  6  o 0 178.7   7.3   ?     ?   435.25    45.6463      176.001    45.6463      225.021    -134.354     
1 1 1 -45 7  5  o 0 75.7    5     ?     ?   275.313   -29.881      100.741    -29.881      154.025    150.119      
1 1 1 -45 7  4  o 0 427.3   15    ?     ?   407.89    -111.892     530.919    -111.892     151.982    -111.892     
1 1 1 -45 7  3  o 0 335.7   10.7  ?     ?   416.554   -42.632      419.205    -42.632      30.85      -42.632      
1 1 1 -45 7  2  f 1 252.7   6.7   ?     ?   517.412   -34.8496     218.382    -34.8496     268.006    145.15       
1 1 1 -45 7  1  o 0 39.1    2.2   ?     ?   17.6999   109.172      20.9017    109.172      4.30268    109.172      
1 1 1 45  7  0  o 0 25.4    2.7   ?     ?   198.729   65.9712      13.3469    -114.029     202.273    -114.029     
1 1 1 45  7  1  o 0 49.5    3.1   ?     ?   315.388   -55.0076     6.92725    124.992      307.228    124.992      
1 1 1 45  7  2  f 1 186.8   5.4   ?     ?   176.034   15.3411      407.569    15.3411      238.888    15.3411      
1 1 1 45  7  3  o 0 610.3   12.8  ?     ?   436.898   34.2939      707.164    34.2939      290.291    34.2939      
1 1 1 45  7  4  o 0 201     6.5   ?     ?   191.892   74.1808      422.319    74.1808      239.13     74.1808      
1 1 1 45  7  5  o 0 7       4.4   ?     ?   71.5173   -118.854     41.7727    61.1462      110.056    61.1462      
1 1 1 45  7  6  o 0 376.3   12.3  ?     ?   363.921   -54.0023     535.948    -54.0023     194.38     -54.0023     
1 1 1 45  7  7  o 0 69.6    6.2   ?     ?   158.543   50.7395      181.757    50.7395      33.051     50.7395      
1 1 1 45  7  8  o 0 275.6   10.7  ?     ?   379.659   -100.4       391.451    -100.4       35.7342    -100.4       
1 1 1 45  7  9  o 0 65.4    9     ?     ?   292.744   67.147       79.49      67.147       187.563    -112.853     
1 1 1 45  7  10 o 0 65.4    9.4   ?     ?   141.615   25.9791      187.299    25.9791      57.8767    25.9791      
1 1 1 45  7  11 o 0 86.1    10.2  ?     ?   271.796   163.642      150.87     163.642      96.9354    -16.3579     
1 1 1 45  7  12 o 0 432.8   15    ?     ?   475.38    165.547      504.821    165.547      68.8339    165.547      
1 1 1 45  7  13 o 0 55.6    14.4  ?     ?   130.833   164.801      173.055    164.801      43.2248    164.801      
1 1 1 45  7  14 o 0 66.2    16.1  ?     ?   197.384   -40.1914     154.775    -40.1914     40.3725    139.809      
1 1 1 45  7  15 f 1 54.1    17.2  ?     ?   132.881   -71.1061     158.013    -71.1061     25.5219    -71.1061     
1 1 1 45  7  16 o 0 56.4    16.3  ?     ?   158.481   -104.103     155.322    -104.103     4.1027     -104.103     
1 1 1 45  7  17 f 1 27.3    22.1  ?     ?   120.378   159.39       80.613     159.39       30.4011    -20.6099     
1 1 1 45  7  18 o 0 9.7     25.4  ?     ?   116.855   72.4468      51.7347    72.4468      55.1364    -107.553     
1 1 1 45  7  19 < 0 68.9    26.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 9  18 < 0 1       5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 9  17 < 0 69.3    4.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 9  16 o 0 10.9    3.5   ?     ?   56.4801   65.0659      19.0244    65.0659      27.5489    -114.934     
1 1 1 -45 9  15 f 1 141.5   5.7   ?     ?   284.005   25.7384      252.775    25.7384      12.1125    25.7384      
1 1 1 -45 9  14 o 0 45.2    3.3   ?     ?   218.993   -72.0136     83.4042    -72.0136     102.805    107.986      
1 1 1 -45 9  13 f 1 109.9   3.7   ?     ?   188.279   -118.576     265.155    -118.576     99.476     -118.576     
1 1 1 -45 9  12 o 0 42.4    2.3   ?     ?   84.0027   -156.389     143.009    -156.389     66.3205    -156.389     
1 1 1 -45 9  11 f 1 137     7.8   ?     ?   108.166   55.0959      364.5      55.0959      265.273    55.0959      
1 1 1 -45 9  10 o 0 97.9    6.3   ?     ?   329.815   3.6          119.581    3.6          183.465    -176.4       
1 1 1 -45 9  9  o 0 62      6.1   ?     ?   122.023   -108.744     178.421    -108.744     74.4843    -108.744     
1 1 1 -45 9  8  o 0 20.7    4.9   ?     ?   188.853   54.8176      2.40442    -125.182     164.21     -125.182     
1 1 1 -45 9  7  o 0 132.5   7.1   ?     ?   320.886   66.346       201.262    66.346       72.7552    -113.654     
1 1 1 -45 9  6  o 0 68.4    5.5   ?     ?   246.139   -4.00555     118.909    -4.00555     92.326     175.994      
1 1 1 -45 9  5  o 0 45.7    5.8   ?     ?   80.3726   -28.1513     120.592    -28.1513     51.5631    -28.1513     
1 1 1 -45 9  4  o 0 608.7   19.7  ?     ?   549.915   10.7339      590.411    10.7339      116.164    10.7339      
1 1 1 -45 9  3  o 0 119.7   7.8   ?     ?   302.581   38.1647      194.273    38.1647      67.6379    -141.835     
1 1 1 -45 9  2  o 0 67.8    6.9   ?     ?   258.667   -11.2587     109.198    -11.2587     115.436    168.741      
1 1 1 -45 9  1  o 0 4.3     2.2   ?     ?   148.699   -5.73565     90.9058    174.264      220.41     174.264      
1 1 1 45  9  0  o 0 65.7    3.2   ?     ?   195.021   -117.335     153.076    -117.335     20.0457    62.6651      
1 1 1 45  9  1  o 0 76.9    4     ?     ?   127.041   14.4494      220.224    14.4494      107.296    14.4494      
1 1 1 45  9  2  o 0 198.9   6.1   ?     ?   242.15    79.6097      390.889    79.6097      175.425    79.6097      
1 1 1 45  9  3  o 0 19.2    4.7   ?     ?   157.033   79.2551      2.87348    79.2551      136.94     -100.745     
1 1 1 45  9  4  o 0 21.9    5     ?     ?   128.101   10.4171      28.9383    10.4171      85.1429    -169.583     
1 1 1 45  9  5  o 0 47.3    6.6   ?     ?   88.3759   47.6574      136.429    47.6574      57.441     47.6574      
1 1 1 45  9  6  o 0 93.1    9.3   ?     ?   267.182   34.7644      168.615    34.7644      70.0536    -145.236     
1 1 1 45  9  7  o 0 34.5    7.2   ?     ?   152.816   -157.301     75.4675    -157.301     60.9087    22.6993      
1 1 1 45  9  8  o 0 28.6    9.5   ?     ?   62.982    -137.225     63.1658    -137.225     6.5453     -137.225     
1 1 1 45  9  9  o 0 11.4    10.6  ?     ?   72.8677   -151.38      0.700836   28.6197      66.09      28.6197      
1 1 1 45  9  10 o 0 367.6   15.8  ?     ?   370.69    -106.935     523.055    -106.935     162.765    -106.935     
1 1 1 45  9  11 f 1 114.7   13.4  ?     ?   224.925   -79.3464     254.387    -79.3464     33.5913    -79.3464     
1 1 1 45  9  12 o 0 10      15.3  ?     ?   140.661   -53.8981     10.1168    126.102      147.062    126.102      
1 1 1 45  9  13 f 1 -44.4   27.8  ?     ?   131.694   5.5753       32.667     -174.425     156.76     -174.425     
1 1 1 45  9  14 o 0 -5.4    16.3  ?     ?   105.989   0.450462     14.735     -179.55      111.637    -179.55      
1 1 1 45  9  15 f 1 37.1    22.9  ?     ?   108.531   -43.8141     112.718    -43.8141     14.7171    -43.8141     
1 1 1 45  9  16 o 0 5.2     23.5  ?     ?   86.2105   112.913      52.9329    112.913      24.3118    -67.0872     
1 1 1 -45 11 15 < 0 38.8    4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 11 14 < 0 10.7    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 11 13 o 0 11.5    2.5   ?     ?   47.539    128.635      32.1028    128.635      6.513      -51.365      
1 1 1 -45 11 12 o 0 7.4     2.4   ?     ?   21.983    47.3924      1.39113    47.3924      16.5667    -132.608     
1 1 1 -45 11 11 o 0 31.1    7.6   ?     ?   115.465   -138.66      95.686     -138.66      0.595897   41.3404      
1 1 1 -45 11 10 o 0 333.4   12.5  ?     ?   382.368   -100.286     444        -100.286     122.926    -100.286     
1 1 1 -45 11 9  o 0 130.2   9     ?     ?   234.41    0.844822     266.073    0.844822     63.7332    0.844822     
1 1 1 -45 11 8  f 1 24.3    6.7   ?     ?   106.386   13.8933      66.3965    13.8933      26.4689    -166.107     
1 1 1 -45 11 7  o 0 5.2     6.6   ?     ?   97.382    -60.3509     33.1236    119.649      121.134    119.649      
1 1 1 -45 11 6  o 0 24.1    7.1   ?     ?   157.899   -98.3171     35.2381    -98.3171     108.205    81.6829      
1 1 1 -45 11 5  f 1 25.8    7     ?     ?   31.8366   -119.006     40.4881    -119.006     11.4973    -119.006     
1 1 1 -45 11 4  o 0 165.7   8.9   ?     ?   233.528   153.399      329.736    153.399      117.261    153.399      
1 1 1 -45 11 3  o 0 75.2    8.2   ?     ?   248.946   72.7777      131.971    72.7777      95.4064    -107.222     
1 1 1 -45 11 2  o 0 2.1     6.4   ?     ?   79.0808   -44.3861     38.8572    135.614      111.334    135.614      
1 1 1 -45 11 1  o 0 76.1    3.8   ?     ?   201.226   16.0956      175.081    16.0956      9.89436    -163.904     
1 1 1 45  11 0  o 0 6.4     3.3   ?     ?   115.992   53.1389      52.2972    -126.861     161.649    -126.861     
1 1 1 45  11 1  o 0 58.5    4.6   ?     ?   139.265   -150.187     174.573    -150.187     43.1325    -150.187     
1 1 1 45  11 2  o 0 111.5   5.6   ?     ?   225.194   -108.139     244.194    -108.139     31.4946    -108.139     
1 1 1 45  11 3  o 0 5.3     5.7   ?     ?   94.38     -155.016     40.4468    24.9836      129.622    24.9836      
1 1 1 45  11 4  o 0 39.2    6.4   ?     ?   73.9567   -158.09      124.079    -158.09      54.2041    -158.09      
1 1 1 45  11 5  f 1 52.2    7.5   ?     ?   76.1794   -74.074      180.281    -74.074      107.426    -74.074      
1 1 1 45  11 6  o 0 203.3   9.4   ?     ?   325.073   172.335      325.435    172.335      16.4017    172.335      
1 1 1 45  11 7  o 0 29.7    9.9   ?     ?   215.679   -93.3226     10.3205    -93.3226     194.455    86.6774      
1 1 1 45  11 8  f 1 50.1    10.6  ?     ?   207.493   -150.827     102.894    -150.827     88.1307    29.1734      
1 1 1 45  11 9  o 0 39      12.5  ?     ?   162.523   173.712      88.4495    173.712      60.0946    -6.28797     
1 1 1 45  11 10 o 0 95.5    15.5  ?     ?   189.943   166.889      240.697    166.889      71.1446    166.889      
1 1 1 45  11 11 o 0 30.3    14.8  ?     ?   153.004   139.634      67.5662    139.634      66.8297    -40.3658     
1 1 1 45  11 12 o 0 50      19.6  ?     ?   260.781   139.057      49.3015    139.057      179.495    -40.9429     
1 1 1 45  11 13 < 0 216.4   19    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 45  11 14 < 0 -4.9    28.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 13 10 < 0 -1.9    8.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 13 9  < 1 76.5    9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 13 8  < 0 39.3    7.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -45 13 7  o 0 156.4   10.3  ?     ?   248.772   102.705      301.604    102.705      101.463    102.705      
1 1 1 -45 13 6  o 0 22.8    9.3   ?     ?   122.115   154.757      63.2892    154.757      35.482     -25.2429     
1 1 1 -45 13 5  o 0 7.6     9.5   ?     ?   125.048   -15.669      10.7118    164.331      112.126    164.331      
1 1 1 -45 13 4  o 0 3.9     9.1   ?     ?   7.91888   94.9471      0.34863    94.9471      6.10229    -85.0529     
1 1 1 -45 13 3  o 0 88.4    6.2   ?     ?   163.709   -22.8093     237.568    -22.8093     103.67     -22.8093     
1 1 1 -45 13 2  o 0 83.8    4.3   ?     ?   285.757   -81.9539     138.492    -81.9538     96.0668    98.0462      
1 1 1 -45 13 1  o 0 132.1   5.6   ?     ?   254.322   -5.27927     262.121    -5.27927     52.7087    -5.27927     
1 1 1 45  13 0  o 0 56.2    5.5   ?     ?   266.97    47.4035      85.1157    47.4035      141.824    -132.596     
1 1 1 45  13 1  o 0 31.7    6.2   ?     ?   134.68    11.2932      99.2053    11.2932      15.3814    -168.707     
1 1 1 45  13 2  o 0 -6.8    6.9   ?     ?   23.9306   37.2228      11.7434    -142.777     32.1136    -142.777     
1 1 1 45  13 3  o 0 29.9    7.8   ?     ?   180.797   9.37061      59.3719    9.37061      94.5385    -170.629     
1 1 1 45  13 4  o 0 174.5   10.5  ?     ?   334.986   -39.6412     279.004    -39.6412     6.07271    140.359      
1 1 1 45  13 5  o 0 28.8    9     ?     ?   196.522   -80.0716     45.9541    -80.0716     121.541    99.9284      
1 1 1 45  13 6  o 0 42.2    11.1  ?     ?   138.871   46.494       134.889    46.494       16.6665    46.494       
1 1 1 45  13 7  o 0 15.5    12.4  ?     ?   124.255   25.5995      32.5241    25.5995      73.0895    -154.401     
1 1 1 45  13 8  < 0 141.1   14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 45  13 9  < 1 59.1    14.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 0  22 < 0 24.7    5.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 0  21 o 0 39.1    5.7   ?     ?   119.562   180          133.28     180          30.3043    180          
1 1 1 -46 0  20 o 0 93.1    6     ?     ?   208.004   0            215.307    0            31.9792    0            
1 1 1 -46 0  19 o 0 100.9   5.7   ?     ?   269.017   0            226.379    0            18.083     180          
1 1 1 -46 0  18 o 0 2.6     4.9   ?     ?   48.5285   0            5.90414    0            40.1461    180          
1 1 1 -46 0  17 o 0 3.7     4.9   ?     ?   106.172   180          11.9166    180          85.496     9.78e-16     
1 1 1 -46 0  16 o 0 32.8    4.6   ?     ?   194.334   0            121.238    0            50.2253    180          
1 1 1 -46 0  15 o 0 -1.3    4     ?     ?   25.0081   0            0.9917     0            21.0509    180          
1 1 1 -46 0  14 o 0 194.8   8.2   ?     ?   170.021   0            312.578    0            162.191    0            
1 1 1 -46 0  13 o 0 503.8   14    ?     ?   405.9     0            506.879    0            136.16     0            
1 1 1 -46 0  12 o 0 -0.4    2.9   ?     ?   123.774   180          2.9628     180          112.743    1.84394e-16  
1 1 1 -46 0  11 o 0 1163.1  34.5  ?     ?   864.784   180          779.136    180          34.1376    1.60145e-13  
1 1 1 -46 0  10 f 1 6.2     2.9   ?     ?   98.7358   0            10.1289    0            85.394     180          
1 1 1 -46 0  9  o 0 7.7     2.7   ?     ?   83.3638   0            11.9952    0            68.6613    180          
1 1 1 -46 0  8  f 1 409.5   12.2  ?     ?   306.413   0            417.565    0            152.376    0            
1 1 1 -46 0  7  o 0 9.3     2.8   ?     ?   218.628   180          26.003     180          163.083    1.11879e-15  
1 1 1 -46 0  6  o 0 28      3.6   ?     ?   67.5825   180          27.5211    180          31.1697    6.19537e-15  
1 1 1 -46 0  5  f 1 22.5    2.7   ?     ?   442.699   180          89.565     180          298.325    2.1066e-15   
1 1 1 -46 0  4  o 0 10.3    3.4   ?     ?   58.4008   180          6.38465    180          44.2566    1.01226e-15  
1 1 1 -46 0  3  o 0 164.2   6.2   ?     ?   330.595   180          265.297    180          22.2759    8.35662e-14  
1 1 1 -46 0  2  o 0 185.2   7.6   ?     ?   554.373   0            286.926    0            196.679    180          
1 1 1 -46 0  1  o 0 419.5   14.5  ?     ?   460.147   180          433.105    180          30.6718    180          
1 1 1 46  0  0  o 0 950.9   26.2  ?     ?   593.485   -180         653.59     180          133.367    180          
1 1 1 46  0  1  o 0 217.5   8.7   ?     ?   276.257   180          307.254    180          64.6228    180          
1 1 1 46  0  2  o 0 950     26.4  ?     ?   452.925   180          655.624    180          257.166    180          
1 1 1 46  0  3  o 0 639.3   18.4  ?     ?   600.58    180          538.606    180          9.53657    180          
1 1 1 46  0  4  o 0 391.7   13.6  ?     ?   520.552   180          421.959    180          37.079     7.98502e-14  
1 1 1 46  0  5  f 1 340     13.2  ?     ?   251.493   0            392.405    0            167.387    0            
1 1 1 46  0  6  o 0 -4.9    7     ?     ?   256.966   180          6.02272    180          222.787    1.89686e-16  
1 1 1 46  0  7  o 0 19.5    6.7   ?     ?   145.034   180          35.914     180          93.2196    2.70327e-15  
1 1 1 46  0  8  f 1 451.8   17    ?     ?   192.352   0            509.645    0            315.365    0            
1 1 1 46  0  9  o 0 108.5   10.7  ?     ?   441.729   180          248.743    180          194.749    8.96208e-15  
1 1 1 46  0  10 f 1 516.2   19.4  ?     ?   408.722   180          543.917    180          139.172    180          
1 1 1 46  0  11 o 0 3.8     10.3  ?     ?   26.0957   180          3.23197    180          22.4338    1.01087e-15  
1 1 1 46  0  12 o 0 60.2    14.3  ?     ?   227.774   180          177.1      180          42.7122    2.90938e-14  
1 1 1 46  0  13 o 0 -16.8   16.7  ?     ?   26.739    0            3.1199     0            21.9777    180          
1 1 1 46  0  14 o 0 -4.9    16.9  ?     ?   66.6275   0            11.1987    0            51.1523    180          
1 1 1 46  0  15 o 0 13      22.6  ?     ?   21.0768   0            8.50341    0            11.2275    180          
1 1 1 46  0  16 o 0 389.9   27.8  ?     ?   494.044   180          462.208    180          2.55029    1.27169e-12  
1 1 1 46  0  17 < 0 1417.4  52.5  ?     ?   ?         ?            687.937    180          ?          ?            
1 1 1 46  0  18 o 0 28.8    31.1  ?     ?   201.441   180          98.3466    180          107.064    6.44538e-15  
1 1 1 46  0  19 o 0 7.6     27.9  ?     ?   59.3504   0            30.1895    0            27.9966    180          
1 1 1 46  0  20 o 0 17.6    31.5  ?     ?   84.9513   0            61.2189    0            18.8273    180          
1 1 1 46  0  21 o 0 6.3     26.4  ?     ?   20.5102   180          15.4989    180          3.75733    2.89437e-14  
1 1 1 -46 2  22 < 0 -0.6    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 2  21 o 0 36.8    4.8   ?     ?   113.867   -38.7964     139.349    -38.7964     41.9146    -38.7964     
1 1 1 -46 2  20 o 0 55.1    4.7   ?     ?   154.153   55.6239      163.901    55.6239      29.1787    55.6239      
1 1 1 -46 2  19 o 0 126     4.9   ?     ?   223.89    -171.054     279.21     -171.054     77.4111    -171.054     
1 1 1 -46 2  18 o 0 27.1    3.1   ?     ?   130.622   -168.521     69.9835    -168.521     52.9953    11.4794      
1 1 1 -46 2  17 o 0 65.6    3.3   ?     ?   131.263   -28.9406     200.242    -28.9406     76.4859    -28.9406     
1 1 1 -46 2  16 o 0 65.3    3.1   ?     ?   260.497   56.6742      102.66     56.6742      125.505    -123.326     
1 1 1 -46 2  15 o 0 132.1   3.9   ?     ?   217.155   -103.057     286.321    -103.057     96.2576    -103.057     
1 1 1 -46 2  14 o 0 46.8    3     ?     ?   156.874   129.861      116.958    129.861      20.8643    -50.1392     
1 1 1 -46 2  13 o 0 12.7    2.3   ?     ?   120.343   131.844      25.824     -48.1564     135.024    -48.1564     
1 1 1 -46 2  12 o 0 31.9    2.8   ?     ?   93.7641   -56.5725     67.6425    -56.5725     18.0091    123.427      
1 1 1 -46 2  11 o 0 215.3   5     ?     ?   272.635   139.193      376.715    139.193      121.852    139.193      
1 1 1 -46 2  10 o 0 171     4.6   ?     ?   176.351   -108.259     375.196    -108.259     209.379    -108.259     
1 1 1 -46 2  9  o 0 11.5    1.9   ?     ?   118.847   -134.27      59.1092    45.7295      173.46     45.7295      
1 1 1 -46 2  8  o 0 125.3   3.4   ?     ?   221.687   -144.04      243.756    -144.04      29.3808    -144.04      
1 1 1 -46 2  7  o 0 108.8   3.4   ?     ?   171.578   31.7443      185.674    31.7443      38.0436    31.7443      
1 1 1 -46 2  6  f 1 209.8   5     ?     ?   344.802   143.733      257.842    143.733      41.6368    -36.2669     
1 1 1 -46 2  5  o 0 326.2   7.2   ?     ?   351.407   103.834      404.44     103.834      99.5967    103.834      
1 1 1 -46 2  4  o 0 312.8   6.7   ?     ?   435.309   68.0572      325.566    68.0572      53.4119    -111.943     
1 1 1 -46 2  3  o 0 260.6   6     ?     ?   524.377   -45.4427     186.295    -45.4427     267.731    134.557      
1 1 1 -46 2  2  o 0 110.6   3.4   ?     ?   273.31    -9.53624     128.994    -9.53624     108.34     170.464      
1 1 1 -46 2  1  o 0 910.1   17.7  ?     ?   731.823   158.382      607.887    158.382      29.2603    -21.6182     
1 1 1 46  2  0  o 0 548     11.5  ?     ?   525.134   156.153      495.354    156.153      36.0058    156.153      
1 1 1 46  2  1  o 0 461.6   10.7  ?     ?   449.003   -91.7326     475.064    -91.7326     81.552     -91.7326     
1 1 1 46  2  2  o 0 32.8    3.2   ?     ?   85.5353   57.2511      9.58092    -122.749     84.6669    -122.749     
1 1 1 46  2  3  o 0 78      5     ?     ?   364.354   152.757      1.18274    -27.2426     321.444    -27.2426     
1 1 1 46  2  4  o 0 14.8    3.8   ?     ?   74.5032   170.997      32.9852    -9.00254     99.1104    -9.00254     
1 1 1 46  2  5  o 0 94      5     ?     ?   190.383   -140.553     153.887    -140.553     15.1933    39.4471      
1 1 1 46  2  6  f 1 248.9   8.2   ?     ?   346.35    114.256      318.904    114.256      9.64654    114.256      
1 1 1 46  2  7  o 0 231.1   7.9   ?     ?   446.51    82.785       223.676    82.785       174.188    -97.215      
1 1 1 46  2  8  o 0 136.8   7.8   ?     ?   174.843   9.46472      304.961    9.46472      129.702    9.46472      
1 1 1 46  2  9  o 0 210.7   8.8   ?     ?   266.672   -168.922     377.871    -168.922     110.816    -168.922     
1 1 1 46  2  10 o 0 84.2    9     ?     ?   277.555   123.588      127.123    123.588      145.608    -56.412      
1 1 1 46  2  11 o 0 71.8    9.2   ?     ?   191.454   174.292      158.227    174.292      29.5626    -5.70803     
1 1 1 46  2  12 o 0 147.5   12.8  ?     ?   201.958   -132.283     338.995    -132.283     144.645    -132.283     
1 1 1 46  2  13 o 0 81.8    14    ?     ?   156.215   -74.3856     227.496    -74.3856     81.2985    -74.3856     
1 1 1 46  2  14 o 0 197.8   15.9  ?     ?   298.303   -66.4984     357.95     -66.4984     78.5923    -66.4984     
1 1 1 46  2  15 o 0 182.8   17.9  ?     ?   305.095   -97.3002     324.095    -97.3002     39.3876    -97.3002     
1 1 1 46  2  16 o 0 157.1   17.6  ?     ?   221.982   -175.092     361.546    -175.092     143.338    -175.092     
1 1 1 46  2  17 o 0 13.8    20.7  ?     ?   72.6506   172.438      34.9472    172.438      38.6729    -7.56211     
1 1 1 46  2  18 o 0 50.2    18.8  ?     ?   202.768   6.55673      94.4816    6.55673      104.601    -173.443     
1 1 1 46  2  19 o 0 48.3    20.8  ?     ?   82.4616   169.002      162.798    169.002      83.9376    169.002      
1 1 1 46  2  20 o 0 53.9    26.7  ?     ?   133.272   77.3033      151.358    77.3033      26.2746    77.3033      
1 1 1 46  2  21 < 0 165.1   29.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 4  21 < 0 33.4    5     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 4  20 o 0 71.2    4.9   ?     ?   207.581   130.825      172.776    130.825      3.3931     -49.1748     
1 1 1 -46 4  19 o 0 230.9   6.7   ?     ?   392.83    150.885      317.079    150.885      24.137     -29.115      
1 1 1 -46 4  18 o 0 186.5   5.8   ?     ?   230.35    117.69       380.409    117.69       174.083    117.69       
1 1 1 -46 4  17 o 0 2.3     3     ?     ?   96.4773   -158.237     62.3062    21.7625      152.559    21.7625      
1 1 1 -46 4  16 o 0 103.1   3.8   ?     ?   284.4     -91.6739     174.062    -91.6739     92.3281    88.3261      
1 1 1 -46 4  15 o 0 289.6   7.3   ?     ?   362.943   -49.4621     409.338    -49.4621     93.5564    -49.4621     
1 1 1 -46 4  14 o 0 97.6    3.5   ?     ?   187.589   37.6554      233.556    37.6554      70.4849    37.6554      
1 1 1 -46 4  13 o 0 101.1   3.2   ?     ?   285.443   -23.0502     170.885    -23.0502     78.1553    156.95       
1 1 1 -46 4  12 o 0 333.8   7.7   ?     ?   375.764   -49.5862     465.246    -49.5862     135.112    -49.5862     
1 1 1 -46 4  11 o 0 176.2   4.6   ?     ?   249.216   -81.7878     337.323    -81.7878     111.309    -81.7878     
1 1 1 -46 4  10 o 0 283.4   6.4   ?     ?   415.952   -69.6742     351.04     -69.6742     34.9419    110.326      
1 1 1 -46 4  9  o 0 49.1    2.2   ?     ?   35.6263   -69.0651     57.8976    -69.0651     24.6499    -69.0651     
1 1 1 -46 4  8  o 0 32.1    2.3   ?     ?   112.993   56.9477      25.1086    56.9477      82.7813    -123.052     
1 1 1 -46 4  7  o 0 13.9    1.7   ?     ?   129.563   155.666      53.651     -24.3341     177.965    -24.3341     
1 1 1 -46 4  6  o 0 39.8    2.1   ?     ?   118.118   -100.173     52.1975    -100.173     61.6432    79.8269      
1 1 1 -46 4  5  o 0 103.8   3.8   ?     ?   254.102   121.213      139.407    121.213      78.3814    -58.7872     
1 1 1 -46 4  4  o 0 48.1    2.3   ?     ?   168.665   144.712      38.0726    144.712      107.028    -35.2875     
1 1 1 -46 4  3  o 0 136.8   3.9   ?     ?   371.679   155.467      123.047    155.467      197.78     -24.5332     
1 1 1 -46 4  2  o 0 199.6   5.3   ?     ?   248.411   71.8801      310.071    71.8801      95.0014    71.8801      
1 1 1 -46 4  1  o 0 532.4   11.4  ?     ?   479.362   56.9931      513.9      56.9931      97.7709    56.9931      
1 1 1 46  4  0  o 0 457.4   10.2  ?     ?   605.562   84.7306      343.231    84.7306      186.55     -95.2694     
1 1 1 46  4  1  o 0 176.8   5.3   ?     ?   272.35    -122.357     263.573    -122.357     24.8688    -122.357     
1 1 1 46  4  2  o 0 510.1   10.8  ?     ?   434.023   -5.30532     535.581    -5.30532     154.599    -5.30532     
1 1 1 46  4  3  o 0 347.9   8.4   ?     ?   182.945   38.1326      540.298    38.1326      379.519    38.1326      
1 1 1 46  4  4  o 0 5.3     5.7   ?     ?   214.31    108.943      150.662    -71.0574     339.165    -71.0574     
1 1 1 46  4  5  o 0 204.6   7.8   ?     ?   420.469   116.657      230.723    116.657      187.063    -63.3434     
1 1 1 46  4  6  o 0 6.6     5.6   ?     ?   113.267   -109.475     78.551     70.5253      191.109    70.5253      
1 1 1 46  4  7  o 0 278.9   8.9   ?     ?   493.587   -146.985     276.551    -146.985     213.806    33.0153      
1 1 1 46  4  8  o 0 24.3    6.4   ?     ?   49.1646   -22.1666     16.7036    -22.1666     31.2537    157.833      
1 1 1 46  4  9  o 0 156.9   8.5   ?     ?   269.388   114.706      292.737    114.706      30.2536    114.706      
1 1 1 46  4  10 o 0 -8.1    8.3   ?     ?   115.642   -120.108     84.1722    59.8923      194.799    59.8923      
1 1 1 46  4  11 o 0 45.2    8.9   ?     ?   173.015   -147.136     97.1037    -147.136     68.0827    32.8643      
1 1 1 46  4  12 o 0 125.4   11.2  ?     ?   392.379   -122.046     141.903    -122.046     222.517    57.9542      
1 1 1 46  4  13 o 0 132.1   14.8  ?     ?   234.295   -100.254     286.525    -100.254     68.7251    -100.254     
1 1 1 46  4  14 o 0 28      12.7  ?     ?   77.1429   -177.045     55.4907    -177.045     15.9854    2.95505      
1 1 1 46  4  15 o 0 -3.3    14.1  ?     ?   60.8165   72.513       17.3948    -107.487     74.0259    -107.487     
1 1 1 46  4  16 o 0 58.5    19.3  ?     ?   117.255   31.6243      179.401    31.6243      61.3691    31.6243      
1 1 1 46  4  17 o 0 64.3    19.2  ?     ?   124.218   70.311       203.518    70.311       78.1165    70.311       
1 1 1 46  4  18 o 0 55.4    23.6  ?     ?   189.813   -119.278     114.022    -119.278     66.378     60.7224      
1 1 1 46  4  19 o 0 84.2    27.6  ?     ?   156.203   100.876      223.71     100.876      77.9837    100.876      
1 1 1 46  4  20 o 0 17.2    27.5  ?     ?   136.42    46.2361      58.337     46.2361      68.4747    -133.764     
1 1 1 -46 6  20 < 0 8.6     5     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 6  19 f 1 143.4   6     ?     ?   329.26    115.761      227.99     115.761      49.6537    -64.2391     
1 1 1 -46 6  18 o 0 98.9    4.9   ?     ?   233.96    92.6357      212.71     92.6357      12.3021    92.6357      
1 1 1 -46 6  17 o 0 16.3    3.3   ?     ?   40.0387   -152.583     27.128     -152.583     8.23394    27.4174      
1 1 1 -46 6  16 f 1 -0.7    3     ?     ?   54.3383   137.505      40.495     -42.495      90.8682    -42.495      
1 1 1 -46 6  15 o 0 41.9    3     ?     ?   232.553   -73.7015     49.9229    -73.7015     164.801    106.298      
1 1 1 -46 6  14 o 0 95.9    3.6   ?     ?   252.03    -108.453     189.433    -108.453     37.1563    71.5467      
1 1 1 -46 6  13 f 1 192.3   4.8   ?     ?   232.972   -53.4954     372.39     -53.4954     170.023    -53.4954     
1 1 1 -46 6  12 f 1 296.6   6.2   ?     ?   449.42    -59.9735     346.471    -59.9735     43.3412    120.026      
1 1 1 -46 6  11 f 1 59.3    2.4   ?     ?   173.445   28.9996      144.271    28.9996      6.63076    -151         
1 1 1 -46 6  10 o 0 123.6   3.6   ?     ?   240.089   56.8223      252.266    56.8223      43.1202    56.8223      
1 1 1 -46 6  9  o 0 75.6    2.4   ?     ?   225.873   -114.243     147.465    -114.243     55.5253    65.757       
1 1 1 -46 6  8  o 0 183.6   4.9   ?     ?   325.55    -147.506     287.21     -147.506     6.97935    32.494       
1 1 1 -46 6  7  o 0 45.8    4.3   ?     ?   52.7369   -24.4893     70.5373    -24.4893     21.8229    -24.4893     
1 1 1 -46 6  6  o 0 185.2   7.3   ?     ?   388.163   113.775      229.188    113.775      131.055    -66.2252     
1 1 1 -46 6  5  o 0 56      4.5   ?     ?   178.501   112.216      112.954    112.216      53.4193    -67.7844     
1 1 1 -46 6  4  o 0 398.4   18    ?     ?   451.554   -117.678     463.222    -117.678     40.7057    -117.678     
1 1 1 -46 6  3  o 0 249.8   6.4   ?     ?   301.424   -155.733     392.454    -155.733     104.394    -155.733     
1 1 1 -46 6  2  o 0 35.1    2     ?     ?   77.3479   -23.3963     33.2706    -23.3963     40.8788    156.604      
1 1 1 -46 6  1  o 0 400.9   8.4   ?     ?   381.811   95.6379      520.506    95.6379      153.479    95.6379      
1 1 1 46  6  0  o 0 62.1    2.8   ?     ?   163.899   125.343      118.112    125.343      41.3211    -54.6565     
1 1 1 46  6  1  o 0 88.8    3.5   ?     ?   124.153   -103.559     198.745    -103.559     77.7724    -103.559     
1 1 1 46  6  2  o 0 378.6   8.7   ?     ?   412.02    -173.063     474.87     -173.063     72.8634    -173.063     
1 1 1 46  6  3  o 0 13.8    3.7   ?     ?   72.0841   -148.971     28.2096    31.0286      98.6123    31.0286      
1 1 1 46  6  4  o 0 32.9    4.2   ?     ?   193.407   -59.8796     23.2971    -59.8796     162.419    120.12       
1 1 1 46  6  5  o 0 21.2    5.4   ?     ?   66.3464   -15.6627     9.65982    -15.6627     54.066     164.337      
1 1 1 46  6  6  o 0 19.4    5.4   ?     ?   120.07    56.6728      6.35445    -123.327     121.669    -123.327     
1 1 1 46  6  7  o 0 485.6   12.3  ?     ?   463.876   158.915      573.004    158.915      135.167    158.915      
1 1 1 46  6  8  o 0 247.6   9.4   ?     ?   318.822   -83.5771     406.928    -83.5771     106.28     -83.5771     
1 1 1 46  6  9  o 0 57      8.1   ?     ?   182.566   -38.6499     129.842    -38.6499     42.0867    141.35       
1 1 1 46  6  10 o 0 89      9.6   ?     ?   147.615   11.4068      248.068    11.4068      112.756    11.4068      
1 1 1 46  6  11 f 1 29.6    11    ?     ?   182.375   172.896      30.9587    172.896      137.338    -7.10393     
1 1 1 46  6  12 f 1 55.5    11.3  ?     ?   239.596   151.807      89.9383    151.807      130.578    -28.1928     
1 1 1 46  6  13 f 1 -1.8    13.1  ?     ?   104.578   16.7271      36.1261    -163.273     132.92     -163.273     
1 1 1 46  6  14 o 0 125.4   15.1  ?     ?   230.141   -75.8986     279.113    -75.8986     49.8748    -75.8986     
1 1 1 46  6  15 o 0 38.1    15.1  ?     ?   246.7     -81.7272     11.7556    -81.7272     234.84     98.2728      
1 1 1 46  6  16 < 1 493.2   41.9  ?     ?   ?         ?            23.0871    -122.314     ?          ?            
1 1 1 46  6  17 o 0 9.5     20.5  ?     ?   120.195   160.192      25.5199    160.192      87.1125    -19.8079     
1 1 1 46  6  18 o 0 4.4     25.7  ?     ?   119.959   -147.017     35.3601    -147.017     75.0032    32.9831      
1 1 1 46  6  19 f 1 22.8    28.3  ?     ?   57.8109   56.8352      99.605     56.8352      46.3284    56.8352      
1 1 1 -46 8  18 < 0 151.4   6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 8  17 o 0 78.4    4.8   ?     ?   204.234   95.322       191.967    95.322       22.6766    95.322       
1 1 1 -46 8  16 o 0 15.7    3.3   ?     ?   38.4908   36.7467      36.1077    36.7467      3.97456    36.7467      
1 1 1 -46 8  15 o 0 -2.9    2.7   ?     ?   36.0302   7.78496      26.3659    -172.215     57.1149    -172.215     
1 1 1 -46 8  14 o 0 20.1    2.6   ?     ?   101.135   119.379      51.5118    119.379      37.385     -60.6209     
1 1 1 -46 8  13 o 0 114.6   3.7   ?     ?   269.697   122.176      206.201    122.176      41.091     -57.824      
1 1 1 -46 8  12 o 0 108.5   3.2   ?     ?   188.514   17.3094      259.873    17.3094      87.0066    17.3094      
1 1 1 -46 8  11 o 0 117.9   4.1   ?     ?   193.467   -93.8535     267.076    -93.8535     102.481    -93.8535     
1 1 1 -46 8  10 o 0 246.2   11.1  ?     ?   292.676   -167.101     401.159    -167.101     150.499    -167.101     
1 1 1 -46 8  9  o 0 7.6     6.2   ?     ?   76.1086   -90.8547     25.332     89.1453      90.3507    89.1453      
1 1 1 -46 8  8  o 0 297.7   10    ?     ?   357.73    36.6063      422.427    36.6063      115.054    36.6063      
1 1 1 -46 8  7  o 0 77.3    4.8   ?     ?   163.974   179.787      197.344    179.787      56.2305    179.787      
1 1 1 -46 8  6  o 0 84.9    5.9   ?     ?   209.774   -82.5833     187.711    -82.5833     6.29343    -82.5833     
1 1 1 -46 8  5  o 0 127.9   6.8   ?     ?   239.163   -73.5858     260.234    -73.5858     52.4712    -73.5858     
1 1 1 -46 8  4  o 0 15.4    4.2   ?     ?   56.1618   -41.404      1.71668    -41.404      48.5212    138.596      
1 1 1 -46 8  3  o 0 192.1   8.5   ?     ?   215.675   88.0251      384.374    88.0251      190.743    88.0251      
1 1 1 -46 8  2  o 0 90.3    5.9   ?     ?   160.989   84.5675      225.974    84.5675      80.9682    84.5675      
1 1 1 -46 8  1  o 0 250.8   8.4   ?     ?   369.88    169.781      351.886    169.781      17.7799    169.781      
1 1 1 46  8  0  o 0 287.6   6.9   ?     ?   369.984   -139.418     409.156    -139.418     69.2317    -139.418     
1 1 1 46  8  1  o 0 58.5    3.4   ?     ?   214.779   53.0811      110.889    53.0811      86.734     -126.919     
1 1 1 46  8  2  o 0 9.7     3.5   ?     ?   45.748    53.7924      14.8759    -126.208     57.0174    -126.208     
1 1 1 46  8  3  o 0 16.2    4.2   ?     ?   52.241    -173.184     4.47136    -173.184     43.6881    6.81613      
1 1 1 46  8  4  o 0 48.9    5.7   ?     ?   115.138   -28.9349     141.656    -28.9349     38.1153    -28.9349     
1 1 1 46  8  5  o 0 91      5.8   ?     ?   266.354   -60.2275     167.292    -60.2275     72.2351    119.772      
1 1 1 46  8  6  o 0 88      6.6   ?     ?   158.744   -19.7301     235.914    -19.7301     93.2131    -19.7301     
1 1 1 46  8  7  o 0 30.1    7.3   ?     ?   178.876   47.0443      43.0516    47.0443      118.225    -132.956     
1 1 1 46  8  8  o 0 105.4   8.3   ?     ?   226.296   82.7036      230.486    82.7036      26.702     82.7036      
1 1 1 46  8  9  o 0 148.1   9.1   ?     ?   240.023   61.9899      307.788    61.9899      90.1034    61.9899      
1 1 1 46  8  10 o 0 25.5    9.7   ?     ?   30.6716   108.238      30.4107    108.238      2.65089    108.238      
1 1 1 46  8  11 o 0 78      12.1  ?     ?   214.374   -119.185     177.093    -119.185     33.0014    60.8147      
1 1 1 46  8  12 o 0 48.8    13.2  ?     ?   197.267   -72.0528     100.247    -72.0528     92.517     107.947      
1 1 1 46  8  13 o 0 39.1    14.2  ?     ?   146.857   -36.2136     98.002     -36.2136     46.0931    143.786      
1 1 1 46  8  14 o 0 41.6    14.9  ?     ?   203.178   -33.5357     70.4004    -33.5357     121.513    146.464      
1 1 1 46  8  15 o 0 6.9     16.1  ?     ?   78.6259   -91.6185     18.872     -91.6185     53.5384    88.3815      
1 1 1 46  8  16 o 0 6.2     19.2  ?     ?   89.4176   165.859      32.3748    165.859      48.5217    -14.141      
1 1 1 46  8  17 o 0 19.6    20.3  ?     ?   224.218   115.086      17.8395    -64.9138     220.112    -64.9138     
1 1 1 46  8  18 < 0 4.4     24.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 10 16 < 0 17.9    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 10 15 < 0 27.8    3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 10 14 o 0 21.8    2.8   ?     ?   28.5121   -47.6819     61.6328    -47.6819     38.2876    -47.6819     
1 1 1 -46 10 13 o 0 6.7     2.3   ?     ?   47.52     -44.723      3.75048    135.277      42.8937    135.277      
1 1 1 -46 10 12 o 0 31.5    5.7   ?     ?   72.5303   -113.994     107.131    -113.994     46.1222    -113.994     
1 1 1 -46 10 11 o 0 53.7    6.2   ?     ?   154.952   131.215      148.759    131.215      14.6656    131.215      
1 1 1 -46 10 10 o 0 50.8    6.5   ?     ?   116.358   9.69701      162.302    9.69701      60.9091    9.69701      
1 1 1 -46 10 9  o 0 91.7    7.4   ?     ?   214.827   65.1153      198.765    65.1153      3.79224    65.1153      
1 1 1 -46 10 8  o 0 59.3    6.6   ?     ?   153.65    19.5733      160.336    19.5733      21.0934    19.5733      
1 1 1 -46 10 7  o 0 129.6   7.9   ?     ?   334.902   75.186       179.512    75.186       125.678    -104.814     
1 1 1 -46 10 6  o 0 0.6     4.9   ?     ?   168.731   19.0538      110.127    -160.946     264.677    -160.946     
1 1 1 -46 10 5  o 0 245.3   10.4  ?     ?   281.429   122.152      404.519    122.152      165.942    122.152      
1 1 1 -46 10 4  o 0 130.8   8.3   ?     ?   228.507   98.003       266.114    98.003       71.5768    98.003       
1 1 1 -46 10 3  o 0 137.4   10.5  ?     ?   229.202   118.471      278.19     118.471      82.315     118.471      
1 1 1 -46 10 2  f 1 128.2   8.7   ?     ?   309.762   -110.411     199.224    -110.411     67.7612    69.5886      
1 1 1 -46 10 1  o 0 54.3    3.5   ?     ?   138.35    159.367      151.776    159.367      32.7891    159.367      
1 1 1 46  10 0  o 0 7.2     2.7   ?     ?   94.5928   28.6506      35.2536    -151.349     118.495    -151.349     
1 1 1 46  10 1  o 0 83.3    4.4   ?     ?   171.684   -144.824     214.591    -144.824     63.3181    -144.824     
1 1 1 46  10 2  f 1 19.8    4.4   ?     ?   170.878   85.7992      3.97382    85.7992      147.497    -94.2008     
1 1 1 46  10 3  o 0 163.6   6.9   ?     ?   232.935   118.259      332.975    118.259      127.446    118.259      
1 1 1 46  10 4  o 0 39.3    6     ?     ?   16.7559   -47.8044     37.3193    -47.8044     22.5331    -47.8044     
1 1 1 46  10 5  o 0 88.7    8.5   ?     ?   304.623   137.614      131.788    137.614      149.96     -42.3857     
1 1 1 46  10 6  o 0 185     9.5   ?     ?   341.36    137.682      285.289    137.682      41.3985    -42.3182     
1 1 1 46  10 7  o 0 21.1    8.3   ?     ?   132.021   135.084      28.2856    135.084      97.9227    -44.9164     
1 1 1 46  10 8  o 0 31.4    11.6  ?     ?   165.07    -140.913     56.1322    -140.913     102.614    39.0875      
1 1 1 46  10 9  o 0 2.8     12.1  ?     ?   68.6026   -70.617      9.1805     109.383      75.0276    109.383      
1 1 1 46  10 10 o 0 140.1   14.1  ?     ?   182.06    -31.9506     344.16     -31.9506     175.694    -31.9506     
1 1 1 46  10 11 o 0 281.7   17.8  ?     ?   264.612   30.0534      506.939    30.0534      267.861    30.0534      
1 1 1 46  10 12 o 0 195.1   18.2  ?     ?   338.476   123.131      311.763    123.131      6.93423    123.131      
1 1 1 46  10 13 o 0 49.2    17.6  ?     ?   180.133   95.4901      114.391    95.4901      45.1356    -84.5099     
1 1 1 46  10 14 o 0 155.3   22    ?     ?   192.159   12.1059      362.281    12.1059      192.42     12.1059      
1 1 1 -46 12 12 < 0 35.9    7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 12 11 < 0 135.4   10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 12 10 o 0 54.6    8.2   ?     ?   166.284   -7.27814     150.471    -7.27814     16.5103    -7.27814     
1 1 1 -46 12 9  o 0 179.3   10    ?     ?   305.58    70.0064      297.738    70.0064      49.913     70.0064      
1 1 1 -46 12 8  o 0 221.7   11.3  ?     ?   315.721   31.4568      352.191    31.4568      95.1254    31.4568      
1 1 1 -46 12 7  o 0 47.5    7.7   ?     ?   161.259   19.5913      131.846    19.5913      0.212016   -160.409     
1 1 1 -46 12 6  o 0 85.3    9.4   ?     ?   165.561   -4.67018     223.988    -4.67018     85.8859    -4.67018     
1 1 1 -46 12 5  o 0 22      9.4   ?     ?   40.8047   149.88       45.5339    149.88       11.331     149.88       
1 1 1 -46 12 4  o 0 122.8   11.7  ?     ?   289.697   -176.112     204.043    -176.112     45.0519    3.88804      
1 1 1 -46 12 3  o 0 -15.2   9.1   ?     ?   47.3413   -158.342     27.0852    21.6578      67.9538    21.6578      
1 1 1 -46 12 2  o 0 26      4     ?     ?   130.516   -98.0217     66.3024    -98.0217     46.7681    81.9783      
1 1 1 -46 12 1  f 1 152.7   5.3   ?     ?   174.536   48.5146      354.342    48.5146      201.884    48.5146      
1 1 1 46  12 0  o 0 130.1   7.1   ?     ?   184.909   50.36        315.037    50.36        149.546    50.36        
1 1 1 46  12 1  f 1 24.1    5.1   ?     ?   145.74    -91.361      50.2736    -91.361      80.9669    88.639       
1 1 1 46  12 2  o 0 63.3    6.4   ?     ?   135.594   25.1667      194.656    25.1667      73.0993    25.1667      
1 1 1 46  12 3  o 0 45.3    6.3   ?     ?   170.892   22.1084      115.064    22.1084      38.1742    -157.892     
1 1 1 46  12 4  o 0 76.2    8     ?     ?   235.147   -40.4274     161.094    -40.4274     45.3337    139.573      
1 1 1 46  12 5  o 0 80.1    10.5  ?     ?   231.067   -61.9757     172.527    -61.9757     30.2042    118.024      
1 1 1 46  12 6  o 0 48.5    10.3  ?     ?   77.5364   -14.9759     171.081    -14.9759     103.119    -14.9759     
1 1 1 46  12 7  o 0 45.5    9.9   ?     ?   196.683   -59.3389     104.131    -59.3389     65.7799    120.661      
1 1 1 46  12 8  o 0 95.2    13.8  ?     ?   173.38    128.107      253.705    128.107      104.197    128.107      
1 1 1 46  12 9  o 0 35.9    15.8  ?     ?   106.153   152.447      119.579    152.447      28.0417    152.447      
1 1 1 46  12 10 < 0 15.9    17.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 46  12 11 < 0 6.6     22.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 14 4  < 0 16.2    5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 14 3  < 0 108.8   8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 14 2  < 0 32.8    4.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -46 14 1  < 0 159.4   11.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 46  14 0  < 0 334.9   17.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 46  14 1  < 0 65.7    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 46  14 2  < 0 39.2    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 46  14 3  < 0 35.6    10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 1  22 < 0 52.9    4.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 1  21 o 0 38.2    3.7   ?     ?   119.276   -31.6658     141.588    -31.6658     39.6279    -31.6658     
1 1 1 -47 1  20 o 0 42.3    4.2   ?     ?   134.54    150.803      141.308    150.803      25.3912    150.803      
1 1 1 -47 1  19 o 0 5.7     3     ?     ?   85.1486   113.178      32.8026    -66.822      109.455    -66.822      
1 1 1 -47 1  18 o 0 34      3.1   ?     ?   177.914   -124.78      66.548     -124.78      100.731    55.2199      
1 1 1 -47 1  17 o 0 27.3    3.2   ?     ?   54.88     123.061      68.9294    123.061      17.2624    123.061      
1 1 1 -47 1  16 o 0 38.9    3.1   ?     ?   79.6396   161.622      112.499    161.622      42.8519    161.622      
1 1 1 -47 1  15 o 0 37      3.1   ?     ?   109.15    -107.324     99.3653    -107.324     3.9891     -107.324     
1 1 1 -47 1  14 o 0 30.1    2.7   ?     ?   163.828   -90.6355     51.0524    -90.6355     92.6304    89.3645      
1 1 1 -47 1  13 f 1 24.1    2.5   ?     ?   80.8834   -78.2652     45.2379    -78.2652     26.5666    101.735      
1 1 1 -47 1  12 o 0 56.7    2.5   ?     ?   122.769   -118.528     153.241    -118.528     41.3063    -118.528     
1 1 1 -47 1  11 f 1 92.1    3     ?     ?   224.543   142.614      180.501    142.614      30.0682    -37.3865     
1 1 1 -47 1  10 o 0 366     7.9   ?     ?   329.594   12.8627      534.663    12.8627      225.386    12.8627      
1 1 1 -47 1  9  o 0 422.5   9.7   ?     ?   324.15    104.317      593.673    104.317      282.438    104.317      
1 1 1 -47 1  8  o 0 14      1.8   ?     ?   146.288   -144.502     62.3018    35.4976      203.461    35.4976      
1 1 1 -47 1  7  o 0 80.3    2.8   ?     ?   230.315   -71.555      100.744    -71.555      96.9921    108.445      
1 1 1 -47 1  6  f 1 135.1   4.2   ?     ?   284.275   -22.687      180.761    -22.687      65.5984    157.313      
1 1 1 -47 1  5  o 0 23.5    2.4   ?     ?   157.869   58.6527      39.4859    -121.347     176.13     -121.347     
1 1 1 -47 1  4  o 0 389.8   8.6   ?     ?   319.16    -15.3938     498.751    -15.3938     221.517    -15.3938     
1 1 1 -47 1  3  o 0 548.3   13.2  ?     ?   487.35    -46.3131     523.629    -46.3131     98.9266    -46.3131     
1 1 1 -47 1  2  o 0 173.5   5.2   ?     ?   371.717   3.77741      177.954    3.77741      144.108    -176.223     
1 1 1 -47 1  1  o 0 311     7.8   ?     ?   520.222   117.78       252.957    117.78       198.952    -62.2201     
1 1 1 47  1  0  o 0 114.5   4.6   ?     ?   241.099   140.933      153.592    140.933      56.5994    -39.0671     
1 1 1 47  1  1  o 0 31      2.9   ?     ?   67.4528   -91.2795     9.58527    88.7205      68.507     88.7205      
1 1 1 47  1  2  o 0 604.8   12.9  ?     ?   617.306   -162.241     472.054    -162.241     72.8078    17.7586      
1 1 1 47  1  3  o 0 571.7   12.2  ?     ?   570.919   -111.041     482.814    -111.041     21.785     68.9588      
1 1 1 47  1  4  o 0 127.4   5.5   ?     ?   209.736   128.523      215.272    128.523      29.7111    128.523      
1 1 1 47  1  5  o 0 474.7   11.1  ?     ?   402.145   90.2856      531.646    90.2856      175.616    90.2856      
1 1 1 47  1  6  f 1 277     8.4   ?     ?   352.117   108.313      350.421    108.313      36.9831    108.313      
1 1 1 47  1  7  o 0 583.1   13.5  ?     ?   433.363   113.264      690.859    113.264      257.559    113.264      
1 1 1 47  1  8  o 0 524.2   13.4  ?     ?   454.682   132.194      610.723    132.194      156.319    132.194      
1 1 1 47  1  9  o 0 53.4    7     ?     ?   67.4366   -146.427     109.941    -146.427     43.7805    -146.427     
1 1 1 47  1  10 o 0 60.1    8.6   ?     ?   145.307   -177.121     146.508    -177.121     4.13323    -177.121     
1 1 1 47  1  11 f 1 118.4   9.6   ?     ?   350.382   -155.35      153.827    -155.35      184.904    24.65        
1 1 1 47  1  12 o 0 416.1   14.3  ?     ?   496.978   -142.945     473.555    -142.945     3.41877    37.0553      
1 1 1 47  1  13 f 1 100.3   12    ?     ?   289.498   -109.836     173.539    -109.836     98.0831    70.1644      
1 1 1 47  1  14 o 0 15.9    12.9  ?     ?   56.4777   168.443      11.5862    168.443      41.173     -11.5572     
1 1 1 47  1  15 o 0 47.9    14.5  ?     ?   99.9954   -2.80445     149.718    -2.80445     55.8105    -2.80445     
1 1 1 47  1  16 o 0 184.5   16.9  ?     ?   357.468   -177.308     282.813    -177.308     80.2021    2.69212      
1 1 1 47  1  17 o 0 12      16.1  ?     ?   125.133   151.764      8.56213    151.764      118.92     -28.236      
1 1 1 47  1  18 o 0 39.8    21.8  ?     ?   208.505   -29.8415     50.0109    -29.8415     154.295    150.158      
1 1 1 47  1  19 o 0 12.6    26.2  ?     ?   87.9917   14.0606      58.6298    14.0606      25.3626    -165.939     
1 1 1 47  1  20 o 0 93.4    35    ?     ?   200.965   64.8391      196.452    64.8391      8.15924    64.8391      
1 1 1 47  1  21 < 0 -20.7   26.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 3  21 < 0 101.9   5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 3  20 o 0 30.4    4.1   ?     ?   86.2752   118.44       116.495    118.44       43.0788    118.44       
1 1 1 -47 3  19 o 0 345.5   8.8   ?     ?   334.401   178.698      516.489    178.698      225.279    178.698      
1 1 1 -47 3  18 o 0 39.5    4     ?     ?   168.707   164.233      98.3595    164.233      53.1234    -15.7666     
1 1 1 -47 3  17 o 0 21.1    3.1   ?     ?   32.4836   -15.3902     37.0328    -15.3902     6.57401    -15.3902     
1 1 1 -47 3  16 o 0 332.5   8.3   ?     ?   359.15    -95.6482     475.376    -95.6482     138.224    -95.6482     
1 1 1 -47 3  15 o 0 122.2   4     ?     ?   250.99    -49.233      239.759    -49.233      20.9233    -49.233      
1 1 1 -47 3  14 o 0 32.1    2.3   ?     ?   241.499   139.015      9.15588    139.015      201.197    -40.9852     
1 1 1 -47 3  13 o 0 46.1    2.8   ?     ?   195.111   128.288      91.6037    128.288      78.9457    -51.7123     
1 1 1 -47 3  12 o 0 365.6   9     ?     ?   330.46    -97.0732     531.434    -97.0732     233.159    -97.0732     
1 1 1 -47 3  11 o 0 267.1   5.9   ?     ?   422.132   -156.522     332.306    -156.522     51.1708    23.4776      
1 1 1 -47 3  10 o 0 109.1   3.6   ?     ?   297.164   -90.6774     163.153    -90.6774     113.04     89.3226      
1 1 1 -47 3  9  o 0 298.8   6.6   ?     ?   230.936   27.6432      527.903    27.6432      312.06     27.6432      
1 1 1 -47 3  8  o 0 196.6   4.8   ?     ?   202.066   93.5688      384.058    93.5688      190.841    93.5688      
1 1 1 -47 3  7  o 0 5.4     1.7   ?     ?   96.8505   -128.885     70.9773    51.1153      164.032    51.1153      
1 1 1 -47 3  6  o 0 126.5   3.6   ?     ?   170.207   -108.858     274.972    -108.858     110.711    -108.858     
1 1 1 -47 3  5  o 0 329.4   7     ?     ?   481.77    -116.242     303.389    -116.242     110.06     63.7579      
1 1 1 -47 3  4  o 0 491     10.1  ?     ?   345.394   7.6615       575.419    7.6615       277.91     7.6615       
1 1 1 -47 3  3  o 0 248.7   5.8   ?     ?   335.716   168.282      319.259    168.282      29.1166    168.282      
1 1 1 -47 3  2  o 0 44.2    2.6   ?     ?   331.013   101.754      59.5555    -78.246      346.494    -78.246      
1 1 1 -47 3  1  o 0 498.1   11.2  ?     ?   298.771   178.568      620.921    178.568      361.238    178.568      
1 1 1 47  3  0  o 0 617.9   13.2  ?     ?   525.513   -114.358     555.073    -114.358     95.3396    -114.358     
1 1 1 47  3  1  o 0 236.2   6.5   ?     ?   308.633   -60.9853     326.406    -60.9854     55.8913    -60.9854     
1 1 1 47  3  2  o 0 69.1    3.8   ?     ?   173.846   106.181      96.5435    106.181      56.0735    -73.8194     
1 1 1 47  3  3  o 0 282.8   7.2   ?     ?   314.997   104.065      383.999    104.065      107.116    104.065      
1 1 1 47  3  4  o 0 257.8   7.6   ?     ?   387.386   67.9133      297.733    67.9133      43.0963    -112.087     
1 1 1 47  3  5  o 0 253.3   7.7   ?     ?   363.237   57.1854      359.472    57.1854      1.57602    -122.815     
1 1 1 47  3  6  o 0 18.8    5.3   ?     ?   264.004   115.825      114.413    -64.1745     376.881    -64.1745     
1 1 1 47  3  7  o 0 165.4   7     ?     ?   485.66    64.1237      101.593    64.1237      381.152    -115.876     
1 1 1 47  3  8  o 0 107.9   7.2   ?     ?   201.543   46.6909      243.7      46.6909      46.9787    46.6909      
1 1 1 47  3  9  o 0 283     9.8   ?     ?   488.666   -179.789     300.615    -179.789     175.888    0.210578     
1 1 1 47  3  10 o 0 16.1    9.5   ?     ?   126.988   80.2729      14.8414    -99.7271     136.428    -99.7271     
1 1 1 47  3  11 o 0 142     10.9  ?     ?   270.624   13.6771      271.966    13.6771      13.3304    13.6771      
1 1 1 47  3  12 o 0 64.6    12.4  ?     ?   209.111   177.824      143.255    177.824      51.1723    -2.17644     
1 1 1 47  3  13 o 0 102.1   11.8  ?     ?   215.223   120.5        237.43     120.5        37.1089    120.5        
1 1 1 47  3  14 o 0 69.7    14.6  ?     ?   77.2684   0.567352     203.254    0.567352     131.562    0.567352     
1 1 1 47  3  15 o 0 34.2    12.1  ?     ?   96.102    72.6777      92.2891    72.6777      2.66412    72.6777      
1 1 1 47  3  16 o 0 31.5    12.2  ?     ?   109.391   26.7159      87.3685    26.7159      22.9316    -153.284     
1 1 1 47  3  17 o 0 116.7   20.4  ?     ?   172.591   48.3476      307.021    48.3476      132.468    48.3476      
1 1 1 47  3  18 o 0 -30.2   20.8  ?     ?   66.4577   44.0376      18.1648    -135.962     82.7993    -135.962     
1 1 1 47  3  19 o 0 6.7     25.5  ?     ?   23.8068   62.6218      28.5136    62.6218      6.25604    62.6218      
1 1 1 47  3  20 o 0 2.6     28.2  ?     ?   152.596   65.3469      22.2544    65.3469      119.921    -114.653     
1 1 1 -47 5  20 < 0 0.9     4.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 5  19 o 0 41.6    4.1   ?     ?   198.564   132.016      91.9283    132.016      75.3615    -47.9843     
1 1 1 -47 5  18 o 0 40.3    3.8   ?     ?   55.6381   119.552      135.136    119.552      87.172     119.552      
1 1 1 -47 5  17 o 0 90.6    4.2   ?     ?   127.935   -73.3498     267.943    -73.3498     154.242    -73.3498     
1 1 1 -47 5  16 o 0 30.9    3.1   ?     ?   114.261   -0.533216    93.4576    -0.533216    12.5732    179.467      
1 1 1 -47 5  15 o 0 130.5   4.6   ?     ?   173.292   -4.41851     319.861    -4.41851     158.888    -4.41851     
1 1 1 -47 5  14 o 0 208.5   5.9   ?     ?   141.069   -50.7807     458.944    -50.7807     337.254    -50.7807     
1 1 1 -47 5  13 o 0 6.2     2     ?     ?   148.706   52.7671      72.189     -127.233     200.324    -127.233     
1 1 1 -47 5  12 o 0 117.4   3.5   ?     ?   197.09    -49.8675     268.985    -49.8675     97.9393    -49.8675     
1 1 1 -47 5  11 o 0 121.2   3.4   ?     ?   270.327   -146.591     224.412    -146.591     10.8877    33.4089      
1 1 1 -47 5  10 f 1 38.6    2     ?     ?   192.929   -94.6206     57.4462    -94.6206     116.749    85.3794      
1 1 1 -47 5  9  o 0 176     4.3   ?     ?   298.325   170.053      296.845    170.053      27.2909    170.053      
1 1 1 -47 5  8  o 0 76.1    2.5   ?     ?   144.25    -179.804     184.842    -179.804     51.566     -179.804     
1 1 1 -47 5  7  o 0 81.7    2.7   ?     ?   269.741   -70.6734     121.125    -70.6734     129.352    109.327      
1 1 1 -47 5  6  o 0 5.8     1.4   ?     ?   107.241   -46.8941     67.7832    133.106      167.828    133.106      
1 1 1 -47 5  5  o 0 3.2     1.4   ?     ?   197.41    44.5923      163.533    -135.408     351.764    -135.408     
1 1 1 -47 5  4  o 0 80.9    3     ?     ?   141.533   -159.154     174.575    -159.154     39.1015    -159.154     
1 1 1 -47 5  3  o 0 1081.8  19.9  ?     ?   516.207   -171.758     989.948    -171.758     494.121    -171.758     
1 1 1 -47 5  2  o 0 124.3   4.3   ?     ?   414.476   2.88013      83.7176    2.88013      315.634    -177.12      
1 1 1 -47 5  1  o 0 14.8    2.3   ?     ?   114.56    0.797542     42.7298    -179.202     153.413    -179.202     
1 1 1 47  5  0  o 0 13.5    2.4   ?     ?   70.7384   175.714      28.3646    -4.28595     97.4113    -4.28595     
1 1 1 47  5  1  o 0 86.2    4.1   ?     ?   259.896   -104.19      128.434    -104.19      125.698    75.8101      
1 1 1 47  5  2  o 0 208.5   6.7   ?     ?   371.508   -152.511     277.693    -152.511     86.1041    27.4886      
1 1 1 47  5  3  o 0 89.6    4.7   ?     ?   309.164   -169.544     97.8482    -169.544     205.236    10.4557      
1 1 1 47  5  4  o 0 82.5    4.7   ?     ?   348.696   157.538      46.1863    157.538      295.914    -22.4625     
1 1 1 47  5  5  o 0 82      5.5   ?     ?   294.581   125.133      105.706    125.133      178.369    -54.8666     
1 1 1 47  5  6  o 0 3.7     4.8   ?     ?   117.595   -89.1216     83.1659    90.8784      196.569    90.8784      
1 1 1 47  5  7  o 0 160.7   7.1   ?     ?   171.222   -142.583     368.449    -142.583     203.393    -142.583     
1 1 1 47  5  8  o 0 37.4    7.1   ?     ?   90.1194   63.8796      89.8998    63.8796      4.54307    63.8796      
1 1 1 47  5  9  o 0 150.5   9.2   ?     ?   368.841   44.4902      201.783    44.4902      147.147    -135.51      
1 1 1 47  5  10 f 1 43.4    8.4   ?     ?   95.8804   110.998      124.767    110.998      36.0102    110.998      
1 1 1 47  5  11 o 0 40.2    10    ?     ?   106.726   108.941      111.798    108.941      13.7086    108.941      
1 1 1 47  5  12 o 0 3.9     9.8   ?     ?   97.2272   40.6212      37.0782    -139.379     126.552    -139.379     
1 1 1 47  5  13 o 0 22.3    12    ?     ?   22.7759   -136.033     17.785     -136.033     3.29643    43.9667      
1 1 1 47  5  14 o 0 16.1    13.6  ?     ?   155.514   -174.289     6.11566    5.71119      161.847    5.71119      
1 1 1 47  5  15 o 0 52.4    16.5  ?     ?   157.352   151.583      140.536    151.583      17.6164    -28.4174     
1 1 1 47  5  16 o 0 21.4    15.7  ?     ?   35.351    83.1737      38.3639    83.1737      4.17469    83.1737      
1 1 1 47  5  17 o 0 25.8    20.8  ?     ?   59.0118   103.969      76.2885    103.969      20.6662    103.969      
1 1 1 47  5  18 o 0 7.8     23.1  ?     ?   104.705   -88.3047     42.0092    -88.3047     54.9005    91.6953      
1 1 1 47  5  19 o 0 108.3   24.6  ?     ?   292.639   48.3867      184.652    48.3867      85.3201    -131.613     
1 1 1 -47 7  19 < 0 31.7    4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 7  18 o 0 105.7   5.1   ?     ?   246.772   31.794       220.134    31.794       15.4581    31.794       
1 1 1 -47 7  17 f 1 11.9    3.4   ?     ?   176.455   14.9994      24.2577    -165.001     172.465    -165.001     
1 1 1 -47 7  16 o 0 50.3    3.7   ?     ?   144.219   33.9494      152.545    33.9494      29.3062    33.9494      
1 1 1 -47 7  15 o 0 125.5   4.4   ?     ?   217.077   -43.0156     277.03     -43.0156     85.9089    -43.0156     
1 1 1 -47 7  14 o 0 174.9   4.9   ?     ?   215.109   55.8463      363.322    55.8463      165.691    55.8463      
1 1 1 -47 7  13 o 0 240.2   5.7   ?     ?   296.034   20.2311      398.676    20.2311      126.582    20.2311      
1 1 1 -47 7  12 o 0 323.6   7     ?     ?   422.369   -42.0259     413.579    -42.0259     35.8446    -42.0259     
1 1 1 -47 7  11 o 0 157.7   3.8   ?     ?   271.193   136.756      285.59     136.756      52.6262    136.756      
1 1 1 -47 7  10 o 0 297.9   7.3   ?     ?   417.935   93.8097      373.394    93.8097      15.1502    93.8097      
1 1 1 -47 7  9  o 0 76.9    5.4   ?     ?   179.104   -27.6998     187.954    -27.6998     33.4869    -27.6998     
1 1 1 -47 7  8  o 0 22.3    4.2   ?     ?   41.5489   -16.8514     25.2152    -16.8514     10.6876    163.149      
1 1 1 -47 7  7  o 0 323.8   11.1  ?     ?   381.438   179.722      442.546    179.722      111.202    179.722      
1 1 1 -47 7  6  o 0 276.2   14    ?     ?   402.479   167.61       354.753    167.61       5.53687    -12.3903     
1 1 1 -47 7  5  o 0 285.9   13.4  ?     ?   447.496   168.103      330.951    168.103      71.4167    -11.8972     
1 1 1 -47 7  4  f 1 68.7    8     ?     ?   305.789   124.006      65.354     124.006      212.125    -55.9945     
1 1 1 -47 7  3  o 0 175.2   7.1   ?     ?   434.323   69.4841      181.288    69.4841      212.233    -110.516     
1 1 1 -47 7  2  o 0 155.6   8.8   ?     ?   210.965   168.498      330.013    168.498      138.249    168.498      
1 1 1 -47 7  1  o 0 502.5   11.4  ?     ?   553.288   157.249      480.601    157.249      32.3262    -22.751      
1 1 1 47  7  0  f 1 52.1    2.9   ?     ?   121.518   161.054      121.436    161.054      6.49463    161.054      
1 1 1 47  7  1  o 0 24      2.8   ?     ?   199.293   154.507      20.3286    -25.4934     208.174    -25.4934     
1 1 1 47  7  2  o 0 102.3   4.1   ?     ?   213.46    -171.504     226.928    -171.504     28.8416    -171.504     
1 1 1 47  7  3  o 0 58.9    4     ?     ?   133.262   -174.311     159.971    -174.311     36.1945    -174.311     
1 1 1 47  7  4  f 1 69.3    5     ?     ?   155.221   -81.7933     180.842    -81.7933     35.8503    -81.7933     
1 1 1 47  7  5  o 0 58.1    6.8   ?     ?   152.434   -80.3156     149.032    -80.3156     7.34954    -80.3156     
1 1 1 47  7  6  o 0 37.1    6.7   ?     ?   74.9024   175.014      94.1716    175.014      26.3009    175.014      
1 1 1 47  7  7  o 0 150.5   7.4   ?     ?   250.876   110.562      306.141    110.562      78.9595    110.562      
1 1 1 47  7  8  o 0 13.4    7     ?     ?   103.364   -53.1302     11.9621    126.87       105.467    126.87       
1 1 1 47  7  9  o 0 107.8   8.7   ?     ?   168.575   76.7478      277.952    76.7478      125.105    76.7478      
1 1 1 47  7  10 o 0 26.9    8.3   ?     ?   92.9402   144.899      59.4148    144.899      24.6951    -35.1008     
1 1 1 47  7  11 o 0 189.4   10.9  ?     ?   323.485   -81.0838     312.15     -81.0838     17.5172    -81.0838     
1 1 1 47  7  12 o 0 15.8    13.4  ?     ?   88.8554   102.861      22.7031    102.861      64.9082    -77.1392     
1 1 1 47  7  13 o 0 52.2    14.9  ?     ?   124.461   -69.2965     167.121    -69.2965     43.8755    -69.2965     
1 1 1 47  7  14 o 0 -9.9    14.9  ?     ?   93.7992   -58.2958     32.0141    121.704      124.562    121.704      
1 1 1 47  7  15 o 0 16.8    17.3  ?     ?   23.8545   -98.6257     19.7319    -98.6257     2.91969    81.3743      
1 1 1 47  7  16 o 0 6.7     17.7  ?     ?   107.86    -6.69677     14.3314    -6.69677     85.5047    173.303      
1 1 1 47  7  17 f 1 48.4    20.9  ?     ?   178.721   84.9573      110.937    84.9573      52.7333    -95.0427     
1 1 1 47  7  18 < 0 -3.8    23.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 9  17 < 0 61.3    4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 9  16 < 0 102.8   4.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 9  15 o 0 1.6     2.7   ?     ?   15.5052   -36.1714     7.00809    143.829      19.7735    143.829      
1 1 1 -47 9  14 o 0 95.3    3.9   ?     ?   218.086   157.928      217.85     157.928      37.1514    157.928      
1 1 1 -47 9  13 o 0 42.5    2.4   ?     ?   127.852   178.37       135.937    178.37       27.7238    178.37       
1 1 1 -47 9  12 o 0 5.7     1.6   ?     ?   61.6402   40.4228      19.972     -139.577     73.6679    -139.577     
1 1 1 -47 9  11 f 1 167.2   12.6  ?     ?   212.836   42.351       344.343    42.351       150.084    42.351       
1 1 1 -47 9  10 f 1 17.7    5.5   ?     ?   182.357   53.2854      13.1517    -126.715     180.729    -126.715     
1 1 1 -47 9  9  o 0 95.2    6.6   ?     ?   199.835   136.678      220.09     136.678      37.592     136.678      
1 1 1 -47 9  8  o 0 184.2   8.3   ?     ?   304.802   39.7125      311.855    39.7125      41.4209    39.7125      
1 1 1 -47 9  7  o 0 59.2    5.2   ?     ?   219.262   -47.0125     113.128    -47.0125     73.4514    132.987      
1 1 1 -47 9  6  o 0 101.5   6.3   ?     ?   254.384   -16.9459     190.029    -16.9459     27.5343    163.054      
1 1 1 -47 9  5  o 0 33.4    5.5   ?     ?   102.009   -16.9481     83.188     -16.9481     3.6983     163.052      
1 1 1 -47 9  4  o 0 128.8   8.3   ?     ?   206.78    62.3214      279.778    62.3214      102.912    62.3214      
1 1 1 -47 9  3  o 0 336.1   11.4  ?     ?   370.481   -174.51      458.392    -174.51      140.306    -174.51      
1 1 1 -47 9  2  o 0 281.2   11.2  ?     ?   366.046   -159.659     395.286    -159.659     79.9501    -159.659     
1 1 1 -47 9  1  o 0 51.9    2.8   ?     ?   270.754   -155.462     54.9264    -155.462     179.008    24.5378      
1 1 1 47  9  0  o 0 120.1   4.2   ?     ?   244.989   -166.5       243.84     -166.5       27.7501    -166.5       
1 1 1 47  9  1  o 0 68.3    4     ?     ?   207.012   -79.5142     151.242    -79.5142     31.6064    100.486      
1 1 1 47  9  2  o 0 16.2    4     ?     ?   70.2505   -73.5339     12.9778    -73.5339     49.1368    106.466      
1 1 1 47  9  3  o 0 29.5    4.6   ?     ?   97.2575   -35.4464     70.9492    -35.4464     15.1016    144.554      
1 1 1 47  9  4  o 0 53.3    5.7   ?     ?   271.497   -20.4795     59.3185    -20.4795     180.962    159.52       
1 1 1 47  9  5  o 0 23.8    6.6   ?     ?   25.2329   -141.286     24.8913    -141.286     2.36643    -141.286     
1 1 1 47  9  6  o 0 25.6    7.3   ?     ?   136.505   31.6744      49.8664    31.6744      71.9264    -148.326     
1 1 1 47  9  7  o 0 13.6    7.9   ?     ?   102.709   -178.182     3.15248    1.81848      94.7082    1.81848      
1 1 1 47  9  8  o 0 5.6     8.8   ?     ?   111.93    140.75       36.932     -39.25       145.097    -39.25       
1 1 1 47  9  9  o 0 53.2    10.5  ?     ?   196.465   37.4972      116.859    37.4972      72.6652    -142.503     
1 1 1 47  9  10 f 1 25.2    9.9   ?     ?   67.043    -81.934      68.6259    -81.934      3.27339    -81.934      
1 1 1 47  9  11 f 1 50.7    13.7  ?     ?   146.966   72.0277      147.322    72.0277      9.24591    72.0277      
1 1 1 47  9  12 o 0 21.7    13.8  ?     ?   157.274   59.2526      19.8862    59.2526      126.672    -120.747     
1 1 1 47  9  13 o 0 111.3   17    ?     ?   304.713   45.8723      185.025    45.8723      92.0421    -134.128     
1 1 1 47  9  14 o 0 211.6   20    ?     ?   268.405   49.6959      403.235    49.6959      163.303    49.6959      
1 1 1 47  9  15 o 0 67.9    21.5  ?     ?   207.893   130.968      145.31     130.968      40.1409    -49.0319     
1 1 1 47  9  16 < 0 153.5   23.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 11 13 < 1 116.7   4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 11 12 o 0 22.4    7.7   ?     ?   135.589   167.751      55.9903    167.751      53.6173    -12.2488     
1 1 1 -47 11 11 o 0 13.1    6.8   ?     ?   59.6915   -52.8619     25.9359    -52.8619     22.5722    127.138      
1 1 1 -47 11 10 o 0 134.3   7.9   ?     ?   188.445   28.0567      312.283    28.0567      158.06     28.0567      
1 1 1 -47 11 9  o 0 206.7   9.9   ?     ?   266.407   89.3977      369.074    89.3977      146.707    89.3977      
1 1 1 -47 11 8  o 0 87.2    8.1   ?     ?   104.726   158.147      265.248    158.147      177.295    158.147      
1 1 1 -47 11 7  o 0 35.8    7.4   ?     ?   127.538   -143.007     105.025    -143.007     4.99155    36.9932      
1 1 1 -47 11 6  o 0 -6.6    6.3   ?     ?   63.8303   76.0472      39.2432    -103.953     94.594     -103.953     
1 1 1 -47 11 5  o 0 54.9    8     ?     ?   296.133   109.371      35.3814    109.371      231.641    -70.6293     
1 1 1 -47 11 4  o 0 17.5    8.6   ?     ?   107.903   120.593      24.1064    120.593      73.6157    -59.4075     
1 1 1 -47 11 3  o 0 130.8   10.2  ?     ?   180.394   6.5997       306.568    6.5997       142.551    6.5997       
1 1 1 -47 11 2  f 1 24.3    7.6   ?     ?   157.08    -119.958     35.9226    -119.958     108.136    60.0421      
1 1 1 -47 11 1  f 1 19.9    3.5   ?     ?   107.3     77.6299      44.4245    77.6299      54.2848    -102.37      
1 1 1 47  11 0  o 0 111.7   4.5   ?     ?   202.546   -100.381     261.976    -100.381     71.5278    -100.381     
1 1 1 47  11 1  f 1 35.9    4.3   ?     ?   133.169   -88.6328     104.188    -88.6328     21.8191    91.3672      
1 1 1 47  11 2  f 1 54.9    5.3   ?     ?   47.3161   82.8299      165.116    82.8299      120.309    82.8299      
1 1 1 47  11 3  o 0 60.1    6.5   ?     ?   86.8886   34.7722      204.329    34.7722      122.436    34.7722      
1 1 1 47  11 4  o 0 29.2    6.8   ?     ?   199.298   -106.768     28.3809    -106.768     159.459    73.2324      
1 1 1 47  11 5  o 0 3.2     7.2   ?     ?   13.5409   -138.897     4.03282    41.1034      16.3606    41.1034      
1 1 1 47  11 6  o 0 66      9     ?     ?   148.907   -175.682     195.715    -175.682     60.2563    -175.682     
1 1 1 47  11 7  o 0 10.8    10.9  ?     ?   39.5348   -100.804     8.6608     -100.804     27.2597    79.1956      
1 1 1 47  11 8  o 0 102.2   12.8  ?     ?   130.191   71.6441      299.354    71.6441      183.72     71.6441      
1 1 1 47  11 9  o 0 106.2   14.7  ?     ?   262.852   85.8511      211.098    85.8511      18.8467    -94.1489     
1 1 1 47  11 10 o 0 154.2   15.7  ?     ?   321.18    64.7384      257.541    64.7384      22.7336    -115.262     
1 1 1 47  11 11 o 0 1.4     15.8  ?     ?   78.945    58.856       22.4651    58.856       46.3795    -121.144     
1 1 1 47  11 12 < 0 2.6     16.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 47  11 13 < 1 1.2     26.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 13 8  < 0 -5.7    7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 13 7  < 0 67.5    8.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 13 6  < 0 72.5    9.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -47 13 5  o 0 290.9   15.3  ?     ?   437.873   -43.0924     339.692    -43.0924     11.8806    136.908      
1 1 1 -47 13 4  o 0 197.8   12.5  ?     ?   260.125   -113.127     357.228    -113.127     147.42     -113.127     
1 1 1 -47 13 3  o 0 98.6    10.3  ?     ?   177.114   -94.8991     248.651    -94.8991     105.21     -94.8991     
1 1 1 -47 13 2  o 0 28      3.4   ?     ?   108.106   -168.235     103.297    -168.235     15.4235    -168.235     
1 1 1 -47 13 1  o 0 47.7    4     ?     ?   220.674   98.7054      95.0155    98.7054      84.9381    -81.2946     
1 1 1 47  13 0  o 0 13.1    4.7   ?     ?   52.5445   166.729      39.7621    166.729      4.55785    -13.2708     
1 1 1 47  13 1  o 0 112.2   6.5   ?     ?   212.595   -102.44      263.88     -102.44      84.3932    -102.44      
1 1 1 47  13 2  o 0 0       6.4   ?     ?   93.2758   139.909      29.6358    -40.0908     108.428    -40.0908     
1 1 1 47  13 3  o 0 138.8   9.4   ?     ?   237.679   95.8448      294.444    95.8448      93.644     95.8448      
1 1 1 47  13 4  o 0 11.3    8.3   ?     ?   159.422   -114.723     13.8816    65.2766      148.531    65.2766      
1 1 1 47  13 5  < 0 16.8    9.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 47  13 6  < 0 78.8    12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 47  13 7  < 0 18.3    13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 0  22 < 0 -2.4    5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 0  21 o 0 3.5     5.1   ?     ?   50.577    0            10.4327    0            32.6744    180          
1 1 1 -48 0  20 o 0 17.7    4.8   ?     ?   65.6258   0            57.7803    0            1.41018    0            
1 1 1 -48 0  19 o 0 10.6    4.4   ?     ?   26.849    180          12.7608    180          10.8311    8.26687e-15  
1 1 1 -48 0  18 o 0 37.2    4.6   ?     ?   153.375   180          132.858    180          6.04362    1.5425e-13   
1 1 1 -48 0  17 f 1 97.6    5.5   ?     ?   309.721   180          223.959    180          68.158     2.3056e-14   
1 1 1 -48 0  16 o 0 25.2    4     ?     ?   161.551   0            102.331    0            45.2854    180          
1 1 1 -48 0  15 o 0 -0.5    3.7   ?     ?   57.8559   0            2.6227     0            48.1978    180          
1 1 1 -48 0  14 o 0 56.9    3.9   ?     ?   126.355   0            152.894    0            42.0536    0            
1 1 1 -48 0  13 o 0 145.7   5.7   ?     ?   131.723   180          265.857    180          149.939    180          
1 1 1 -48 0  12 f 1 65      3.9   ?     ?   105.711   180          152.307    180          55.7857    180          
1 1 1 -48 0  11 o 0 113.2   5.2   ?     ?   83.4997   180          205.465    180          129.15     180          
1 1 1 -48 0  10 o 0 246.6   7.4   ?     ?   498.419   0            357.026    0            108.899    180          
1 1 1 -48 0  9  o 0 38.9    3.2   ?     ?   173.61    0            122.333    0            40.8233    180          
1 1 1 -48 0  8  o 0 9.8     2.8   ?     ?   61.5833   0            11.9267    0            47.2684    180          
1 1 1 -48 0  7  o 0 20.3    2.7   ?     ?   238.813   0            78.896     0            151.707    180          
1 1 1 -48 0  6  o 0 1.2     2.3   ?     ?   45.7004   0            1.0958     0            43.2201    180          
1 1 1 -48 0  5  o 0 6.1     2.7   ?     ?   73.8906   180          5.30267    180          58.4034    6.37074e-16  
1 1 1 -48 0  4  o 0 204.1   7.1   ?     ?   157.003   180          274.027    180          138.182    180          
1 1 1 -48 0  3  o 0 92.2    5.4   ?     ?   291.932   0            192.78     0            60.6295    180          
1 1 1 -48 0  2  o 0 50.2    3.5   ?     ?   256.567   0            127.697    0            95.6673    180          
1 1 1 -48 0  1  f 1 76.8    5.1   ?     ?   33.2726   180          38.1754    180          8.98323    180          
1 1 1 48  0  0  o 0 947.7   26    ?     ?   520.046   -7.74571e-14 645.525    0            190.535    1.84964e-13  
1 1 1 48  0  1  f 1 739.2   20.5  ?     ?   589.26    0            571.326    0            52.0856    0            
1 1 1 48  0  2  o 0 -1.3    4.7   ?     ?   22.3292   0            0.448187   0            19.1604    180          
1 1 1 48  0  3  o 0 212.4   9     ?     ?   330.235   0            306.531    0            16.1326    0            
1 1 1 48  0  4  o 0 77.1    6.9   ?     ?   198.166   0            156.905    0            17.5378    180          
1 1 1 48  0  5  o 0 939.5   27.2  ?     ?   688.877   0            646.936    0            40.1056    0            
1 1 1 48  0  6  o 0 98.7    8.6   ?     ?   318.989   0            234.248    0            83.1306    180          
1 1 1 48  0  7  o 0 7.9     8.4   ?     ?   153.645   180          18.1259    180          134.737    9.43941e-16  
1 1 1 48  0  8  o 0 18.2    9.9   ?     ?   118.049   0            32.5907    0            84.8074    180          
1 1 1 48  0  9  o 0 13.5    9.8   ?     ?   13.6532   180          3.48239    180          9.84741    2.48136e-15  
1 1 1 48  0  10 o 0 56.1    11.4  ?     ?   220.529   180          167.002    180          48.037     2.43937e-14  
1 1 1 48  0  11 o 0 431.1   23.9  ?     ?   495.663   180          490.15     180          15.6863    180          
1 1 1 48  0  12 f 1 887.3   32    ?     ?   762.089   180          702.318    180          11.1924    4.40295e-13  
1 1 1 48  0  13 o 0 74.5    17.2  ?     ?   136       180          186.625    180          60.261     180          
1 1 1 48  0  14 o 0 94.3    20    ?     ?   179.756   0            220        0            52.8384    0            
1 1 1 48  0  15 o 0 81.3    25.9  ?     ?   198.202   180          193.602    180          8.29248    180          
1 1 1 48  0  16 o 0 117.4   23.6  ?     ?   276.201   180          256.958    180          22.3146    8.07989e-14  
1 1 1 48  0  17 f 1 10.8    30.8  ?     ?   99.7031   180          54.3346    180          47.3316    8.05487e-15  
1 1 1 48  0  18 o 0 4.9     35    ?     ?   87.2467   0            47.3907    0            37.7482    180          
1 1 1 48  0  19 o 0 52.2    32.7  ?     ?   5.91335   180          12.1454    180          6.59649    180          
1 1 1 48  0  20 o 0 2.6     29.7  ?     ?   87.2583   180          52.1416    180          29.4833    1.24091e-14  
1 1 1 -48 2  21 < 0 14.7    4.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 2  20 o 0 85.4    4.5   ?     ?   242.54    163.619      181.831    163.619      24.7055    -16.3808     
1 1 1 -48 2  19 o 0 38.1    4.1   ?     ?   158.001   98.0575      105.216    98.0575      32.4591    -81.9425     
1 1 1 -48 2  18 o 0 158.2   5.1   ?     ?   249.294   21.2964      318.083    21.2964      94.1336    21.2964      
1 1 1 -48 2  17 o 0 78.5    3.7   ?     ?   156.04    87.2523      220.112    87.2523      73.7435    87.2523      
1 1 1 -48 2  16 o 0 192     5.7   ?     ?   296.326   -134.552     332.343    -134.552     54.0923    -134.552     
1 1 1 -48 2  15 o 0 79.4    3.1   ?     ?   277.555   -155.478     125.228    -155.478     116.809    24.5215      
1 1 1 -48 2  14 f 1 33.9    2.8   ?     ?   181.031   137.184      56.7311    137.184      101.774    -42.8159     
1 1 1 -48 2  13 o 0 72.9    2.9   ?     ?   89.4548   65.2747      208.135    65.2747      129.944    65.2747      
1 1 1 -48 2  12 o 0 297.4   6.7   ?     ?   331.869   -31.3515     456.403    -31.3515     164.35     -31.3515     
1 1 1 -48 2  11 o 0 11.1    2.3   ?     ?   156.017   -126.437     52.9582    53.563       194.66     53.563       
1 1 1 -48 2  10 o 0 102.3   3.4   ?     ?   170.89    2.29135      238.467    2.29135      79.6826    2.29135      
1 1 1 -48 2  9  o 0 36.3    2.1   ?     ?   174.8     74.1058      46.8964    74.1058      116.422    -105.894     
1 1 1 -48 2  8  f 1 33.5    2.1   ?     ?   201.137   110.117      0.598454   -69.8833     193.836    -69.8833     
1 1 1 -48 2  7  o 0 210.1   4.9   ?     ?   228.755   36.8902      389.927    36.8902      170.241    36.8902      
1 1 1 -48 2  6  o 0 76      2.7   ?     ?   158.601   -23.3884     158.911    -23.3884     5.92891    -23.3884     
1 1 1 -48 2  5  o 0 192.5   4.8   ?     ?   147.168   -49.1218     408.182    -49.1218     265.657    -49.1218     
1 1 1 -48 2  4  f 1 79.9    2.8   ?     ?   101.798   -80.804      114.606    -80.804      26.5194    -80.804      
1 1 1 -48 2  3  o 0 283.1   6.6   ?     ?   405.432   -96.6825     310.508    -96.6825     39.6849    83.3175      
1 1 1 -48 2  2  o 0 41.6    2.6   ?     ?   119.837   -113.535     26.5684    -113.535     77.2525    66.4645      
1 1 1 -48 2  1  o 0 290.4   6.9   ?     ?   367.844   91.3948      350.07     91.3948      30.5317    91.3948      
1 1 1 48  2  0  o 0 238.5   6.2   ?     ?   347.322   -147.689     300.253    -147.689     3.03741    32.3107      
1 1 1 48  2  1  o 0 121.8   5     ?     ?   283.303   -124.332     160.083    -124.332     87.7912    55.6682      
1 1 1 48  2  2  o 0 353.9   10.3  ?     ?   474.45    159.435      343.443    159.435      72.3589    -20.565      
1 1 1 48  2  3  o 0 103.7   4.5   ?     ?   396.712   50.202       41.781     50.202       306.354    -129.798     
1 1 1 48  2  4  f 1 237.1   6.7   ?     ?   425.386   48.2092      237.99     48.2092      137.601    -131.791     
1 1 1 48  2  5  o 0 346.4   9.8   ?     ?   444.037   53.4089      413.272    53.4089      27.4191    -126.591     
1 1 1 48  2  6  o 0 21.3    5     ?     ?   100.602   32.5527      12.6495    -147.447     112.521    -147.447     
1 1 1 48  2  7  o 0 103.9   6.8   ?     ?   200.49    -99.7918     215.332    -99.7918     16.319     -99.7918     
1 1 1 48  2  8  f 1 409.7   12.1  ?     ?   446.719   -164.69      499.403    -164.69      61.6978    -164.69      
1 1 1 48  2  9  o 0 202.1   9.1   ?     ?   361.724   -172.402     292.874    -172.402     59.4188    7.59835      
1 1 1 48  2  10 o 0 61.9    10.3  ?     ?   143.008   -22.786      168.497    -22.786      31.7251    -22.786      
1 1 1 48  2  11 o 0 472.1   15.2  ?     ?   463.186   -83.8749     564.836    -83.8749     122.62     -83.8749     
1 1 1 48  2  12 o 0 51.3    11.6  ?     ?   85.6243   -94.0077     149.013    -94.0077     69.4738    -94.0077     
1 1 1 48  2  13 o 0 80.6    12.6  ?     ?   158.804   -105.723     222.028    -105.723     74.3385    -105.723     
1 1 1 48  2  14 f 1 155.3   14.9  ?     ?   79.75     -42.5914     417.57     -42.5914     342.595    -42.5914     
1 1 1 48  2  15 o 0 66.5    15    ?     ?   160.536   79.1134      190.546    79.1134      33.671     79.1134      
1 1 1 48  2  16 o 0 98.8    20.2  ?     ?   207.701   131.633      234.877    131.633      25.5404    131.633      
1 1 1 48  2  17 o 0 51.4    21.6  ?     ?   151.816   -11.1477     128.791    -11.1477     24.7052    168.852      
1 1 1 48  2  18 o 0 -0.3    15.2  ?     ?   68.5082   -49.305      2.12602    -49.305      63.1038    130.695      
1 1 1 48  2  19 o 0 8.1     14.7  ?     ?   82.1535   99.8203      25.3775    99.8203      51.4296    -80.1797     
1 1 1 48  2  20 o 0 -4.8    17.9  ?     ?   112.113   10.8792      5.27784    10.8792      99.1955    -169.121     
1 1 1 48  2  21 < 0 23.8    27.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 4  21 < 0 55.6    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 4  20 o 0 -4.7    4     ?     ?   36.5569   118.025      21.8543    -61.9745     52.5467    -61.9745     
1 1 1 -48 4  19 o 0 41      4     ?     ?   93.247    -116.846     154.308    -116.846     75.3962    -116.846     
1 1 1 -48 4  18 o 0 1.9     2.9   ?     ?   88.8309   -55.6421     51.848     124.358      128.76     124.358      
1 1 1 -48 4  17 o 0 216     6     ?     ?   241.419   -58.7641     416.168    -58.7641     200.702    -58.7641     
1 1 1 -48 4  16 o 0 11.2    2.7   ?     ?   137.233   -18.4118     20.7214    161.588      148.593    161.588      
1 1 1 -48 4  15 f 1 21.9    2.7   ?     ?   161.167   23.069       21.7078    23.069       129.374    -156.931     
1 1 1 -48 4  14 o 0 26.6    2.3   ?     ?   240.386   110.16       10.8702    -69.8401     219.042    -69.8401     
1 1 1 -48 4  13 o 0 191.9   4.9   ?     ?   340.35    157.276      291.342    157.276      3.03358    -22.7236     
1 1 1 -48 4  12 o 0 533.7   10.4  ?     ?   460.24    -147.105     602.205    -147.105     202.821    -147.105     
1 1 1 -48 4  11 o 0 360     7.6   ?     ?   518.405   -151.342     374.393    -151.342     78.4535    28.6575      
1 1 1 -48 4  10 o 0 61.2    2.5   ?     ?   161.026   88.0997      150.35     88.0997      5.20038    88.0997      
1 1 1 -48 4  9  o 0 112     3.9   ?     ?   274.036   79.549       196.773    79.549       51.6766    -100.451     
1 1 1 -48 4  8  o 0 302.3   6.6   ?     ?   375.398   -159.645     410.675    -159.645     62.6839    -159.645     
1 1 1 -48 4  7  o 0 258.8   6.2   ?     ?   445.332   -98.7533     292.715    -98.7533     122.159    81.2467      
1 1 1 -48 4  6  o 0 425.5   9.2   ?     ?   594.28    -28.6666     366.836    -28.6666     189.338    151.333      
1 1 1 -48 4  5  o 0 147.1   4.2   ?     ?   216.342   -38.9892     287.785    -38.9892     80.852     -38.9892     
1 1 1 -48 4  4  o 0 42.6    2.3   ?     ?   112.623   -11.1641     61.4573    -11.1641     46.6798    168.836      
1 1 1 -48 4  3  o 0 301     7.1   ?     ?   568.725   172.042      229.343    172.042      318.62     -7.95849     
1 1 1 -48 4  2  o 0 109.8   3.8   ?     ?   259.506   176.664      183.055    176.664      67.753     -3.33575     
1 1 1 -48 4  1  o 0 70.3    3.1   ?     ?   225.858   -38.2984     109.154    -38.2984     109.734    141.702      
1 1 1 48  4  0  o 0 450.9   9.9   ?     ?   407.619   -110.14      562.845    -110.14      164.354    -110.14      
1 1 1 48  4  1  o 0 329.3   7.9   ?     ?   291.436   -121.062     520.312    -121.062     234.871    -121.062     
1 1 1 48  4  2  o 0 940.9   18.8  ?     ?   638.107   -157.976     792.179    -157.976     166.233    -157.976     
1 1 1 48  4  3  o 0 126.6   5.1   ?     ?   243.398   144.494      234.695    144.494      4.35278    -35.5061     
1 1 1 48  4  4  o 0 471.9   10.8  ?     ?   441.242   130.773      558.188    130.773      124.457    130.773      
1 1 1 48  4  5  o 0 123.8   5.6   ?     ?   131.123   81.4969      283.793    81.4969      154.837    81.4969      
1 1 1 48  4  6  o 0 6.3     5.5   ?     ?   76.4658   -121.986     45.7811    58.0139      119.68     58.0139      
1 1 1 48  4  7  o 0 -10.9   6.5   ?     ?   210.078   108.285      179.148    -71.7146     382.121    -71.7146     
1 1 1 48  4  8  o 0 202.7   8.5   ?     ?   345.958   77.341       315.77     77.341       12.6881    -102.659     
1 1 1 48  4  9  o 0 16      8     ?     ?   106.588   -94.9291     8.77479    85.0709      109.863    85.0709      
1 1 1 48  4  10 o 0 19.6    8.9   ?     ?   29.1494   50.5808      11.9128    50.5808      15.0042    -129.419     
1 1 1 48  4  11 o 0 6.5     9.6   ?     ?   75.2786   13.7899      22.9065    -166.21      92.2868    -166.21      
1 1 1 48  4  12 o 0 15.5    11.3  ?     ?   33.4503   -50.8138     6.52518    -50.8138     24.3478    129.186      
1 1 1 48  4  13 o 0 129.1   13.7  ?     ?   312.734   126.631      214.203    126.631      76.156     -53.3694     
1 1 1 48  4  14 o 0 74      13.2  ?     ?   208.995   82.5678      177.048    82.5678      25.7319    -97.4322     
1 1 1 48  4  15 f 1 21.2    14.4  ?     ?   218.573   -14.014      34.905     165.986      254.815    165.986      
1 1 1 48  4  16 o 0 49.5    19.4  ?     ?   94.6654   34.717       158.233    34.717       63.1535    34.717       
1 1 1 48  4  17 o 0 27.8    19.5  ?     ?   158.075   -151.759     41.6744    -151.759     111.056    28.2413      
1 1 1 48  4  18 o 0 25.9    22.3  ?     ?   226.034   -51.116      1.09282    128.884      211.107    128.884      
1 1 1 48  4  19 o 0 20.8    26.1  ?     ?   172.724   31.5034      34.7429    31.5034      125.244    -148.497     
1 1 1 -48 6  19 < 0 167.9   5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 6  18 o 0 43.4    3.8   ?     ?   199.463   -44.821      100.094    -44.821      66.7254    135.179      
1 1 1 -48 6  17 o 0 164.5   5     ?     ?   209.368   1.24529      355.942    1.24529      177.218    1.24529      
1 1 1 -48 6  16 o 0 119.7   5.3   ?     ?   164.904   -14.4866     303.716    -14.4866     158.631    -14.4866     
1 1 1 -48 6  15 o 0 33.8    2.8   ?     ?   112.568   -56.972      104.903    -56.972      1.51995    -56.972      
1 1 1 -48 6  14 o 0 23.7    2.6   ?     ?   89.0093   51.7238      60.9084    51.7238      20.9007    -128.276     
1 1 1 -48 6  13 o 0 67.8    2.7   ?     ?   145.632   -22.3948     194.465    -22.3948     59.567     -22.3948     
1 1 1 -48 6  12 o 0 67.1    2.6   ?     ?   131.973   -32.4746     190.923    -32.4746     77.4794    -32.4746     
1 1 1 -48 6  11 o 0 85.7    2.9   ?     ?   225.498   81.0503      177.52     81.0503      15.9651    -98.9497     
1 1 1 -48 6  10 o 0 71.6    2.5   ?     ?   265.914   -60.1286     113.805    -60.1286     115.839    119.871      
1 1 1 -48 6  9  o 0 66.5    2.2   ?     ?   227.166   -131.484     129.467    -131.484     67.1619    48.516       
1 1 1 -48 6  8  f 1 25.5    2     ?     ?   307.091   -9.46551     69.7665    170.534      338.447    170.534      
1 1 1 -48 6  7  o 0 156.7   4.7   ?     ?   354.02    -16.0683     215.743    -16.0683     101.926    163.932      
1 1 1 -48 6  6  o 0 156.1   6.4   ?     ?   273.82    103.965      281.009    103.965      34.1271    103.965      
1 1 1 -48 6  5  o 0 236.3   8.2   ?     ?   313.534   83.0957      379.117    83.0957      95.1876    83.0957      
1 1 1 -48 6  4  o 0 43.1    2.2   ?     ?   259.179   -155.64      16.2592    -155.641     223.388    24.3595      
1 1 1 -48 6  3  o 0 298.6   6.8   ?     ?   279.333   164.915      486.407    164.915      227.194    164.915      
1 1 1 -48 6  2  f 1 35.5    2.1   ?     ?   106.609   -33.7113     63.083     -33.7113     36.6751    146.289      
1 1 1 -48 6  1  o 0 28.6    2.4   ?     ?   122.317   125.838      34.4982    125.838      79.6958    -54.1624     
1 1 1 48  6  0  o 0 67.3    3.2   ?     ?   35.975    48.4068      91.7295    48.4068      57.701     48.4068      
1 1 1 48  6  1  o 0 238.5   6.7   ?     ?   276.926   -121.373     413.772    -121.373     151.379    -121.373     
1 1 1 48  6  2  f 1 13.9    3.2   ?     ?   11.1347   -78.8147     2.05749    101.185      12.6767    101.185      
1 1 1 48  6  3  o 0 34.8    3.7   ?     ?   102.713   65.5455      61.4286    65.5455      36.128     -114.455     
1 1 1 48  6  4  o 0 16.5    3.9   ?     ?   118.942   163.626      5.16064    -16.3736     116.32     -16.3736     
1 1 1 48  6  5  o 0 20.9    4.3   ?     ?   169.375   -152.617     4.33793    27.3832      162.677    27.3832      
1 1 1 48  6  6  o 0 83.5    6     ?     ?   198.867   -178.898     193.193    -178.898     7.30002    -178.898     
1 1 1 48  6  7  o 0 110.2   6.8   ?     ?   207.582   162.864      250.085    162.864      56.1383    162.864      
1 1 1 48  6  8  f 1 -0.1    6.8   ?     ?   139.069   -128.252     86.185     51.748       213.422    51.748       
1 1 1 48  6  9  o 0 139.6   9.1   ?     ?   169.624   46.548       344.674    46.548       190.475    46.548       
1 1 1 48  6  10 o 0 31.9    8.2   ?     ?   153.316   97.2204      65.1485    97.2205      74.5099    -82.7795     
1 1 1 48  6  11 o 0 9.6     9.8   ?     ?   101.912   97.0866      15.9773    -82.9134     109.423    -82.9134     
1 1 1 48  6  12 o 0 215.9   13    ?     ?   346.094   122.027      335.839    122.027      19.316     122.027      
1 1 1 48  6  13 o 0 27.4    12.1  ?     ?   114.369   116.706      64.8959    116.706      48.3057    -63.2936     
1 1 1 48  6  14 o 0 5.4     15.4  ?     ?   46.6346   120.953      8.79712    120.953      37.5477    -59.047      
1 1 1 48  6  15 o 0 1       24.7  ?     ?   95.1527   82.9156      27.8128    82.9156      63.2104    -97.0844     
1 1 1 48  6  16 o 0 83.3    18.8  ?     ?   148.362   -15.0296     247.235    -15.0296     108.869    -15.0296     
1 1 1 48  6  17 o 0 43.6    22.6  ?     ?   99.8712   20.6915      140.007    20.6915      48.5134    20.6915      
1 1 1 48  6  18 o 0 5.1     26.6  ?     ?   70.9759   14.8398      64.7738    14.8398      0.0589236  -165.16      
1 1 1 48  6  19 < 0 -5.5    26.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 8  17 < 1 5.7     3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 8  16 o 0 67.1    3.7   ?     ?   170.386   -110.717     188.464    -110.717     47.7491    -110.717     
1 1 1 -48 8  15 o 0 6.3     3     ?     ?   104.903   17.9949      25.5663    -162.005     112.786    -162.005     
1 1 1 -48 8  14 o 0 5.2     2.4   ?     ?   85.0985   73.6793      30.9786    -106.321     103.28     -106.321     
1 1 1 -48 8  13 o 0 -1.9    2.9   ?     ?   39.5405   -51.2239     28.865     128.776      63.4532    128.776      
1 1 1 -48 8  12 o 0 255.3   6.2   ?     ?   363.411   -44.1242     355.243    -44.1242     23.7559    -44.1242     
1 1 1 -48 8  11 o 0 10.4    4.7   ?     ?   75.4008   58.1011      8.49063    -121.899     77.2473    -121.899     
1 1 1 -48 8  10 o 0 305.9   11    ?     ?   389.441   112.917      404.436    112.917      46.9138    112.917      
1 1 1 -48 8  9  o 0 69.1    5.7   ?     ?   243.106   57.9765      122.068    57.9765      84.8249    -122.023     
1 1 1 -48 8  8  o 0 164.4   9.3   ?     ?   240.014   -39.0102     318.543    -39.0102     113.083    -39.0102     
1 1 1 -48 8  7  o 0 207.5   11.2  ?     ?   330.638   -90.3528     317.513    -90.3528     35.4092    -90.3528     
1 1 1 -48 8  6  o 0 69.5    6.6   ?     ?   104.98    -86.1389     198.238    -86.1389     108.22     -86.1389     
1 1 1 -48 8  5  o 0 73.2    6.1   ?     ?   111.732   -25.7334     208.483    -25.7334     112.236    -25.7334     
1 1 1 -48 8  4  o 0 12.9    4.4   ?     ?   69.4202   85.9082      4.45012    -94.0918     64.2729    -94.0918     
1 1 1 -48 8  3  o 0 15.6    5.3   ?     ?   82.3144   130.361      4.83553    130.361      66.365     -49.6392     
1 1 1 -48 8  2  f 1 171.3   8.7   ?     ?   144.324   -102.026     399.271    -102.026     273.372    -102.026     
1 1 1 -48 8  1  o 0 75      3.7   ?     ?   101.938   131.239      214.788    131.239      126.058    131.239      
1 1 1 48  8  0  o 0 121.2   4.1   ?     ?   216.632   135.517      269.108    135.517      77.0355    135.517      
1 1 1 48  8  1  o 0 27.1    3.2   ?     ?   202.699   77.8622      15.0024    77.8622      164.991    -102.138     
1 1 1 48  8  2  f 1 163.7   5.5   ?     ?   163.796   -127.072     385.439    -127.072     239.072    -127.072     
1 1 1 48  8  3  o 0 5.1     4.4   ?     ?   15.0825   179.512      7.60429    -0.487806    21.0238    -0.487806    
1 1 1 48  8  4  o 0 206.7   6.6   ?     ?   402.779   -53.0956     272.569    -53.0956     85.9538    126.904      
1 1 1 48  8  5  o 0 142     7.7   ?     ?   132.955   -93.8687     363.655    -93.8687     244.857    -93.8687     
1 1 1 48  8  6  o 0 21.3    7.1   ?     ?   49.6973   127.737      25.4469    127.737      18.9432    -52.2628     
1 1 1 48  8  7  o 0 29.7    7.1   ?     ?   107.081   94.7657      70.6844    94.7657      24.8895    -85.2343     
1 1 1 48  8  8  o 0 40.2    7.5   ?     ?   116.649   -57.1753     117.948    -57.1753     13.0428    -57.1753     
1 1 1 48  8  9  o 0 1.3     8.5   ?     ?   16.5355   -152.257     7.08385    27.7429      22.6497    27.7429      
1 1 1 48  8  10 o 0 31      10.1  ?     ?   39.0168   166.075      62.6424    166.075      24.6885    166.075      
1 1 1 48  8  11 o 0 -6.1    12    ?     ?   68.0768   -72.9299     25.0508    107.07       91.6083    107.07       
1 1 1 48  8  12 o 0 295.7   15.9  ?     ?   235.025   63.6088      557.75     63.6088      336.341    63.6088      
1 1 1 48  8  13 o 0 56.1    16.3  ?     ?   182.197   53.182       136.177    53.182       34.9011    -126.818     
1 1 1 48  8  14 o 0 63.5    16    ?     ?   177.744   50.4136      169.092    50.4136      6.28225    50.4136      
1 1 1 48  8  15 o 0 33.7    19.6  ?     ?   241.095   64.6943      9.64461    64.6943      207.411    -115.306     
1 1 1 48  8  16 o 0 88.4    19.6  ?     ?   270.746   89.3801      160.224    89.3801      82.958     -90.6199     
1 1 1 48  8  17 < 1 -6      19.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 10 15 < 0 54.4    3.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 10 14 < 0 18.4    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 10 13 o 0 0.8     2.2   ?     ?   42.8796   165.121      23.7521    -14.879      58.6965    -14.879      
1 1 1 -48 10 12 o 0 13.9    6.3   ?     ?   148.135   138.735      1.12194    138.735      120.281    -41.2651     
1 1 1 -48 10 11 o 0 104     7.5   ?     ?   272.819   82.4745      187.651    82.4745      40.578     -97.5255     
1 1 1 -48 10 10 o 0 104.3   7     ?     ?   239.685   70.0607      215.406    70.0607      13.4928    70.0607      
1 1 1 -48 10 9  o 0 137.6   8     ?     ?   267.32    168.635      255.054    168.635      23.5608    168.635      
1 1 1 -48 10 8  o 0 100.4   7.2   ?     ?   238.875   169.958      197.281    169.958      18.0911    -10.0422     
1 1 1 -48 10 7  o 0 37.5    5.8   ?     ?   112.504   -134.639     116.432    -134.639     14.4241    -134.639     
1 1 1 -48 10 6  o 0 54.7    6.1   ?     ?   178.915   42.1238      131.968    42.1238      31.1001    -137.876     
1 1 1 -48 10 5  o 0 59.5    7.6   ?     ?   121.101   57.3935      179.29     57.3935      69.2153    57.3935      
1 1 1 -48 10 4  o 0 89.5    8     ?     ?   200.937   7.78411      205.379    7.78411      21.9451    7.78411      
1 1 1 -48 10 3  o 0 58.7    6.6   ?     ?   110.823   -69.3024     183.197    -69.3024     81.6325    -69.3024     
1 1 1 -48 10 2  o 0 45.2    8     ?     ?   132.247   -135.309     130.606    -135.309     8.98444    -135.309     
1 1 1 -48 10 1  o 0 107.8   9.3   ?     ?   218.924   132.238      234.461    132.238      32.5107    132.238      
1 1 1 48  10 0  o 0 93.1    3.6   ?     ?   194.568   -62.3289     227.908    -62.3289     43.9579    -62.3289     
1 1 1 48  10 1  o 0 64.1    4.1   ?     ?   220.405   -77.7125     131.678    -77.7125     76.9721    102.287      
1 1 1 48  10 2  o 0 9       4.2   ?     ?   93.8934   -71.9147     23.4259    108.085      112.395    108.085      
1 1 1 48  10 3  o 0 60.4    5.5   ?     ?   146.09    -173.495     176.487    -173.495     37.9821    -173.495     
1 1 1 48  10 4  o 0 72.8    6.3   ?     ?   212.022   -29.4432     162.246    -29.4432     38.8024    150.557      
1 1 1 48  10 5  o 0 100.7   8.5   ?     ?   165.971   63.026       266.493    63.026       109.147    63.026       
1 1 1 48  10 6  o 0 38.7    7.9   ?     ?   85.0801   -61.2991     133.069    -61.2991     51.8565    -61.2991     
1 1 1 48  10 7  o 0 177.4   11.8  ?     ?   222.154   -93.5945     372.912    -93.5945     161.076    -93.5945     
1 1 1 48  10 8  o 0 354.5   14.6  ?     ?   327.792   38.188       540.76     38.188       239.155    38.188       
1 1 1 48  10 9  o 0 417.6   17.4  ?     ?   396.9     40.9239      551.236    40.9239      186.727    40.9239      
1 1 1 48  10 10 o 0 32.1    14.7  ?     ?   185.139   75.139       48.4992    75.139       117.603    -104.861     
1 1 1 48  10 11 o 0 22.3    16.2  ?     ?   51.5952   80.5929      65.2447    80.5929      19.6823    80.5929      
1 1 1 48  10 12 o 0 4.3     16.2  ?     ?   147.973   144.862      10.4048    -35.1384     140.665    -35.1384     
1 1 1 48  10 13 o 0 62.8    17.7  ?     ?   179.02    6.7954       165.088    6.7954       7.70906    6.7954       
1 1 1 48  10 14 < 0 93.9    25.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 12 10 < 0 62.8    8.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 12 9  < 0 21.5    6.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -48 12 8  o 0 -0.5    8.1   ?     ?   71.6163   -53.3197     11.8365    126.68       69.5422    126.68       
1 1 1 -48 12 7  o 0 85.9    9.5   ?     ?   198.487   -121.833     206.656    -121.833     45.7879    -121.833     
1 1 1 -48 12 6  o 0 249.7   12.4  ?     ?   359.088   -117.076     355.627    -117.076     63.6795    -117.076     
1 1 1 -48 12 5  o 0 217.5   12.5  ?     ?   353.013   -116.904     317.485    -116.904     29.0568    -116.904     
1 1 1 -48 12 4  o 0 217.9   13.3  ?     ?   176.34    -147.43      453.571    -147.43      308.844    -147.43      
1 1 1 -48 12 3  o 0 37.8    9.5   ?     ?   34.2578   -145.372     90.0633    -145.372     61.4596    -145.372     
1 1 1 -48 12 2  o 0 30.4    9.1   ?     ?   96.6877   177.441      98.2756    177.441      17.2526    177.441      
1 1 1 -48 12 1  o 0 57.5    3.8   ?     ?   109.07    118.517      189.718    118.517      98.026     118.517      
1 1 1 48  12 0  o 0 70.5    4.6   ?     ?   180.947   -106.514     187.284    -106.514     30.3373    -106.514     
1 1 1 48  12 1  o 0 178.6   6.7   ?     ?   274.95    -120.62      333.536    -120.62      94.7963    -120.62      
1 1 1 48  12 2  o 0 4.4     5.8   ?     ?   74.0105   130.53       22.2216    -49.47       86.5296    -49.47       
1 1 1 48  12 3  o 0 128.1   8.2   ?     ?   193.049   -144.461     306.671    -144.461     138.879    -144.461     
1 1 1 48  12 4  o 0 132.4   8.7   ?     ?   240.879   -108.978     282.809    -108.978     76.1958    -108.978     
1 1 1 48  12 5  o 0 91.9    11.6  ?     ?   268.53    108.873      172.919    108.873      57.2952    -71.1273     
1 1 1 48  12 6  o 0 296.1   16.4  ?     ?   309.034   77.4724      475.961    77.4724      211.266    77.4724      
1 1 1 48  12 7  o 0 41      11.3  ?     ?   102.126   110.997      153.778    110.997      66.2245    110.997      
1 1 1 48  12 8  o 0 55.3    14.9  ?     ?   194.563   151.009      131.564    151.009      34.9441    -28.9909     
1 1 1 48  12 9  < 0 74.7    15.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 48  12 10 < 0 -17.1   19.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 1  21 < 0 43.9    3.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 1  20 o 0 35.7    3.6   ?     ?   132.861   94.0184      123.562    94.0184      10.3097    94.0184      
1 1 1 -49 1  19 o 0 83.6    4.2   ?     ?   228.482   66.257       185.108    66.257       13.7154    -113.743     
1 1 1 -49 1  18 o 0 92.7    3.7   ?     ?   136.184   83.8768      270.577    83.8768      148.414    83.8768      
1 1 1 -49 1  17 f 1 114.9   4.8   ?     ?   275.718   130.438      204.55     130.438      55.0083    -49.562      
1 1 1 -49 1  16 o 0 71      3.4   ?     ?   195.355   -21.2087     169.637    -21.2087     13.5021    158.791      
1 1 1 -49 1  15 o 0 46.3    2.9   ?     ?   58.0871   110.679      122.801    110.679      72.2341    110.679      
1 1 1 -49 1  14 o 0 263.4   6.7   ?     ?   402.219   68.7034      346.57     68.7034      3.16453    -111.297     
1 1 1 -49 1  13 o 0 16.3    2.4   ?     ?   167.672   74.4536      17.766     -105.546     164.049    -105.546     
1 1 1 -49 1  12 o 0 50.6    2.6   ?     ?   35.6859   -25.0553     86.8504    -25.0553     55.5075    -25.0553     
1 1 1 -49 1  11 o 0 67.1    2.7   ?     ?   176.024   -32.7938     159.556    -32.7938     0.00938629 -32.7938     
1 1 1 -49 1  10 o 0 9.4     1.9   ?     ?   115.346   -32.9577     42.8068    147.042      147.971    147.042      
1 1 1 -49 1  9  o 0 43.5    2.2   ?     ?   250.345   22.7646      24.4538    22.7646      208.944    -157.235     
1 1 1 -49 1  8  o 0 140.8   4.1   ?     ?   215.821   -60.3432     292.487    -60.3432     90.251     -60.3432     
1 1 1 -49 1  7  o 0 519.1   10.3  ?     ?   563.412   -30.6634     481.856    -30.6634     58.0108    149.337      
1 1 1 -49 1  6  f 1 84.6    2.9   ?     ?   144.482   125.551      184.674    125.551      44.9123    125.551      
1 1 1 -49 1  5  o 0 17.6    1.9   ?     ?   131.498   167.398      37.9687    -12.6019     165.027    -12.6019     
1 1 1 -49 1  4  o 0 250.4   6.5   ?     ?   282.993   179.635      414.18     179.635      139.739    179.635      
1 1 1 -49 1  3  o 0 176.5   4.6   ?     ?   324.79    161.849      223.074    161.849      56.8165    -18.151      
1 1 1 -49 1  2  o 0 178.4   4.9   ?     ?   278.788   44.2085      258.269    44.2085      17.2975    44.2085      
1 1 1 -49 1  1  o 0 526.5   13.6  ?     ?   411.995   64.59        560.765    64.59        203.696    64.59        
1 1 1 49  1  0  o 0 468.4   10.4  ?     ?   365.904   112          544.248    112          225.893    112          
1 1 1 49  1  1  o 0 106.1   3.9   ?     ?   270.847   53.0452      136.357    53.0452      99.7686    -126.955     
1 1 1 49  1  2  o 0 218.2   6.2   ?     ?   375.368   8.87581      250.878    8.87581      76.9273    -171.124     
1 1 1 49  1  3  o 0 1141.7  21.4  ?     ?   819.921   47.9224      681.539    47.9224      35.475     -132.078     
1 1 1 49  1  4  o 0 968     19.5  ?     ?   572.131   68.4144      881.787    68.4144      316.285    68.4144      
1 1 1 49  1  5  o 0 959.6   19.3  ?     ?   623.048   11.086       827.463    11.086       211.211    11.086       
1 1 1 49  1  6  f 1 608.3   13.8  ?     ?   488.74    -28.3957     654.258    -28.3957     168.206    -28.3957     
1 1 1 49  1  7  o 0 6.5     5.6   ?     ?   49.1479   24.0583      28.8106    -155.942     76.5867    -155.942     
1 1 1 49  1  8  o 0 161.8   7.6   ?     ?   367.636   -145.767     216.243    -145.767     140.974    34.2329      
1 1 1 49  1  9  o 0 195.1   9.5   ?     ?   191.582   -54.9474     419.194    -54.9474     233.198    -54.9474     
1 1 1 49  1  10 o 0 170.3   9.9   ?     ?   335.849   -176.458     269.393    -176.458     50.8155    3.54248      
1 1 1 49  1  11 o 0 224.6   11.1  ?     ?   325.488   -128.032     379.361    -128.032     77.2603    -128.032     
1 1 1 49  1  12 o 0 256.9   12    ?     ?   336.283   175.98       418.053    175.98       106.584    175.98       
1 1 1 49  1  13 o 0 43.8    11.6  ?     ?   76.8647   108.173      121.383    108.173      50.1009    108.173      
1 1 1 49  1  14 o 0 135.2   15.4  ?     ?   114.309   -146.479     372.916    -146.479     266.294    -146.479     
1 1 1 49  1  15 o 0 35.1    14.1  ?     ?   192.927   147.526      47.8534    147.526      146.838    -32.4742     
1 1 1 49  1  16 o 0 19.1    18.8  ?     ?   157.359   -158.048     16.7252    -158.048     142.662    21.9524      
1 1 1 49  1  17 f 1 78.8    21.7  ?     ?   97.6813   -101.067     255.447    -101.067     159.748    -101.067     
1 1 1 49  1  18 o 0 -21.7   21.9  ?     ?   45.3117   43.2221      0.966219   43.2221      42.0797    -136.778     
1 1 1 49  1  19 o 0 30.2    23.8  ?     ?   80.7779   103.031      105.536    103.031      30.1754    103.031      
1 1 1 49  1  20 < 0 51.2    20    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 3  21 < 0 16.6    4.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 3  20 f 1 37.2    3.8   ?     ?   102.046   -117.397     145.164    -117.397     58.8264    -117.397     
1 1 1 -49 3  19 o 0 35.3    3.7   ?     ?   162.572   72.2154      96.2232    72.2154      41.6932    -107.785     
1 1 1 -49 3  18 o 0 164.5   5.2   ?     ?   184.69    0.0512537    380.417    0.0512537    220.134    0.0512537    
1 1 1 -49 3  17 o 0 51      3.3   ?     ?   98.0795   -29.9565     175.395    -29.9565     87.6643    -29.9565     
1 1 1 -49 3  16 o 0 101     3.6   ?     ?   155.97    -152.45      272.84     -152.45      127.202    -152.45      
1 1 1 -49 3  15 o 0 34      2.6   ?     ?   59.8533   -25.9178     97.2832    -25.9178     41.35      -25.9178     
1 1 1 -49 3  14 o 0 76.9    3.1   ?     ?   205       110.076      173.205    110.076      4.66042    -69.9241     
1 1 1 -49 3  13 o 0 112.9   4.1   ?     ?   234.809   158.622      232.461    158.622      29.0032    158.622      
1 1 1 -49 3  12 f 1 60.7    3     ?     ?   158.003   -44.3135     157.574    -44.3135     19.5224    -44.3135     
1 1 1 -49 3  11 o 0 34.5    2.2   ?     ?   117.764   -39.5161     86.5062    -39.5161     16.5314    140.484      
1 1 1 -49 3  10 o 0 346     7.4   ?     ?   409.351   39.3767      441.977    39.3767      72.4188    39.3767      
1 1 1 -49 3  9  o 0 230     5.5   ?     ?   312.457   96.0636      372.066    96.0636      88.3702    96.0636      
1 1 1 -49 3  8  o 0 562.5   11    ?     ?   641.949   -176.828     460.25     -176.828     135.66     3.17207      
1 1 1 -49 3  7  o 0 131     3.6   ?     ?   190.339   -137.951     289.115    -137.951     111.558    -137.951     
1 1 1 -49 3  6  f 1 89.9    3.2   ?     ?   109.209   -53.7586     227.571    -53.7586     124.708    -53.7586     
1 1 1 -49 3  5  o 0 12.2    1.8   ?     ?   143.935   179.833      69.5919    -0.167432    207.438    -0.167432    
1 1 1 -49 3  4  o 0 12.4    1.9   ?     ?   82.5935   99.0609      36.7104    -80.9391     116.11     -80.9391     
1 1 1 -49 3  3  o 0 51.6    2.5   ?     ?   72.1663   -130.658     75.4101    -130.658     5.795      -130.658     
1 1 1 -49 3  2  o 0 107.3   3.6   ?     ?   139.642   -105.217     242.128    -105.217     107.005    -105.217     
1 1 1 -49 3  1  o 0 91.5    3.4   ?     ?   173.4     31.1594      195.018    31.1594      26.7676    31.1594      
1 1 1 49  3  0  o 0 257.8   6.7   ?     ?   372.103   -109.833     352.332    -109.833     11.3383    70.1668      
1 1 1 49  3  1  o 0 566.7   12.5  ?     ?   477.989   -170.075     619.743    -170.075     151.68     -170.075     
1 1 1 49  3  2  o 0 1070.8  24.4  ?     ?   648.552   -168.983     877.563    -168.983     241.451    -168.983     
1 1 1 49  3  3  o 0 270     8.2   ?     ?   244.318   127.566      478.344    127.566      238.402    127.566      
1 1 1 49  3  4  o 0 369.8   9.3   ?     ?   249.686   101.045      606.541    101.045      361.096    101.045      
1 1 1 49  3  5  o 0 11.1    4.6   ?     ?   166.899   42.5653      94.7541    -137.435     258.916    -137.435     
1 1 1 49  3  6  f 1 483.6   11.5  ?     ?   507.519   -108.962     521.335    -108.962     28.2254    -108.962     
1 1 1 49  3  7  o 0 607.5   16.2  ?     ?   536.939   -80.0638     620.65     -80.0638     101.708    -80.0638     
1 1 1 49  3  8  o 0 243.2   9.5   ?     ?   357.638   -165.32      358.908    -165.32      13.449     -165.32      
1 1 1 49  3  9  o 0 82.4    7.5   ?     ?   246.912   -142.633     156.316    -142.633     77.9774    37.3675      
1 1 1 49  3  10 o 0 211.2   10.5  ?     ?   313.934   17.4249      366.279    17.4249      76.2043    17.4249      
1 1 1 49  3  11 o 0 27.9    9.8   ?     ?   103.457   -97.8338     57.3567    -97.8338     38.0658    82.1662      
1 1 1 49  3  12 f 1 11.3    11.5  ?     ?   191.063   -148.837     58.0185    31.163       235.422    31.163       
1 1 1 49  3  13 o 0 -3.8    12.9  ?     ?   127.296   12.1468      52.4902    -167.853     170.797    -167.853     
1 1 1 49  3  14 o 0 121.2   17.7  ?     ?   204.416   2.79517      296.172    2.79517      97.6097    2.79517      
1 1 1 49  3  15 o 0 51.1    15.3  ?     ?   87.7958   -7.44947     171.414    -7.44947     83.4215    -7.44947     
1 1 1 49  3  16 o 0 25.6    17.8  ?     ?   142.925   -160.66      46.2744    -160.66      97.4787    19.34        
1 1 1 49  3  17 o 0 167.4   22.2  ?     ?   268.649   -95.2157     325.058    -95.2157     65.085     -95.2157     
1 1 1 49  3  18 o 0 7.4     22.8  ?     ?   122.79    -86.7097     32.2487    -86.7097     82.0348    93.2903      
1 1 1 49  3  19 o 0 64.7    28.7  ?     ?   170.453   1.61867      150.125    1.61867      8.05444    -178.381     
1 1 1 49  3  20 < 1 21.6    26.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 5  20 < 0 228.9   7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 5  19 o 0 209.4   6.2   ?     ?   333.125   -93.5655     331.613    -93.5655     54.025     -93.5655     
1 1 1 -49 5  18 o 0 13.5    3.1   ?     ?   80.8512   -23.133      33.998     -23.133      33.8931    156.867      
1 1 1 -49 5  17 o 0 51.7    3.4   ?     ?   182.038   -28.9478     132.182    -28.9478     24.1686    151.052      
1 1 1 -49 5  16 o 0 55.4    3.9   ?     ?   99.0844   -27.6233     187.019    -27.6233     99.3166    -27.6233     
1 1 1 -49 5  15 o 0 14.5    2.8   ?     ?   20.245    -58.2434     10.9487    -58.2434     7.75479    121.757      
1 1 1 -49 5  14 o 0 310.7   6.8   ?     ?   375.435   -176.549     426.696    -176.549     79.6221    -176.549     
1 1 1 -49 5  13 o 0 37.6    2.4   ?     ?   193.076   -125.302     65.1746    -125.302     100.52     54.6983      
1 1 1 -49 5  12 o 0 153.6   4.1   ?     ?   248.598   -82.1007     297.679    -82.1007     82.7855    -82.1007     
1 1 1 -49 5  11 o 0 19.7    1.8   ?     ?   153.493   -130.858     9.47939    -130.858     122.95     49.1417      
1 1 1 -49 5  10 o 0 37.4    2.1   ?     ?   153.426   45.7365      84.1781    45.7365      48.5398    -134.264     
1 1 1 -49 5  9  f 1 87.2    2.9   ?     ?   219.798   92.658       187.113    92.658       5.13667    -87.342      
1 1 1 -49 5  8  o 0 76.2    2.8   ?     ?   263.631   -66.7996     120.342    -66.7996     116.231    113.2        
1 1 1 -49 5  7  o 0 207.3   5.1   ?     ?   275.171   -17.7686     365.411    -17.7686     117.213    -17.7686     
1 1 1 -49 5  6  o 0 190.2   5     ?     ?   352.771   25.2781      276.137    25.2781      43.5614    -154.722     
1 1 1 -49 5  5  o 0 26.5    1.9   ?     ?   152.353   71.2106      15.8958    71.2106      125.129    -108.789     
1 1 1 -49 5  4  o 0 148.3   4.3   ?     ?   247.646   -178.46      280.839    -178.46      50.7001    -178.46      
1 1 1 -49 5  3  o 0 271     6.4   ?     ?   292.986   146.566      440.623    146.566      167.375    146.566      
1 1 1 -49 5  2  o 0 185.5   5.2   ?     ?   353.322   20.1592      261.885    20.1592      68.6889    -159.841     
1 1 1 -49 5  1  o 0 14.7    2.3   ?     ?   106.039   110.931      23.0757    -69.0691     122.569    -69.0691     
1 1 1 49  5  0  o 0 97.2    3.7   ?     ?   336.063   170.469      106.569    170.469      212.335    -9.53144     
1 1 1 49  5  1  o 0 481.9   10.4  ?     ?   480.353   -102.873     538.176    -102.873     81.5215    -102.873     
1 1 1 49  5  2  o 0 67.7    3.9   ?     ?   292.28    128.423      67.8912    128.423      210.381    -51.5766     
1 1 1 49  5  3  o 0 46.1    3.7   ?     ?   130.691   83.6621      101.166    83.6621      23.4034    -96.3379     
1 1 1 49  5  4  o 0 9.8     5     ?     ?   118.916   -106.48      56.963     73.5197      170.397    73.5197      
1 1 1 49  5  5  o 0 131.7   7.8   ?     ?   237.127   -163.657     263.225    -163.657     36.9328    -163.657     
1 1 1 49  5  6  o 0 75.7    6.9   ?     ?   61.2266   158.294      185.475    158.294      128.02     158.294      
1 1 1 49  5  7  o 0 637     15.4  ?     ?   604.573   148.266      589.786    148.266      22.647     148.266      
1 1 1 49  5  8  o 0 83.6    7.8   ?     ?   69.9186   -107.957     232.808    -107.957     168.9      -107.957     
1 1 1 49  5  9  f 1 264.8   10.1  ?     ?   363.308   -64.0125     399.28     -64.0125     65.8794    -64.0125     
1 1 1 49  5  10 o 0 103.5   9.1   ?     ?   234.191   -100.753     223.436    -100.753     9.15481    -100.753     
1 1 1 49  5  11 o 0 39.3    10.5  ?     ?   33.5363   -77.5723     61.5862    -77.5723     30.9625    -77.5723     
1 1 1 49  5  12 o 0 14.7    11.9  ?     ?   59.8886   70.3159      12.6644    70.3159      42.3684    -109.684     
1 1 1 49  5  13 o 0 29.5    12.6  ?     ?   59.8397   26.5101      74.1138    26.5101      14.5932    26.5101      
1 1 1 49  5  14 o 0 15.7    14.7  ?     ?   102.53    16.2639      28.0266    16.2639      74.3839    -163.736     
1 1 1 49  5  15 o 0 -38.8   13.6  ?     ?   52.2082   68.6659      32.8319    -111.334     83.0364    -111.334     
1 1 1 49  5  16 o 0 6.5     15.3  ?     ?   55.3777   -121.735     16.5794    -121.735     35.3468    58.2655      
1 1 1 49  5  17 o 0 6.6     21.7  ?     ?   104.301   -129.635     35.8345    -129.635     60.2509    50.365       
1 1 1 49  5  18 o 0 29.2    26.4  ?     ?   197.051   -70.8032     33.9909    -70.8032     147.041    109.197      
1 1 1 -49 7  18 < 0 41.6    3.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 7  17 o 0 22      3.7   ?     ?   25.1894   27.641       56.8745    27.641       36.0563    27.641       
1 1 1 -49 7  16 o 0 140.8   4.7   ?     ?   288.081   -119.617     254.862    -119.617     15.0825    -119.617     
1 1 1 -49 7  15 o 0 184.6   5.1   ?     ?   275.35    -105.411     336.646    -105.411     102.367    -105.411     
1 1 1 -49 7  14 o 0 52.6    3     ?     ?   205.464   -139.068     112.319    -139.068     67.7305    40.9317      
1 1 1 -49 7  13 o 0 87.2    3.1   ?     ?   213.191   -138.359     192.255    -138.359     2.62244    41.6409      
1 1 1 -49 7  12 o 0 54.2    2.6   ?     ?   195.891   -104.987     117.812    -104.987     61.2605    75.0134      
1 1 1 -49 7  11 o 0 276.8   5.7   ?     ?   377.921   94.0923      378.872    94.0923      30.944     94.0923      
1 1 1 -49 7  10 o 0 7.7     1.3   ?     ?   106.084   -17.2639     34.2495    162.736      124.819    162.736      
1 1 1 -49 7  9  o 0 291.1   10.5  ?     ?   371.025   -85.0158     398.831    -85.0158     80.0966    -85.0158     
1 1 1 -49 7  8  f 1 134     6.3   ?     ?   261.677   -63.6231     249.69     -63.6231     24.4019    -63.6231     
1 1 1 -49 7  7  o 0 26      4.4   ?     ?   30.7885   113.898      28.5872    113.898      2.07422    113.898      
1 1 1 -49 7  6  o 0 69.1    4.8   ?     ?   73.7634   141.133      186.363    141.133      122.769    141.133      
1 1 1 -49 7  5  o 0 9.9     4.7   ?     ?   79.8552   87.9025      20.7243    -92.0975     89.8829    -92.0975     
1 1 1 -49 7  4  o 0 150.5   6.8   ?     ?   264.939   -39.0761     283.533    -39.0761     53.1366    -39.0761     
1 1 1 -49 7  3  o 0 330.5   15.4  ?     ?   477.265   -90.5051     372.026    -90.5051     44.5562    89.4949      
1 1 1 -49 7  2  o 0 176.5   6.9   ?     ?   275.12    -116.479     314.053    -116.479     66.9639    -116.479     
1 1 1 -49 7  1  o 0 111.3   3.7   ?     ?   180.184   8.08368      262.244    8.08368      99.9443    8.08368      
1 1 1 49  7  0  o 0 228.9   5.6   ?     ?   368.408   -3.05345     326.254    -3.05345     11.0509    176.947      
1 1 1 49  7  1  o 0 43.2    3.2   ?     ?   120.073   2.04286      109.468    2.04286      0.64888    -177.957     
1 1 1 49  7  2  o 0 20.9    3.4   ?     ?   206.747   42.2797      26.8983    -137.72      216.748    -137.72      
1 1 1 49  7  3  o 0 2       3.2   ?     ?   105.818   103.901      73.2095    -76.0991     168.049    -76.0991     
1 1 1 49  7  4  o 0 56.6    4.8   ?     ?   92.6513   -57.1411     166.128    -57.1411     83.0416    -57.1411     
1 1 1 49  7  5  o 0 78.9    5.5   ?     ?   261.39    -137.169     140.785    -137.169     93.6652    42.8313      
1 1 1 49  7  6  o 0 23.9    5.7   ?     ?   35.6595   -26.1685     26.5903    -26.1685     5.38786    153.831      
1 1 1 49  7  7  o 0 196.9   8.6   ?     ?   292.258   -78.667      350.154    -78.667      87.2354    -78.667      
1 1 1 49  7  8  f 1 383.3   12    ?     ?   453.27    -85.6679     463.544    -85.6679     54.0886    -85.6679     
1 1 1 49  7  9  o 0 32.2    8.2   ?     ?   154.678   -35.5024     69.8032    -35.5024     70.2287    144.498      
1 1 1 49  7  10 o 0 23.5    9.3   ?     ?   105.1     89.9992      46.8684    89.9992      52.7025    -90.0008     
1 1 1 49  7  11 o 0 35.6    11.4  ?     ?   50.1192   29.6424      89.9615    29.6424      40.9079    29.6424      
1 1 1 49  7  12 o 0 176.4   14.6  ?     ?   293.29    129.852      317.21     129.852      28.7761    129.852      
1 1 1 49  7  13 o 0 -16     14.5  ?     ?   74.4804   -177.899     28.8492    2.10101      99.4099    2.10101      
1 1 1 49  7  14 o 0 4       14.6  ?     ?   130.829   29.7553      14.8177    -150.245     135.748    -150.245     
1 1 1 49  7  15 o 0 143.1   18.1  ?     ?   309.249   44.2284      254.409    44.2284      26.5959    -135.772     
1 1 1 49  7  16 o 0 51.8    19.5  ?     ?   170.339   2.16434      132.916    2.16434      21.5322    -177.836     
1 1 1 49  7  17 < 0 8.1     19.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 9  16 < 0 137.5   4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 9  15 < 0 16      2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 9  14 o 0 4.4     2.3   ?     ?   38.2583   -75.6506     7.87585    104.349      39.2305    104.349      
1 1 1 -49 9  13 o 0 25.2    2     ?     ?   59.8444   -32.4904     89.2141    -32.4904     39.8735    -32.4904     
1 1 1 -49 9  12 o 0 55.5    5.9   ?     ?   197.471   36.7175      128.711    36.7175      37.54      -143.282     
1 1 1 -49 9  11 f 1 123     7.1   ?     ?   223.05    -13.8417     261.531    -13.8417     67.3402    -13.8417     
1 1 1 -49 9  10 f 1 21.8    7.7   ?     ?   112.605   176.729      48.1463    176.729      50.5675    -3.27064     
1 1 1 -49 9  9  o 0 58.5    8.2   ?     ?   215.193   -159.083     113.506    -159.083     81.9705    20.9174      
1 1 1 -49 9  8  f 1 42.5    6.2   ?     ?   152.334   -93.9295     108.199    -93.9295     30.6851    86.0705      
1 1 1 -49 9  7  o 0 2.9     4.5   ?     ?   85.7727   -48.9137     47.838     131.086      126.072    131.086      
1 1 1 -49 9  6  o 0 217     9.3   ?     ?   247.315   66.792       403.768    66.7921      177.028    66.7921      
1 1 1 -49 9  5  o 0 23.5    5.1   ?     ?   158.908   -9.35869     28.1413    -9.35869     106.7      170.641      
1 1 1 -49 9  4  o 0 8.4     6.1   ?     ?   61.464    -92.741      14.3795    87.259       66.7588    87.259       
1 1 1 -49 9  3  o 0 11.1    6     ?     ?   120.106   -139.669     22.7368    40.3309      125.487    40.3309      
1 1 1 -49 9  2  o 0 10.1    6.7   ?     ?   211.841   62.5332      80.1463    -117.467     262.001    -117.467     
1 1 1 -49 9  1  o 0 243.2   6.8   ?     ?   279.282   82.6193      410.779    82.6193      170.298    82.6193      
1 1 1 49  9  0  o 0 45.6    2.9   ?     ?   145.73    175.215      123.956    175.215      4.34569    -4.78548     
1 1 1 49  9  1  o 0 37.6    3.6   ?     ?   96.2915   -58.5442     110.939    -58.5442     26.0415    -58.5442     
1 1 1 49  9  2  o 0 67.2    4.5   ?     ?   266.037   142.407      103.974    142.407      130.837    -37.5934     
1 1 1 49  9  3  o 0 29.5    5.3   ?     ?   150.262   -1.04141     60.9152    -1.04141     71.8035    178.959      
1 1 1 49  9  4  o 0 307.1   10    ?     ?   466.684   -16.3714     349.488    -16.3714     62.8434    163.629      
1 1 1 49  9  5  o 0 58.2    7     ?     ?   182.181   75.4895      147.048    75.4895      21.6941    -104.511     
1 1 1 49  9  6  o 0 41.9    8.2   ?     ?   203.989   -156.713     73.0987    -156.713     122.445    23.2869      
1 1 1 49  9  7  o 0 74.3    9.1   ?     ?   163.965   -102.984     204.116    -102.984     47.0752    -102.984     
1 1 1 49  9  8  f 1 148.7   11.6  ?     ?   238.977   44.1815      309.115    44.1815      77.6232    44.1815      
1 1 1 49  9  9  o 0 117.6   9.7   ?     ?   232.569   57.9475      253.204    57.9475      29.4501    57.9475      
1 1 1 49  9  10 f 1 118.4   13    ?     ?   111.084   136.008      348.345    136.008      244.758    136.008      
1 1 1 49  9  11 f 1 0.5     11    ?     ?   108.578   52.2537      27.2811    -127.746     126.168    -127.746     
1 1 1 49  9  12 o 0 49.6    12.9  ?     ?   119.554   36.8052      165.11     36.8052      57.1052    36.8052      
1 1 1 49  9  13 o 0 74.1    15.9  ?     ?   121.877   1.38644      240.216    1.38644      131.915    1.38644      
1 1 1 49  9  14 o 0 131.7   20.8  ?     ?   219.068   158.317      297.337    158.317      102.979    158.317      
1 1 1 49  9  15 < 0 127     20.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 11 12 < 0 110.5   8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 11 11 < 0 32.8    7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 11 10 o 0 34.3    6     ?     ?   113.073   162.939      122.371    162.939      30.8236    162.939      
1 1 1 -49 11 9  o 0 140.4   8.3   ?     ?   263.309   -155.931     265.869    -155.931     51.74      -155.931     
1 1 1 -49 11 8  f 1 133.5   9     ?     ?   141.918   -93.0892     341.202    -93.0892     224.474    -93.0892     
1 1 1 -49 11 7  o 0 255.6   12.1  ?     ?   335.944   -125.932     381.473    -125.932     101.327    -125.932     
1 1 1 -49 11 6  o 0 88.2    8     ?     ?   186.31    -168.407     218.418    -168.407     62.2233    -168.407     
1 1 1 -49 11 5  o 0 86.9    8.4   ?     ?   249.436   140.941      162.614    140.941      52.0029    -39.0591     
1 1 1 -49 11 4  o 0 179.4   11.7  ?     ?   204.516   141.505      373.643    141.505      196.89     141.505      
1 1 1 -49 11 3  o 0 168.6   11.9  ?     ?   151.925   155.347      395.039    155.347      263.209    155.347      
1 1 1 -49 11 2  o 0 170.1   10.6  ?     ?   284.437   167.144      298.261    167.144      50.5577    167.144      
1 1 1 -49 11 1  f 1 63      9.2   ?     ?   90.9531   126.303      204.943    126.303      125.076    126.303      
1 1 1 49  11 0  o 0 8.2     3     ?     ?   120.931   -72.1406     31.7086    107.859      140.438    107.859      
1 1 1 49  11 1  f 1 36.2    4.5   ?     ?   54.4228   -102.967     113.695    -102.967     64.4521    -102.967     
1 1 1 49  11 2  o 0 116.4   6.4   ?     ?   215.567   -143.977     265.643    -143.977     71.4266    -143.977     
1 1 1 49  11 3  o 0 265     11.7  ?     ?   323.55    -146.751     421.385    -146.751     129.748    -146.751     
1 1 1 49  11 4  o 0 4.1     6.6   ?     ?   31.8945   173.609      9.51881    -6.39082     38.2691    -6.39082     
1 1 1 49  11 5  o 0 120.3   10.7  ?     ?   240.709   50.2999      256.892    50.2999      44.5088    50.2999      
1 1 1 49  11 6  o 0 8.7     9.4   ?     ?   21.7773   -171.342     4.21546    -171.342     14.9848    8.65816      
1 1 1 49  11 7  o 0 57.8    12.4  ?     ?   165.926   139.402      158.543    139.402      12.4207    139.402      
1 1 1 49  11 8  f 1 154     12.7  ?     ?   197.362   68.9396      357.261    68.9396      185.109    68.9396      
1 1 1 49  11 9  o 0 103     15.4  ?     ?   220.848   98.6323      237.295    98.6323      45.5934    98.6323      
1 1 1 49  11 10 o 0 22.4    15.6  ?     ?   34.9427   -40.5754     64.6712    -40.5754     34.4132    -40.5754     
1 1 1 49  11 11 < 0 18.3    16.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  11 12 < 0 88.9    24    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 13 6  < 0 165.5   11.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 13 5  < 0 177.4   11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 13 4  < 0 66      10.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 13 3  < 0 159.9   13.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 13 2  < 0 1.3     11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -49 13 1  < 0 34.3    3.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  13 0  < 0 64      5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  13 1  < 0 1.5     5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  13 2  < 0 9.6     6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  13 3  < 0 -4.1    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  13 4  < 0 91.5    12.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 49  13 5  < 0 113.4   12.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 0  21 < 0 62      5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 0  20 o 0 2.6     4.1   ?     ?   52.5176   180          8.4501     180          36.176     1.63898e-15  
1 1 1 -50 0  19 o 0 94.9    5.3   ?     ?   113.082   0            213.35     0            116.545    0            
1 1 1 -50 0  18 o 0 137.4   7.3   ?     ?   181.387   0            259.915    0            101.125    0            
1 1 1 -50 0  17 o 0 65.6    5.4   ?     ?   222.316   0            180.816    0            19.7031    180          
1 1 1 -50 0  16 o 0 366.7   12.8  ?     ?   365.862   0            432.347    0            90.5597    0            
1 1 1 -50 0  15 o 0 1.4     4     ?     ?   133.067   180          10.0374    180          115.261    6.11044e-16  
1 1 1 -50 0  14 o 0 99.3    4.8   ?     ?   263.128   180          217.965    180          11.9941    1.27512e-13  
1 1 1 -50 0  13 o 0 18.7    3.1   ?     ?   47.067    180          30.0705    180          10.9948    1.91906e-14  
1 1 1 -50 0  12 o 0 146.3   5.8   ?     ?   254.096   0            268.319    0            45.9856    0            
1 1 1 -50 0  11 o 0 700.4   18    ?     ?   476.209   0            590.792    0            171.508    0            
1 1 1 -50 0  10 o 0 932.6   24.6  ?     ?   631.476   0            685.477    0            111.963    0            
1 1 1 -50 0  9  o 0 126.2   6.5   ?     ?   86.8963   0            224.376    0            145.026    0            
1 1 1 -50 0  8  o 0 302.9   8.6   ?     ?   481.633   180          395.083    180          54.4606    5.09025e-14  
1 1 1 -50 0  7  o 0 21.5    3     ?     ?   123.38    180          62.0786    180          53.6212    8.12341e-15  
1 1 1 -50 0  6  o 0 0.4     2.7   ?     ?   158.728   180          3.36764    180          148.782    1.58821e-16  
1 1 1 -50 0  5  o 0 66.9    3.9   ?     ?   273.028   0            182.373    0            80.3852    180          
1 1 1 -50 0  4  o 0 121.9   5     ?     ?   222.392   0            249.813    0            35.003     0            
1 1 1 -50 0  3  o 0 28.7    3.1   ?     ?   57.2132   0            34.5319    0            20.9148    180          
1 1 1 -50 0  2  o 0 733.8   19.1  ?     ?   541.304   0            629.129    0            102.958    0            
1 1 1 -50 0  1  o 0 804.3   22    ?     ?   579.478   0            660.339    0            95.5413    0            
1 1 1 50  0  0  o 0 66.7    8.2   ?     ?   219.526   1.03222e-14  176.645    0            37.8292    -180         
1 1 1 50  0  1  o 0 352.5   12.2  ?     ?   242.195   0            438.949    0            201.838    0            
1 1 1 50  0  2  o 0 546.1   16    ?     ?   268.75    0            547.545    0            283.979    0            
1 1 1 50  0  3  o 0 -2.8    5.1   ?     ?   33.3018   180          0.899398   180          31.8062    1.98414e-16  
1 1 1 50  0  4  o 0 246.2   10.7  ?     ?   490.04    0            368.418    0            113.365    180          
1 1 1 50  0  5  o 0 1624    42.6  ?     ?   898.609   0            946.55     0            62.4438    0            
1 1 1 50  0  6  o 0 264.5   11.7  ?     ?   417.94    0            382.2      0            21.9602    180          
1 1 1 50  0  7  o 0 3       8.1   ?     ?   106.33    180          10.0665    180          92.7558    7.61503e-16  
1 1 1 50  0  8  o 0 486.9   21.1  ?     ?   395.626   180          518.009    180          135.584    180          
1 1 1 50  0  9  o 0 65.4    10.7  ?     ?   186.78    180          182.335    180          4.94544    180          
1 1 1 50  0  10 o 0 8.9     12.3  ?     ?   16.8613   180          3.75955    180          12.235     2.15608e-15  
1 1 1 50  0  11 o 0 9.8     13.8  ?     ?   99.5202   180          25.4166    180          66.4897    2.68223e-15  
1 1 1 50  0  12 o 0 26.4    13.1  ?     ?   153.32    180          81.6281    180          60.2094    9.51281e-15  
1 1 1 50  0  13 o 0 29.3    18.6  ?     ?   84.4272   0            55.0433    0            22.8712    180          
1 1 1 50  0  14 o 0 -39.6   21.2  ?     ?   20.7481   0            2.3941     0            16.8663    180          
1 1 1 50  0  15 o 0 176     23.3  ?     ?   282.595   180          317.456    180          33.6125    180          
1 1 1 50  0  16 o 0 -36.2   29.7  ?     ?   41.2758   180          10.8954    180          30.7208    2.48853e-15  
1 1 1 50  0  17 o 0 10.5    30.5  ?     ?   113.425   0            57.9939    0            52.0661    180          
1 1 1 50  0  18 o 0 95.3    34.1  ?     ?   108.714   0            199.013    0            96.1858    0            
1 1 1 -50 2  21 < 0 14.4    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 2  20 o 0 11.1    3.5   ?     ?   76.2615   153.501      30.9717    153.501      33.2589    -26.4987     
1 1 1 -50 2  19 o 0 33.4    3     ?     ?   133.323   58.1335      108.368    58.1335      4.79054    -121.866     
1 1 1 -50 2  18 o 0 33.4    3.2   ?     ?   71.8494   -80.9796     119.349    -80.9796     56.9704    -80.9796     
1 1 1 -50 2  17 o 0 89.7    3.7   ?     ?   241.104   -162.346     185.219    -162.346     30.506     17.6539      
1 1 1 -50 2  16 o 0 119.5   3.8   ?     ?   208.63    -75.7639     271.728    -75.7639     76.8839    -75.7639     
1 1 1 -50 2  15 o 0 164.3   4.6   ?     ?   275.734   57.0638      301.724    57.0638      44.0301    57.0638      
1 1 1 -50 2  14 o 0 419.9   9     ?     ?   451.733   50.9829      485.325    50.9829      93.3911    50.9829      
1 1 1 -50 2  13 o 0 4.7     2.2   ?     ?   100.752   19.7976      56.6524    -160.202     143.943    -160.202     
1 1 1 -50 2  12 o 0 116.5   3.7   ?     ?   137.203   -120.828     302.326    -120.828     183.083    -120.828     
1 1 1 -50 2  11 o 0 32      2.5   ?     ?   127.154   -90.6717     74.1669    -90.6717     37.0565    89.3283      
1 1 1 -50 2  10 o 0 143.7   3.8   ?     ?   199.757   95.6909      314.395    95.6909      134.118    95.6909      
1 1 1 -50 2  9  o 0 30.7    2.6   ?     ?   133.183   178.094      57.2168    178.094      63.6576    -1.90594     
1 1 1 -50 2  8  o 0 49.8    2.3   ?     ?   154.422   -146.108     104.128    -146.108     39.1525    33.8923      
1 1 1 -50 2  7  o 0 78.2    2.7   ?     ?   144.91    -77.8031     191.897    -77.8031     56.7883    -77.8031     
1 1 1 -50 2  6  o 0 50.4    2.3   ?     ?   243.875   64.0443      52.7453    64.0443      175.657    -115.956     
1 1 1 -50 2  5  o 0 94.9    3.2   ?     ?   369.505   137.636      57.7774    137.636      295.889    -42.3644     
1 1 1 -50 2  4  o 0 515.8   10.6  ?     ?   420.938   163.137      609.161    163.137      204.743    163.137      
1 1 1 -50 2  3  o 0 254.9   5.9   ?     ?   337.557   120.931      373.173    120.931      47.7503    120.931      
1 1 1 -50 2  2  o 0 143.6   4.3   ?     ?   240.139   101.684      267.646    101.684      35.4233    101.684      
1 1 1 -50 2  1  o 0 849.9   19.7  ?     ?   503.391   137.502      837.751    137.502      349.611    137.502      
1 1 1 50  2  0  o 0 272.2   7.1   ?     ?   397.572   -169.305     349.617    -169.305     38.1301    10.6949      
1 1 1 50  2  1  o 0 13.2    3.5   ?     ?   104.861   154.118      45.4102    -25.8819     147.885    -25.8819     
1 1 1 50  2  2  o 0 290.4   7.5   ?     ?   332.132   135.153      433.896    135.153      108.776    135.153      
1 1 1 50  2  3  o 0 435.5   9.9   ?     ?   457.371   92.7884      501.831    92.7884      53.5104    92.7884      
1 1 1 50  2  4  o 0 177.3   6.1   ?     ?   222.212   111.918      347.201    111.918      129.165    111.918      
1 1 1 50  2  5  o 0 -1.4    4.3   ?     ?   46.3658   -43.057      38.3394    136.943      83.069     136.943      
1 1 1 50  2  6  o 0 203.9   7.5   ?     ?   349.945   -113.914     303.826    -113.914     33.8685    66.0859      
1 1 1 50  2  7  o 0 96.6    6.5   ?     ?   185.809   -128.959     224.759    -128.959     45.4688    -128.959     
1 1 1 50  2  8  o 0 564.6   13.8  ?     ?   432.347   148.779      685.113    148.779      275.099    148.779      
1 1 1 50  2  9  o 0 163.2   8.3   ?     ?   215.471   -50.7311     354.776    -50.7311     150.615    -50.7311     
1 1 1 50  2  10 o 0 64      8.8   ?     ?   232.24    3.98404      125.197    3.98404      89.0997    -176.016     
1 1 1 50  2  11 o 0 49.6    9.5   ?     ?   101.594   -150.82      146.74     -150.82      53.1538    -150.82      
1 1 1 50  2  12 o 0 221.5   12.4  ?     ?   304.929   108.062      387.028    108.062      105.676    108.062      
1 1 1 50  2  13 o 0 69      12.2  ?     ?   289.593   166.9        91.1415    166.9        177.718    -13.0998     
1 1 1 50  2  14 o 0 57.2    14.1  ?     ?   38.4492   142.137      144.293    142.137      105.658    142.137      
1 1 1 50  2  15 o 0 -0.2    14.4  ?     ?   55.7708   61.1615      8.7252     -118.838     64.5755    -118.838     
1 1 1 50  2  16 o 0 229.4   22.5  ?     ?   275.11    -111.795     424.542    -111.795     148.027    -111.795     
1 1 1 50  2  17 o 0 19.7    17.3  ?     ?   122.738   -102.548     44.2945    -102.548     71.9392    77.4523      
1 1 1 50  2  18 o 0 8.8     23.6  ?     ?   38.6805   -121.381     41.0757    -121.381     5.08956    -121.381     
1 1 1 50  2  19 o 0 21.5    19.2  ?     ?   104.162   73.2204      76.9377    73.2204      19.6991    -106.78      
1 1 1 50  2  20 < 0 8.3     23.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 4  20 < 1 124.6   5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 4  19 o 0 50.7    3.8   ?     ?   111.343   -170.881     184.027    -170.881     90.8431    -170.881     
1 1 1 -50 4  18 o 0 15.8    2.8   ?     ?   94.5971   -61.2843     44.7693    -61.2843     35.0006    118.716      
1 1 1 -50 4  17 o 0 79.2    3.6   ?     ?   99.574    -10.5202     256.943    -10.5202     171.068    -10.5202     
1 1 1 -50 4  16 o 0 96.4    3.7   ?     ?   159.009   22.4454      261.496    22.4454      120.189    22.4454      
1 1 1 -50 4  15 o 0 19.2    2.6   ?     ?   22.6988   149.076      22.7863    149.076      1.73408    149.076      
1 1 1 -50 4  14 o 0 323.9   7.3   ?     ?   417.258   -149.41      407.574    -149.41      20.3739    -149.41      
1 1 1 -50 4  13 o 0 43      2.4   ?     ?   283.086   -156.739     17.4991    -156.739     226.338    23.2607      
1 1 1 -50 4  12 o 0 218.7   5.2   ?     ?   382.263   -28.9235     296.546    -28.9235     32.1971    151.077      
1 1 1 -50 4  11 o 0 103.3   3.1   ?     ?   256.876   28.2931      195.647    28.2931      26.7523    -151.707     
1 1 1 -50 4  10 o 0 254.2   5.6   ?     ?   374.897   32.7861      357.969    32.7861      32.5665    32.7861      
1 1 1 -50 4  9  o 0 11.3    1.7   ?     ?   24.011    19.7641      2.08773    -160.236     23.0516    -160.236     
1 1 1 -50 4  8  f 1 15.2    1.8   ?     ?   150.134   173.704      24.897     -6.29615     160.756    -6.29615     
1 1 1 -50 4  7  o 0 108.9   4     ?     ?   184.208   5.3316       255.697    5.3316       89.0142    5.3316       
1 1 1 -50 4  6  o 0 187.9   5.1   ?     ?   262.368   -120.751     337.057    -120.751     94.4867    -120.751     
1 1 1 -50 4  5  o 0 239.7   5.8   ?     ?   346.466   -162.925     349.942    -162.925     28.2416    -162.925     
1 1 1 -50 4  4  o 0 68.3    2.7   ?     ?   173.601   76.2158      152.217    76.2158      9.60648    -103.784     
1 1 1 -50 4  3  o 0 83.5    3     ?     ?   80.0151   1.2878       196.555    1.2878       121.703    1.2878       
1 1 1 -50 4  2  o 0 185.4   4.9   ?     ?   278.304   -40.1458     325.254    -40.1458     64.0772    -40.1458     
1 1 1 -50 4  1  o 0 195.4   5.6   ?     ?   464.124   29.6426      182.307    29.6426      254.488    -150.357     
1 1 1 50  4  0  o 0 85.3    3.3   ?     ?   158.147   -132.197     208.874    -132.197     58.6008    -132.197     
1 1 1 50  4  1  o 0 15.1    3     ?     ?   196.748   -124.065     67.287     55.9346      254.594    55.9346      
1 1 1 50  4  2  o 0 65.2    3.6   ?     ?   211.67    126.769      122.915    126.769      78.9148    -53.2305     
1 1 1 50  4  3  o 0 177.6   6     ?     ?   329.192   114.253      274.4      114.253      39.8765    -65.7466     
1 1 1 50  4  4  o 0 87.2    5.8   ?     ?   199.491   157.906      190.766    157.906      0.145075   157.906      
1 1 1 50  4  5  o 0 85.2    5.2   ?     ?   256.317   -67.635      144.084    -67.635      100.965    112.365      
1 1 1 50  4  6  o 0 376.5   9.7   ?     ?   388.606   23.3265      515.835    23.3265      150.463    23.3265      
1 1 1 50  4  7  o 0 83.2    6.8   ?     ?   195.806   -122.015     195.459    -122.015     11.4028    -122.015     
1 1 1 50  4  8  f 1 162.8   7.8   ?     ?   211.8     -84.0891     353.036    -84.0891     153.048    -84.0891     
1 1 1 50  4  9  o 0 186.2   9.8   ?     ?   349.048   -113.009     291.671    -113.009     27.7324    66.9911      
1 1 1 50  4  10 o 0 107.6   10.7  ?     ?   200.182   -167.213     257.632    -167.213     74.7175    -167.213     
1 1 1 50  4  11 o 0 104.9   10.8  ?     ?   227.241   -101.384     231.452    -101.384     23.4181    -101.384     
1 1 1 50  4  12 o 0 203.8   14    ?     ?   206.615   -70.933      434.719    -70.933      244.347    -70.933      
1 1 1 50  4  13 o 0 258.3   17.5  ?     ?   290.204   9.39496      461.631    9.39496      172.16     9.39496      
1 1 1 50  4  14 o 0 56.8    15.4  ?     ?   197.336   -27.326      126.818    -27.326      69.4021    152.674      
1 1 1 50  4  15 o 0 -0.6    15    ?     ?   84.0693   -178.843     11.1601    1.15684      95.0809    1.15684      
1 1 1 50  4  16 o 0 -5.3    17.9  ?     ?   129.948   170.854      29.1153    -9.14645     153.966    -9.14645     
1 1 1 50  4  17 o 0 93.9    22.6  ?     ?   190.408   -86.6661     241.416    -86.6661     65.4045    -86.6661     
1 1 1 50  4  18 o 0 87.1    24.8  ?     ?   128.704   18.253       266.098    18.253       147.432    18.253       
1 1 1 50  4  19 < 0 20.3    24.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 6  18 < 0 20.7    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 6  17 o 0 22.9    2.9   ?     ?   147.052   -91.9308     54.6655    -91.9308     67.5795    88.0692      
1 1 1 -50 6  16 o 0 496.7   12.3  ?     ?   456.986   -133.924     562.098    -133.924     173.626    -133.924     
1 1 1 -50 6  15 o 0 436     9.1   ?     ?   382.524   -143.735     560.671    -143.735     225.651    -143.735     
1 1 1 -50 6  14 o 0 37.6    2.6   ?     ?   177.391   -138.834     78.5131    -138.834     83.6037    41.1657      
1 1 1 -50 6  13 o 0 173.9   4.4   ?     ?   214.459   -170.066     363.204    -170.066     165.662    -170.066     
1 1 1 -50 6  12 o 0 45.1    2.4   ?     ?   153.845   79.9434      119.612    79.9434      22.0902    -100.057     
1 1 1 -50 6  11 o 0 108.7   3.1   ?     ?   225.388   35.2322      227.145    35.2322      34.5631    35.2322      
1 1 1 -50 6  10 o 0 220.1   5.5   ?     ?   241.454   -138.216     406.865    -138.216     199.199    -138.216     
1 1 1 -50 6  9  o 0 234.6   5.1   ?     ?   318.75    166.632      369.671    166.632      96.2375    166.632      
1 1 1 -50 6  8  o 0 18.3    1.4   ?     ?   68.3832   134.8        21.7131    134.8        37.2837    -45.1996     
1 1 1 -50 6  7  o 0 98      3.4   ?     ?   131.58    128.692      263.158    128.692      149.465    128.692      
1 1 1 -50 6  6  o 0 329.4   7.9   ?     ?   356.769   116.916      469.854    116.916      160.08     116.916      
1 1 1 -50 6  5  o 0 23.9    1.8   ?     ?   81.7388   4.62735      43.9983    4.62735      27.2916    -175.373     
1 1 1 -50 6  4  o 0 123.7   3.7   ?     ?   158.652   -134.008     299.771    -134.008     157.287    -134.008     
1 1 1 -50 6  3  o 0 35.6    2.2   ?     ?   107.157   43.8322      81.3133    43.8322      15.278     -136.168     
1 1 1 -50 6  2  o 0 84.5    2.8   ?     ?   209.419   25.1752      182.603    25.1752      6.79198    -154.825     
1 1 1 -50 6  1  f 1 39      2.4   ?     ?   177.983   -43.4596     68.6727    -43.4596     93.5921    136.54       
1 1 1 50  6  0  o 0 89.7    3.4   ?     ?   349.876   -70.32       85.8959    -70.32       236.025    109.68       
1 1 1 50  6  1  f 1 41.3    2.8   ?     ?   220.642   -114.152     49.5752    -114.152     154.84     65.8481      
1 1 1 50  6  2  o 0 18.6    3.3   ?     ?   147.058   55.8158      4.9388     -124.184     140.676    -124.184     
1 1 1 50  6  3  o 0 78.9    4.9   ?     ?   194.441   -19.7026     182.429    -19.7026     2.76618    -19.7026     
1 1 1 50  6  4  o 0 204.6   8.4   ?     ?   160.537   -79.2124     453.469    -79.2124     305.029    -79.2124     
1 1 1 50  6  5  o 0 15.7    5     ?     ?   183.61    -62.338      32.1252    117.662      197.727    117.662      
1 1 1 50  6  6  o 0 246.9   7.7   ?     ?   335.425   -133.605     394.278    -133.605     91.7682    -133.605     
1 1 1 50  6  7  o 0 185.2   8     ?     ?   344.74    -135.002     289.75     -135.002     21.0222    44.9976      
1 1 1 50  6  8  o 0 351.4   11    ?     ?   427.153   -91.0873     453.023    -91.0873     66.834     -91.0873     
1 1 1 50  6  9  o 0 332.9   10.9  ?     ?   363.061   -20.6949     484.637    -20.6949     156.806    -20.6949     
1 1 1 50  6  10 o 0 64.9    8.6   ?     ?   129.48    -127.724     194.782    -127.724     77.0384    -127.724     
1 1 1 50  6  11 o 0 39.3    10.6  ?     ?   175.348   -136.307     86.4655    -136.307     86.2639    43.6927      
1 1 1 50  6  12 o 0 83.4    12.1  ?     ?   128.042   -5.70767     256.259    -5.70767     130.446    -5.70767     
1 1 1 50  6  13 o 0 174.9   15.4  ?     ?   229.667   -52.7353     372.776    -52.7353     146.085    -52.7353     
1 1 1 50  6  14 o 0 70.4    14.9  ?     ?   96.8239   -1.83965     241.807    -1.83965     149.767    -1.83965     
1 1 1 50  6  15 o 0 3.4     13.6  ?     ?   63.8953   -147.779     5.02649    -147.779     54.2198    32.2206      
1 1 1 50  6  16 o 0 55.6    18.9  ?     ?   264.22    -71.1655     67.005     -71.1655     173.778    108.835      
1 1 1 50  6  17 o 0 32.8    19.8  ?     ?   123.788   -124.155     99.4955    -124.155     13.0408    55.8447      
1 1 1 50  6  18 < 0 36.6    24.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 8  17 < 0 17.1    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 8  16 < 0 86.4    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 8  15 o 0 62.6    3.4   ?     ?   199.664   -92.0962     154.422    -92.0962     9.74419    87.9038      
1 1 1 -50 8  14 o 0 54.7    2.8   ?     ?   204.761   -139.649     126.682    -139.649     42.747     40.351       
1 1 1 -50 8  13 o 0 3.9     2     ?     ?   45.1301   -122.146     20.2986    57.854       58.4441    57.854       
1 1 1 -50 8  12 o 0 19.1    2.5   ?     ?   116.303   -76.1941     40.9633    -76.1941     60.2085    103.806      
1 1 1 -50 8  11 o 0 70      6.8   ?     ?   268.733   -160.59      101.453    -160.59      142.224    19.4101      
1 1 1 -50 8  10 o 0 57.8    5     ?     ?   198.785   -166.966     126.504    -166.966     54.9787    13.0342      
1 1 1 -50 8  9  o 0 127     6.3   ?     ?   250.619   -89.1378     246.359    -89.1378     17.8069    -89.1378     
1 1 1 -50 8  8  o 0 327.3   11.6  ?     ?   454.589   -85.6531     373.014    -85.6531     44.015     94.3469      
1 1 1 -50 8  7  o 0 106.3   5.9   ?     ?   237.671   -80.9305     211.341    -80.9305     9.379      -80.9305     
1 1 1 -50 8  6  o 0 18.6    4.7   ?     ?   50.8429   170.458      24.8481    170.458      18.5759    -9.54179     
1 1 1 -50 8  5  f 1 28      7.6   ?     ?   56.1117   109.935      59.0208    109.935      10.6256    109.935      
1 1 1 -50 8  4  o 0 82.9    8.6   ?     ?   136.34    120.652      222.758    120.652      106.292    120.652      
1 1 1 -50 8  3  o 0 0.7     5.3   ?     ?   167.345   -131.844     104.281    48.1558      247.781    48.1558      
1 1 1 -50 8  2  o 0 29.6    5.6   ?     ?   145.347   -94.2388     57.2425    -94.2388     67.822     85.7612      
1 1 1 -50 8  1  o 0 44.7    3.1   ?     ?   24.1332   97.03        53.8446    97.03        33.0162    97.03        
1 1 1 50  8  0  o 0 53.2    2.9   ?     ?   122.416   42.8849      153.458    42.8849      45.6812    42.8849      
1 1 1 50  8  1  o 0 22.5    3.3   ?     ?   116.039   179.575      37.6243    179.575      64.6984    -0.424895    
1 1 1 50  8  2  o 0 100.3   5     ?     ?   226.999   -155.057     215.136    -155.057     14.7262    -155.057     
1 1 1 50  8  3  o 0 58.2    4.1   ?     ?   156.747   -55.9273     154.518    -55.9273     16.0154    -55.9273     
1 1 1 50  8  4  o 0 143.5   5.8   ?     ?   294.678   -48.1562     250.87     -48.1562     9.63325    131.844      
1 1 1 50  8  5  f 1 181.8   7.9   ?     ?   173.299   121.175      410.485    121.175      255.134    121.175      
1 1 1 50  8  6  o 0 24.8    5.9   ?     ?   62.4866   145.079      53.1213    145.079      2.59028    -34.9213     
1 1 1 50  8  7  o 0 6       7     ?     ?   45.3626   6.73624      15.1833    -173.264     57.5552    -173.264     
1 1 1 50  8  8  o 0 20.4    8.6   ?     ?   121.093   14.637       29.7349    14.637       87.2512    -165.363     
1 1 1 50  8  9  o 0 210.4   11.6  ?     ?   337.348   61.2718      332.074    61.2718      4.22164    61.2718      
1 1 1 50  8  10 o 0 45.2    10.3  ?     ?   224.713   91.5947      67.6655    91.5947      150.298    -88.4053     
1 1 1 50  8  11 o 0 -8.1    17.8  ?     ?   161.106   -20.2116     49.9694    159.788      200.619    159.788      
1 1 1 50  8  12 o 0 36.5    14.4  ?     ?   113.837   -146.942     112.807    -146.942     8.86883    -146.942     
1 1 1 50  8  13 o 0 28.4    14.7  ?     ?   140.653   -102.733     63.9543    -102.733     64.0567    77.2671      
1 1 1 50  8  14 o 0 10.9    17.9  ?     ?   45.0031   -178.286     36.607     -178.286     3.67019    1.71368      
1 1 1 50  8  15 o 0 -15.7   18.8  ?     ?   97.9978   29.1049      0.83406    -150.895     88.381     -150.895     
1 1 1 50  8  16 < 0 22.4    18.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 10 14 < 0 53.8    3.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 10 13 < 0 14.5    6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 10 12 o 0 28.1    9.7   ?     ?   71.0244   -102.587     105.276    -102.587     47.7093    -102.587     
1 1 1 -50 10 11 o 0 68.1    7.9   ?     ?   174.911   -61.2721     179.623    -61.2721     37.1062    -61.2721     
1 1 1 -50 10 10 o 0 20.5    6.5   ?     ?   96.0598   -108.725     64.5737    -108.725     14.2484    71.2752      
1 1 1 -50 10 9  o 0 165.8   8.3   ?     ?   247.36    -111.108     321.444    -111.108     114.429    -111.108     
1 1 1 -50 10 8  f 1 14.4    5.9   ?     ?   114.324   1.05061      9.10262    1.05061      89.7207    -178.949     
1 1 1 -50 10 7  o 0 21      6.2   ?     ?   130.002   -132.689     42.4604    -132.689     69.9803    47.3114      
1 1 1 -50 10 6  o 0 91.4    7.6   ?     ?   306.074   122.701      129.834    122.701      136.294    -57.2991     
1 1 1 -50 10 5  o 0 63.4    7.3   ?     ?   118.17    105.223      194.563    105.223      87.7199    105.223      
1 1 1 -50 10 4  o 0 160.7   10.9  ?     ?   237.399   169.194      315.112    169.194      99.5188    169.194      
1 1 1 -50 10 3  o 0 128.4   9.3   ?     ?   243.49    -177.326     252.784    -177.326     30.7761    -177.326     
1 1 1 -50 10 2  o 0 50.7    7.3   ?     ?   150.095   141.174      140.21     141.174      2.8688     141.174      
1 1 1 -50 10 1  o 0 38.3    7.8   ?     ?   49.6641   0.870694     109.859    0.870694     64.2714    0.870694     
1 1 1 50  10 0  o 0 107.8   4     ?     ?   162.777   -138.613     285.398    -138.613     132.01     -138.613     
1 1 1 50  10 1  o 0 1.3     3.6   ?     ?   15.962    -98.7235     10.2547    81.2765      25.3165    81.2765      
1 1 1 50  10 2  o 0 160.3   7.1   ?     ?   330.992   113.437      246.082    113.437      66.5516    -66.5632     
1 1 1 50  10 3  o 0 52.5    5.8   ?     ?   151.471   57.8421      150.391    57.8421      7.23436    57.8421      
1 1 1 50  10 4  o 0 98.1    8.1   ?     ?   155.842   11.1622      268.151    11.1622      120.832    11.1622      
1 1 1 50  10 5  o 0 48.3    8.2   ?     ?   265.275   170.552      51.386     170.552      190.895    -9.4481      
1 1 1 50  10 6  o 0 104.3   9.8   ?     ?   258.628   -143.085     205.917    -143.085     30.1574    36.9145      
1 1 1 50  10 7  o 0 39.4    8.6   ?     ?   93.2405   15.1794      135.532    15.1794      50.5058    15.1794      
1 1 1 50  10 8  f 1 103.2   11.3  ?     ?   206.69    39.7445      248.66     39.7445      63.4197    39.7445      
1 1 1 50  10 9  o 0 115.2   15.9  ?     ?   169.889   170.595      298.202    170.595      146.996    170.595      
1 1 1 50  10 10 o 0 -3.8    12.1  ?     ?   77.4481   164.157      11.7138    -15.843      79.5945    -15.843      
1 1 1 50  10 11 o 0 2       17.5  ?     ?   84.4858   127.07       28.0586    127.07       45.9601    -52.9303     
1 1 1 50  10 12 < 0 -11.9   17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 50  10 13 < 0 53.8    17.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 12 9  < 0 15.7    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 12 8  < 0 5.6     7.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 12 7  < 0 69.9    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -50 12 6  o 0 110.3   9.8   ?     ?   259.73    -153.853     210.179    -153.853     1.26414    -153.853     
1 1 1 -50 12 5  f 1 69.1    8.2   ?     ?   193.259   174.788      169.722    174.788      12.6879    174.788      
1 1 1 -50 12 4  o 0 156.8   11    ?     ?   238.691   125.384      312.545    125.384      118.701    125.384      
1 1 1 -50 12 3  o 0 81.4    8.9   ?     ?   179.894   -164.714     207.911    -164.714     61.5392    -164.714     
1 1 1 -50 12 2  o 0 140     8.9   ?     ?   293.641   -174.752     242.704    -174.752     2.89392    -174.752     
1 1 1 -50 12 1  o 0 103.5   5     ?     ?   222.405   178.087      229.261    178.087      47.0305    178.087      
1 1 1 50  12 0  o 0 15.9    3.6   ?     ?   25.1427   -27.266      26.7272    -27.266      5.43253    -27.266      
1 1 1 50  12 1  o 0 7.4     4.8   ?     ?   58.3219   -34.2821     1.92461    145.718      51.3766    145.718      
1 1 1 50  12 2  o 0 52      5.7   ?     ?   211.613   -69.276      115.458    -69.276      64.1055    110.724      
1 1 1 50  12 3  o 0 46      6.5   ?     ?   140.352   -78.9299     152.249    -78.9299     32.8434    -78.9299     
1 1 1 50  12 4  o 0 81.8    7.6   ?     ?   180.786   80.5687      221.546    80.5687      67.7491    80.5687      
1 1 1 50  12 5  f 1 242.1   13    ?     ?   261.283   82.5097      440.021    82.5097      216.701    82.5097      
1 1 1 50  12 6  < 0 72      10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 50  12 7  < 0 119.9   11.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 50  12 8  < 0 1.5     16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 1  20 < 0 105.3   4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 1  19 f 1 5.2     3.3   ?     ?   87.7973   -89.3453     26.3259    90.6547      101.119    90.6547      
1 1 1 -51 1  18 o 0 1.2     2.8   ?     ?   100.586   -60.0774     63.0109    119.923      150.203    119.923      
1 1 1 -51 1  17 o 0 75.3    3.6   ?     ?   218.576   -67.8546     167.679    -67.8546     27.5692    112.145      
1 1 1 -51 1  16 o 0 124.7   4.3   ?     ?   209.225   -7.92033     281.236    -7.92033     86.1723    -7.92033     
1 1 1 -51 1  15 o 0 1.8     2.5   ?     ?   119.167   140.378      86.0083    -39.6219     197.177    -39.6219     
1 1 1 -51 1  14 o 0 80      3.3   ?     ?   227.3     -67.1795     164.214    -67.1795     32.6243    112.821      
1 1 1 -51 1  13 o 0 167.7   4.5   ?     ?   340.685   -113.898     251.527    -113.898     43.0581    66.102       
1 1 1 -51 1  12 o 0 136.6   3.8   ?     ?   237.646   -94.3728     278.394    -94.3728     71.5019    -94.3728     
1 1 1 -51 1  11 o 0 500.4   10    ?     ?   505.826   4.96362      534.971    4.96362      93.4477    4.96362      
1 1 1 -51 1  10 f 1 587.6   11.3  ?     ?   412.056   68.5295      698.898    68.5295      335.207    68.5295      
1 1 1 -51 1  9  o 0 18.1    1.9   ?     ?   96.457    120.041      9.00243    120.041      78.3462    -59.9592     
1 1 1 -51 1  8  o 0 229     5.3   ?     ?   376.85    -161.39      317.4      -161.39      25.6415    18.6105      
1 1 1 -51 1  7  f 1 11.9    1.9   ?     ?   260.631   -31.1496     130.874    148.85       374.565    148.85       
1 1 1 -51 1  6  o 0 284.3   7.4   ?     ?   179.637   10.6701      543.594    10.6701      375.745    10.6701      
1 1 1 -51 1  5  o 0 627.2   13.4  ?     ?   535.184   58.0951      622.706    58.0951      120.588    58.0951      
1 1 1 -51 1  4  o 0 86      3.5   ?     ?   286.696   83.4414      104.879    83.4414      169.913    -96.5586     
1 1 1 -51 1  3  o 0 107.8   4.1   ?     ?   235.35    50.9176      195.26     50.9176      31.0902    -129.082     
1 1 1 -51 1  2  o 0 269.6   6.3   ?     ?   398.399   7.31577      341.518    7.31577      42.8326    -172.684     
1 1 1 -51 1  1  o 0 34.6    2.8   ?     ?   154.053   49.9926      25.8471    49.9926      123.184    -130.007     
1 1 1 51  1  0  o 0 381.1   9.2   ?     ?   328.71    118.696      548.787    118.696      229.462    118.696      
1 1 1 51  1  1  o 0 44.7    3.2   ?     ?   133.99    107.162      68.2997    107.162      62.1329    -72.8378     
1 1 1 51  1  2  o 0 94.7    4.2   ?     ?   254.972   -147.279     152.883    -147.279     95.7526    32.7213      
1 1 1 51  1  3  o 0 361.5   8.9   ?     ?   431.473   144.383      436.872    144.383      15.5308    144.383      
1 1 1 51  1  4  o 0 122.7   5.7   ?     ?   187.964   56.4398      281.613    56.4398      101.076    56.4398      
1 1 1 51  1  5  o 0 162.9   6.2   ?     ?   353.518   52.761       228.602    52.761       111.19     -127.239     
1 1 1 51  1  6  o 0 45.5    5.6   ?     ?   283.762   157.001      5.217      157.001      267.623    -22.9995     
1 1 1 51  1  7  f 1 161.9   7.3   ?     ?   359.86    167.761      219.411    167.761      128.368    -12.2394     
1 1 1 51  1  8  o 0 396     12    ?     ?   327.229   173.393      595.199    173.393      285.957    173.393      
1 1 1 51  1  9  o 0 8.6     7.5   ?     ?   74.1953   16.9986      27.277     -163.001     97.3374    -163.001     
1 1 1 51  1  10 f 1 3.6     8.6   ?     ?   86.6456   -73.0411     38.1796    106.959      118.273    106.959      
1 1 1 51  1  11 o 0 26.7    10.5  ?     ?   79.5052   174.271      52.2228    174.271      21.0506    -5.72874     
1 1 1 51  1  12 o 0 134.8   11.8  ?     ?   251.364   100.57       277.268    100.57       46.0774    100.57       
1 1 1 51  1  13 o 0 58.3    12.5  ?     ?   145.781   78.1171      167.152    78.1171      32.2263    78.1171      
1 1 1 51  1  14 o 0 54.3    14.6  ?     ?   126.115   6.01906      172.163    6.01906      45.8186    6.01906      
1 1 1 51  1  15 o 0 3.1     16.1  ?     ?   12.8062   94.4653      2.7183     94.4653      10.1652    -85.5347     
1 1 1 51  1  16 o 0 24      19.4  ?     ?   168.339   -1.59048     26.6907    -1.59048     136.359    178.41       
1 1 1 51  1  17 o 0 -10.2   22.2  ?     ?   25.3357   106.207      7.68818    106.207      16.2414    -73.7926     
1 1 1 51  1  18 o 0 33      23.3  ?     ?   134.238   31.4752      89.3259    31.4752      35.2467    -148.525     
1 1 1 51  1  19 f 1 43.4    19.9  ?     ?   271.513   -19.5585     15.5352    -19.5585     237.053    160.442      
1 1 1 51  1  20 < 0 32.9    24.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 3  20 < 0 21.5    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 3  19 o 0 108.5   4.4   ?     ?   232.134   121.258      240.255    121.258      45.5246    121.258      
1 1 1 -51 3  18 o 0 139.6   4.9   ?     ?   198.467   -55.7569     326.194    -55.7569     158.461    -55.7569     
1 1 1 -51 3  17 o 0 37.4    2.8   ?     ?   141.105   -113.421     113.082    -113.421     8.86955    66.5795      
1 1 1 -51 3  16 o 0 40.9    2.8   ?     ?   175.445   -44.864      98.1438    -44.864      58.0847    135.136      
1 1 1 -51 3  15 o 0 98.1    3.4   ?     ?   130.891   -69.3676     281.831    -69.3676     160.202    -69.3676     
1 1 1 -51 3  14 o 0 51.6    3     ?     ?   147.468   136.686      146.06     136.686      8.96643    136.686      
1 1 1 -51 3  13 o 0 -1.2    2.2   ?     ?   52.7447   71.3434      40.7615    -108.657     86.2715    -108.657     
1 1 1 -51 3  12 o 0 31.1    2.4   ?     ?   180.621   20.9226      46.0151    20.9226      109.572    -159.077     
1 1 1 -51 3  11 o 0 31.8    2.3   ?     ?   132.147   -101.96      73.0364    -101.96      41.5517    78.0402      
1 1 1 -51 3  10 o 0 60.3    2.4   ?     ?   181.929   166.508      143.173    166.508      14.9689    -13.4915     
1 1 1 -51 3  9  o 0 26.2    2     ?     ?   269.299   -78.8803     36.4744    101.12       271.926    101.12       
1 1 1 -51 3  8  o 0 184.7   4.8   ?     ?   316.938   -103.983     295.406    -103.983     9.68982    -103.983     
1 1 1 -51 3  7  o 0 27.4    2     ?     ?   105.885   -125.143     48.9837    -125.143     46.9497    54.8573      
1 1 1 -51 3  6  o 0 22.6    2.1   ?     ?   150.712   -134.782     1.39604    45.218       140.908    45.218       
1 1 1 -51 3  5  o 0 158.7   4.3   ?     ?   251.665   145.628      296.925    145.628      62.9706    145.628      
1 1 1 -51 3  4  o 0 243.3   5.9   ?     ?   300.63    -171.806     395.386    -171.806     114.823    -171.806     
1 1 1 -51 3  3  o 0 74.1    2.8   ?     ?   235.702   -165.497     128.416    -165.497     92.331     14.5027      
1 1 1 -51 3  2  o 0 114.7   3.8   ?     ?   172.68    -177.354     267.755    -177.354     105.517    -177.354     
1 1 1 -51 3  1  o 0 78.5    3.4   ?     ?   186.109   -50.9401     174.591    -50.9401     0.760764   129.06       
1 1 1 51  3  0  o 0 91.8    3.8   ?     ?   162.984   -62.8713     222.745    -62.8713     67.9567    -62.8713     
1 1 1 51  3  1  o 0 0.2     3.4   ?     ?   76.8959   92.6792      63.266     -87.3208     136.439    -87.3208     
1 1 1 51  3  2  o 0 176.1   6.1   ?     ?   374.292   107.47       232.08     107.47       124.681    -72.5302     
1 1 1 51  3  3  o 0 258.1   7.2   ?     ?   454.333   96.9798      290.611    96.9798      143.012    -83.0202     
1 1 1 51  3  4  o 0 84.2    4.7   ?     ?   214.579   57.4258      172.904    57.4258      32.0927    -122.574     
1 1 1 51  3  5  o 0 66.8    5.2   ?     ?   215.344   -71.8377     125.066    -71.8377     80.7884    108.162      
1 1 1 51  3  6  o 0 23.9    5.4   ?     ?   138.405   62.7354      25.4686    62.7354      104.659    -117.265     
1 1 1 51  3  7  o 0 92.1    6.6   ?     ?   130.551   66.7549      254.28     66.7549      131.554    66.7549      
1 1 1 51  3  8  o 0 89.8    7.4   ?     ?   189.516   107.974      216.2      107.974      38.1369    107.974      
1 1 1 51  3  9  o 0 6.6     6.8   ?     ?   163.368   -118.195     76.9284    61.8052      226.463    61.8052      
1 1 1 51  3  10 o 0 165.5   10.1  ?     ?   247.151   57.8797      338.914    57.8797      112.993    57.8797      
1 1 1 51  3  11 o 0 165     11.3  ?     ?   301.996   133.97       292.371    133.97       15.7609    133.97       
1 1 1 51  3  12 o 0 88.1    11.9  ?     ?   252.768   -104.652     171.614    -104.652     61.4284    75.3481      
1 1 1 51  3  13 o 0 12.2    13.8  ?     ?   63.85     -83.8121     14.9591    -83.8121     48.7775    96.1879      
1 1 1 51  3  14 o 0 102.9   14.2  ?     ?   155.223   -139.051     289.507    -139.051     135.026    -139.051     
1 1 1 51  3  15 o 0 1.7     17.5  ?     ?   77.3677   -173.371     4.43758    -173.371     72.872     6.62899      
1 1 1 51  3  16 o 0 8.5     14.3  ?     ?   36.4001   53.7197      9.80702    53.7197      25.2058    -126.28      
1 1 1 51  3  17 o 0 46.7    18.5  ?     ?   52.6881   -25.6409     155.941    -25.6409     107.173    -25.6409     
1 1 1 51  3  18 o 0 31.2    27.1  ?     ?   99.7209   77.651       111.042    77.651       18.9653    77.651       
1 1 1 -51 5  19 < 0 28.9    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 5  18 o 0 38.2    3.3   ?     ?   172.247   -79.283      102.128    -79.283      40.8769    100.717      
1 1 1 -51 5  17 o 0 13.4    2.9   ?     ?   61.949    -139.675     33.7923    -139.675     18.0169    40.3254      
1 1 1 -51 5  16 o 0 70.6    3.3   ?     ?   245.502   145.516      136.741    145.516      73.1914    -34.4844     
1 1 1 -51 5  15 o 0 90.8    3.8   ?     ?   187.581   -161.355     226.322    -161.355     61.0794    -161.355     
1 1 1 -51 5  14 o 0 282.2   6.5   ?     ?   373.183   -161.042     385.532    -161.042     42.5326    -161.042     
1 1 1 -51 5  13 o 0 71.6    3     ?     ?   123.058   -58.5863     215.93     -58.5863     102.791    -58.5863     
1 1 1 -51 5  12 o 0 92.3    3.1   ?     ?   161.159   15.3646      246.086    15.3646      96.8281    15.3646      
1 1 1 -51 5  11 o 0 37.2    2.1   ?     ?   185.386   15.9313      68.9774    15.9313      90.2837    -164.069     
1 1 1 -51 5  10 f 1 27      1.9   ?     ?   108.234   175.44       58.2582    175.44       34.9906    -4.56046     
1 1 1 -51 5  9  o 0 117.4   3.3   ?     ?   171.792   136.188      283.645    136.188      135.502    136.188      
1 1 1 -51 5  8  o 0 218.7   5.3   ?     ?   270.554   147.33       388.414    147.33       154.668    147.33       
1 1 1 -51 5  7  o 0 112.3   3.7   ?     ?   233.575   84.9213      233.247    84.9213      30.3923    84.9213      
1 1 1 -51 5  6  o 0 22.5    2     ?     ?   86.6964   -134.651     38.4937    -134.651     37.1639    45.349       
1 1 1 -51 5  5  f 1 92.7    3.6   ?     ?   57.0393   -56.6235     212.284    -56.6235     160.746    -56.6235     
1 1 1 -51 5  4  o 0 6.7     1.8   ?     ?   49.4789   47.8362      23.8263    -132.164     68.4841    -132.164     
1 1 1 -51 5  3  o 0 70      2.9   ?     ?   305.439   -26.8635     71.7222    -26.8635     204.966    153.137      
1 1 1 -51 5  2  o 0 365.1   8.2   ?     ?   423.343   -102.119     455.621    -102.119     70.8658    -102.119     
1 1 1 -51 5  1  o 0 10.9    2.8   ?     ?   189.66    -121.909     74.6972    58.0905      247.573    58.0905      
1 1 1 51  5  0  o 0 21.6    2.8   ?     ?   192.67    -65.8189     14.08      114.181      191.888    114.181      
1 1 1 51  5  1  o 0 37.4    3.1   ?     ?   152.353   -79.2901     77.9567    -79.2901     62.9045    100.71       
1 1 1 51  5  2  o 0 67.5    3.8   ?     ?   248.675   57.7197      112.22     57.7197      118.047    -122.28      
1 1 1 51  5  3  o 0 15.9    3.7   ?     ?   118.489   -35.8365     8.18288    144.164      118.029    144.164      
1 1 1 51  5  4  o 0 570.6   13    ?     ?   567.654   -74.5035     555.027    -74.5035     28.3497    -74.5035     
1 1 1 51  5  5  f 1 8.6     5     ?     ?   86.4846   76.0344      36.2675    -103.966     116.958    -103.966     
1 1 1 51  5  6  o 0 12.1    5.1   ?     ?   45.2088   51.8313      4.33774    -128.169     45.26      -128.169     
1 1 1 51  5  7  o 0 19.7    5.8   ?     ?   44.8769   -11.1969     19.9312    -11.1969     20.6777    168.803      
1 1 1 51  5  8  o 0 386.7   12.5  ?     ?   385.038   -45.3389     533.108    -45.3389     183.625    -45.3389     
1 1 1 51  5  9  o 0 90.4    8.4   ?     ?   188.158   -32.6456     224.688    -32.6456     54.0955    -32.6456     
1 1 1 51  5  10 f 1 40.2    11.4  ?     ?   133.07    174.45       110.759    174.45       11.3838    -5.54953     
1 1 1 51  5  11 o 0 70.9    10.8  ?     ?   184.778   -60.8614     177.131    -60.8614     8.72218    -60.8614     
1 1 1 51  5  12 o 0 -3.9    12.9  ?     ?   141.752   6.04184      62.7816    -173.958     202.693    -173.958     
1 1 1 51  5  13 o 0 78.2    14.5  ?     ?   193.873   -21.4712     195.014    -21.4712     2.76044    -21.4712     
1 1 1 51  5  14 o 0 -1.7    15.3  ?     ?   149.372   95.6528      43.7036    -84.3472     186.381    -84.3472     
1 1 1 51  5  15 o 0 59.5    14.4  ?     ?   121.771   12.0389      200.98     12.0389      87.5059    12.0389      
1 1 1 51  5  16 o 0 22.9    16.8  ?     ?   193.109   -69.1759     11.6559    -69.1759     165.23     110.824      
1 1 1 51  5  17 o 0 22.6    23.2  ?     ?   129.244   -72.3324     67.3045    -72.3324     50.8173    107.668      
1 1 1 51  5  18 < 0 101.4   25.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 7  17 < 0 5.9     3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 7  16 o 0 220.1   6.4   ?     ?   310.143   -124.878     361.133    -124.878     105.906    -124.878     
1 1 1 -51 7  15 o 0 17.4    2.6   ?     ?   65.5001   -129.049     54.9954    -129.049     0.731065   -129.049     
1 1 1 -51 7  14 o 0 102.9   3.7   ?     ?   147.385   94.9665      281.197    94.9665      156.425    94.9665      
1 1 1 -51 7  13 o 0 44.5    2.6   ?     ?   165.42    82.7748      115.196    82.7748      28.9802    -97.2252     
1 1 1 -51 7  12 o 0 67.2    2.6   ?     ?   206.762   124.883      146.351    124.883      41.5601    -55.1166     
1 1 1 -51 7  11 o 0 9.9     1.7   ?     ?   41.2574   93.3615      2.10073    93.3615      35.6647    -86.6385     
1 1 1 -51 7  10 o 0 186.3   6     ?     ?   199.877   -159.238     393.545    -159.238     210.722    -159.238     
1 1 1 -51 7  9  o 0 481.2   14.1  ?     ?   364.282   -157.136     625.295    -157.136     289.994    -157.136     
1 1 1 -51 7  8  o 0 236.3   8.7   ?     ?   366.798   -149.53      327.307    -149.53      14.4631    -149.53      
1 1 1 -51 7  7  o 0 21.1    4.3   ?     ?   152.579   -153.82      21.0314    -153.82      109.814    26.1796      
1 1 1 -51 7  6  f 1 176.1   7.1   ?     ?   326.089   139.411      272.177    139.411      7.86159    -40.5895     
1 1 1 -51 7  5  o 0 120.1   6.4   ?     ?   131.432   59.9897      308.291    59.9897      195.478    59.9897      
1 1 1 -51 7  4  o 0 71.1    5.3   ?     ?   103.602   142.555      204.062    142.555      114.762    142.555      
1 1 1 -51 7  3  o 0 79.3    5.9   ?     ?   268.326   -149.573     130.996    -149.573     101.168    30.4267      
1 1 1 -51 7  2  o 0 136.7   5.7   ?     ?   120.263   169.833      346.75     169.833      242.733    169.833      
1 1 1 -51 7  1  o 0 8.9     2     ?     ?   138.835   -3.80396     48.8666    176.196      169.31     176.196      
1 1 1 51  7  0  o 0 1.6     2.3   ?     ?   136.685   136.448      100.248    -43.5521     220.942    -43.5521     
1 1 1 51  7  1  o 0 58.6    3.6   ?     ?   218.603   -150.638     115.686    -150.638     77.6677    29.362       
1 1 1 51  7  2  o 0 6.6     3.3   ?     ?   78.886    6.10531      36.2443    -173.895     106.112    -173.895     
1 1 1 51  7  3  o 0 157.8   5.6   ?     ?   231.166   -52.0156     328.602    -52.0156     122.891    -52.0156     
1 1 1 51  7  4  o 0 38.7    4.2   ?     ?   108.316   -26.3114     107.468    -26.3114     11.0215    -26.3114     
1 1 1 51  7  5  o 0 10.5    4.7   ?     ?   51.9974   20.0751      9.5506     -159.925     55.8608    -159.925     
1 1 1 51  7  6  f 1 -10.3   6.1   ?     ?   24.3427   -6.28501     18.1795    173.715      39.9678    173.715      
1 1 1 51  7  7  o 0 53.2    7.1   ?     ?   159.394   -97.9052     142.036    -97.9052     1.06665    82.0948      
1 1 1 51  7  8  o 0 92.5    7.5   ?     ?   255.577   13.1026      177.07     13.1026      52.1671    -166.897     
1 1 1 51  7  9  o 0 205.9   9.9   ?     ?   290.791   45.9732      371.14     45.9732      88.3947    45.9732      
1 1 1 51  7  10 o 0 76.4    10.9  ?     ?   191.007   -126.945     190.633    -126.945     5.23999    -126.945     
1 1 1 51  7  11 o 0 78.5    12.1  ?     ?   162.576   -52.7548     219.614    -52.7548     60.9814    -52.7548     
1 1 1 51  7  12 o 0 38.8    13.4  ?     ?   52.2009   -102.996     115.098    -102.996     66.0069    -102.996     
1 1 1 51  7  13 o 0 -9.9    14.1  ?     ?   45.0978   -139.563     8.96967    40.4375      50.3703    40.4375      
1 1 1 51  7  14 o 0 24.7    14.9  ?     ?   129.778   -65.7189     62.4454    -65.7189     54.7325    114.281      
1 1 1 51  7  15 o 0 214.3   20.4  ?     ?   266.139   -76.7058     413.278    -76.7058     173.373    -76.7058     
1 1 1 51  7  16 < 0 87.6    21    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 9  15 < 0 -0.2    2.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 9  14 < 0 5       2.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 9  13 o 0 50.2    2.4   ?     ?   165.848   -127.639     143.14     -127.639     7.937      -127.639     
1 1 1 -51 9  12 o 0 84      6.4   ?     ?   258.539   -82.2168     158.783    -82.2168     53.1712    97.7832      
1 1 1 -51 9  11 o 0 26.7    5.6   ?     ?   158.795   -107.378     56.0642    -107.378     76.8196    72.6218      
1 1 1 -51 9  10 o 0 114.1   6.6   ?     ?   199.186   172.441      266.326    172.441      98.4769    172.441      
1 1 1 -51 9  9  o 0 42.2    8.4   ?     ?   205.861   -19.4843     76.0542    -19.4843     102.273    160.516      
1 1 1 -51 9  8  o 0 151.9   6.9   ?     ?   269.386   -14.5398     280.848    -14.5398     46.067     -14.5398     
1 1 1 -51 9  7  o 0 115.6   8.5   ?     ?   277.841   16.8977      197.728    16.8977      54.2787    -163.102     
1 1 1 -51 9  6  o 0 60.4    7.8   ?     ?   52.263    11.8271      181.426    11.8271      133.775    11.8271      
1 1 1 -51 9  5  f 1 32.2    4.9   ?     ?   205.76    96.7166      33.197     96.7166      154.867    -83.2834     
1 1 1 -51 9  4  o 0 123.6   7.9   ?     ?   358.276   160.807      147.808    160.807      179.406    -19.1934     
1 1 1 -51 9  3  o 0 30.2    6.2   ?     ?   144.86    -131.241     67.7457    -131.241     65.079     48.7587      
1 1 1 -51 9  2  o 0 80      7.1   ?     ?   188.669   -84.4079     193.798    -84.4079     20.1917    -84.4079     
1 1 1 -51 9  1  o 0 27.1    5.5   ?     ?   34.6482   149.337      48.386     149.337      16.4041    149.337      
1 1 1 51  9  0  o 0 14.4    2.5   ?     ?   149.764   -121.206     12.1158    58.7941      153.682    58.7941      
1 1 1 51  9  1  o 0 105.4   4.5   ?     ?   259.667   -35.2393     202.421    -35.2393     43.3986    144.761      
1 1 1 51  9  2  o 0 40.6    4.2   ?     ?   113.082   -16.5207     128.492    -16.5207     21.3209    -16.5207     
1 1 1 51  9  3  o 0 189.4   7.8   ?     ?   292.734   -27.4055     333.898    -27.4056     56.2563    -27.4056     
1 1 1 51  9  4  o 0 20.9    5.5   ?     ?   157.971   158.711      18.2199    158.711      131.662    -21.2887     
1 1 1 51  9  5  f 1 370     15.4  ?     ?   454.902   151.895      432.429    151.895      4.64476    -28.105      
1 1 1 51  9  6  o 0 176.7   9.2   ?     ?   184.398   164.064      405.077    164.064      228.885    164.064      
1 1 1 51  9  7  o 0 -5.3    8.9   ?     ?   51.9074   92.7253      26.3075    -87.2747     75.8644    -87.2747     
1 1 1 51  9  8  o 0 84.3    9.5   ?     ?   193.409   165.448      213.64     165.448      35.4245    165.448      
1 1 1 51  9  9  o 0 118.6   9.9   ?     ?   194.962   -171.052     289.376    -171.052     110.024    -171.052     
1 1 1 51  9  10 o 0 -4.9    11.4  ?     ?   78.0141   143.738      22.7681    -36.2616     92.8955    -36.2616     
1 1 1 51  9  11 o 0 90.2    13    ?     ?   197.54    -94.0102     230.302    -94.0102     55.48      -94.0102     
1 1 1 51  9  12 o 0 26.9    12.4  ?     ?   96.9126   -124.968     97.9094    -124.968     12.1981    -124.968     
1 1 1 51  9  13 o 0 11.6    14.1  ?     ?   79.1959   -38.1214     43.9771    -38.1214     25.8332    141.879      
1 1 1 51  9  14 < 0 20.6    17    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 11 11 < 0 2.8     7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 11 10 < 0 50.7    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 11 9  o 0 30      6.8   ?     ?   152.32    -157.375     80.7519    -157.375     41.7486    22.6252      
1 1 1 -51 11 8  o 0 27.4    6.5   ?     ?   145.372   -152.095     75.7594    -152.095     41.8914    27.9054      
1 1 1 -51 11 7  o 0 181     11.2  ?     ?   313.626   170.874      292.883    170.874      38.1452    170.874      
1 1 1 -51 11 6  o 0 60.2    7.4   ?     ?   254.394   135.996      101.202    135.996      106.546    -44.0039     
1 1 1 -51 11 5  f 1 1.7     8     ?     ?   50.9858   141.802      8.68932    -38.1979     50.749     -38.1979     
1 1 1 -51 11 4  o 0 68.6    9.3   ?     ?   184.206   -159.145     170.485    -159.145     16.6127    -159.145     
1 1 1 -51 11 3  o 0 114.5   10.1  ?     ?   187.003   -129.256     272.899    -129.256     116.047    -129.256     
1 1 1 -51 11 2  f 1 20.9    8.6   ?     ?   54.4229   152.581      50.4151    152.581      4.36326    152.581      
1 1 1 -51 11 1  o 0 25.9    8     ?     ?   83.5657   -60.0538     83.1077    -60.0538     12.528     -60.0538     
1 1 1 51  11 0  o 0 14.9    3.3   ?     ?   51.8555   39.6164      31.4194    39.6164      13.7349    -140.384     
1 1 1 51  11 1  o 0 30      4.3   ?     ?   136.93    -143.14      87.1242    -143.14      32.2627    36.8603      
1 1 1 51  11 2  f 1 -4.4    5.4   ?     ?   56.7992   115.76       34.5814    -64.2403     84.4028    -64.2403     
1 1 1 51  11 3  o 0 3.5     6     ?     ?   90.422    89.6846      31.9495    -90.3154     110.897    -90.3154     
1 1 1 51  11 4  o 0 85.1    7.6   ?     ?   250.415   70.7978      170.364    70.7978      48.299     -109.202     
1 1 1 51  11 5  f 1 27      7.4   ?     ?   114.924   116.889      89.9804    116.889      9.54424    -63.1114     
1 1 1 51  11 6  o 0 41      8.1   ?     ?   165.675   -161.493     113.036    -161.493     29.6061    18.5068      
1 1 1 51  11 7  o 0 91.4    9.9   ?     ?   211.705   51.4506      221.939    51.4506      39.4562    51.4506      
1 1 1 51  11 8  o 0 40.4    10.2  ?     ?   183.538   34.7447      98.856     34.7447      59.1088    -145.255     
1 1 1 51  11 9  < 0 12.7    13.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 51  11 10 < 0 25.1    13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -51 13 1  < 1 43.9    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 51  13 0  < 0 27.1    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 0  20 < 0 179.1   11.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 0  19 o 0 84.2    6.6   ?     ?   225.082   0            198.481    0            7.92758    0            
1 1 1 -52 0  18 o 0 138.2   7.6   ?     ?   178.565   180          257.149    180          104.903    180          
1 1 1 -52 0  17 o 0 64.9    5.1   ?     ?   194.223   180          177.49     180          8.20893    180          
1 1 1 -52 0  16 o 0 21.4    4.1   ?     ?   14.1086   180          15.2131    180          2.54791    180          
1 1 1 -52 0  15 o 0 136.3   6     ?     ?   69.2831   180          250.348    180          185.468    180          
1 1 1 -52 0  14 o 0 6       3.6   ?     ?   188.62    0            30.6689    0            145.984    180          
1 1 1 -52 0  13 o 0 13.6    3     ?     ?   143.65    180          58.2401    180          66.5862    6.13721e-15  
1 1 1 -52 0  12 o 0 9.2     3     ?     ?   3.16999   0            0.934054   0            1.81511    180          
1 1 1 -52 0  11 o 0 13.5    3     ?     ?   22.2029   0            10.3407    0            9.03701    180          
1 1 1 -52 0  10 o 0 75.5    4.7   ?     ?   289.29    180          192.364    180          60.6644    2.22497e-14  
1 1 1 -52 0  9  o 0 239.9   7.9   ?     ?   210.737   180          345.407    180          155.329    180          
1 1 1 -52 0  8  o 0 386.7   12    ?     ?   330.083   180          440.815    180          141.549    180          
1 1 1 -52 0  7  o 0 321.1   9.4   ?     ?   314.513   0            403.725    0            117.204    0            
1 1 1 -52 0  6  o 0 2061    51.9  ?     ?   865.806   0            1025.93    0            220.217    0            
1 1 1 -52 0  5  o 0 118.4   4.8   ?     ?   149.353   0            237.327    0            97.772     0            
1 1 1 -52 0  4  o 0 60.8    3.6   ?     ?   239.798   180          173.687    180          51.2212    2.3793e-14   
1 1 1 -52 0  3  o 0 48.3    3.2   ?     ?   107.847   0            113.517    0            12.021     0            
1 1 1 -52 0  2  f 1 274.4   8.2   ?     ?   408.466   0            380.324    0            7.25916    180          
1 1 1 -52 0  1  o 0 4.8     3.5   ?     ?   9.7514    180          0.684473   180          8.71054    5.51372e-16  
1 1 1 52  0  0  o 0 251.1   10.3  ?     ?   360.927   180          365.51     180          16.924     -180         
1 1 1 52  0  1  o 0 478.2   15.7  ?     ?   404.627   180          505.543    180          113.924    180          
1 1 1 52  0  2  f 1 310.9   11.4  ?     ?   396.54    180          408.36     180          28.653     180          
1 1 1 52  0  3  o 0 120.5   7.2   ?     ?   232.831   180          253.251    180          31.1219    180          
1 1 1 52  0  4  o 0 351.4   13.7  ?     ?   333.319   0            435.134    0            116.784    0            
1 1 1 52  0  5  o 0 4       6.9   ?     ?   183.509   180          16.5207    180          158.879    7.29614e-16  
1 1 1 52  0  6  o 0 127.4   9.5   ?     ?   423.774   180          261.803    180          143.402    1.28101e-14  
1 1 1 52  0  7  o 0 60.3    9.7   ?     ?   256.809   180          177.09     180          64.3689    1.93042e-14  
1 1 1 52  0  8  o 0 393.4   16.7  ?     ?   339.478   180          460.476    180          141.406    180          
1 1 1 52  0  9  o 0 -4.4    9.9   ?     ?   79.3886   180          7.14894    180          65.5545    7.65196e-16  
1 1 1 52  0  10 o 0 -1.9    11.3  ?     ?   72.0518   0            8.62976    0            57.2787    180          
1 1 1 52  0  11 o 0 23.5    12.1  ?     ?   198.538   180          82.4773    180          99.5336    5.81431e-15  
1 1 1 52  0  12 o 0 270.5   20.7  ?     ?   263.787   0            378.207    0            134.738    0            
1 1 1 52  0  13 o 0 87.6    20.5  ?     ?   208.387   0            217.585    0            16.4181    0            
1 1 1 52  0  14 o 0 19.4    19.9  ?     ?   11.2592   0            6.93217    0            4.29068    180          
1 1 1 52  0  15 o 0 358.9   30.7  ?     ?   295.905   0            450.634    0            154.417    0            
1 1 1 52  0  16 o 0 15.7    25.8  ?     ?   123.112   0            61.6029    0            57.0628    180          
1 1 1 52  0  17 o 0 29.8    30    ?     ?   73.734    180          64.0833    180          5.22865    8.59981e-14  
1 1 1 52  0  18 o 0 26.6    30.1  ?     ?   51.3467   180          58.9973    180          11.4611    180          
1 1 1 -52 2  20 < 0 3.1     2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 2  19 f 1 26.8    3.5   ?     ?   141.716   -88.2069     80.538     -88.2069     38.9997    91.7931      
1 1 1 -52 2  18 o 0 80.2    3.8   ?     ?   215.722   -62.1515     188.889    -62.1515     6.52266    -62.1515     
1 1 1 -52 2  17 o 0 18.9    2.4   ?     ?   159.245   -77.597      22.6713    -77.597      114.983    102.403      
1 1 1 -52 2  16 o 0 106.5   3.8   ?     ?   127.805   7.27368      304.338    7.27368      190.523    7.27368      
1 1 1 -52 2  15 o 0 27      2.6   ?     ?   22.0945   -40.8012     39.1565    -40.8012     18.6257    -40.8012     
1 1 1 -52 2  14 o 0 216.9   5.3   ?     ?   340.547   -116.26      329.626    -116.26      13.0681    -116.26      
1 1 1 -52 2  13 o 0 102.4   3.5   ?     ?   188.958   -95.0572     241.944    -95.0572     78.9355    -95.0572     
1 1 1 -52 2  12 o 0 87.4    3.2   ?     ?   181.724   -96.0778     211.944    -96.0778     55.4489    -96.0778     
1 1 1 -52 2  11 o 0 210.7   5     ?     ?   271.171   11.7135      375.82     11.7135      140.761    11.7135      
1 1 1 -52 2  10 o 0 94.2    3.4   ?     ?   175.071   70.9624      233.684    70.9624      81.565     70.9624      
1 1 1 -52 2  9  o 0 71.8    2.7   ?     ?   75.7819   40.5976      198.122    40.5976      131.897    40.5976      
1 1 1 -52 2  8  o 0 10.6    2.4   ?     ?   110.786   72.0574      33.4462    -107.943     133.266    -107.943     
1 1 1 -52 2  7  o 0 154.3   4.2   ?     ?   232.181   26.6255      311.515    26.6255      101.275    26.6255      
1 1 1 -52 2  6  o 0 70.8    2.7   ?     ?   120.431   13.8233      194.56     13.8233      85.008     13.8233      
1 1 1 -52 2  5  o 0 271.5   6     ?     ?   293.461   154.685      439.263    154.685      166.629    154.685      
1 1 1 -52 2  4  o 0 250.4   5.8   ?     ?   315.797   160.228      392.853    160.228      98.3306    160.228      
1 1 1 -52 2  3  o 0 66.3    2.8   ?     ?   156.24    -103.081     155.407    -103.081     9.17931    -103.081     
1 1 1 -52 2  2  f 1 167.8   5.5   ?     ?   217.194   -58.8538     341.1      -58.8538     136.13     -58.8538     
1 1 1 -52 2  1  f 1 147.2   4.5   ?     ?   212.436   -71.3764     307.773    -71.3764     106.724    -71.3764     
1 1 1 52  2  0  o 0 3.2     3.6   ?     ?   61.0403   -7.06824     45.0024    172.932      102.836    172.932      
1 1 1 52  2  1  f 1 36.3    3.1   ?     ?   241.671   33.5003      3.45277    33.5003      227.169    -146.5       
1 1 1 52  2  2  f 1 77.9    3.9   ?     ?   80.0037   176.32       185.606    176.32       109.128    176.32       
1 1 1 52  2  3  o 0 290.4   7.7   ?     ?   316.368   108.115      456.96     108.115      155.667    108.115      
1 1 1 52  2  4  o 0 391.4   10.3  ?     ?   352.703   66.3781      553.174    66.3781      216.929    66.3781      
1 1 1 52  2  5  o 0 8.5     4.8   ?     ?   89.515    101.531      46.6299    -78.4693     132.026    -78.4693     
1 1 1 52  2  6  o 0 115.4   7.5   ?     ?   248.983   114.715      230.765    114.715      2.86907    -65.2853     
1 1 1 52  2  7  o 0 53.1    6.3   ?     ?   75.5737   87.4575      136.47     87.4575      65.5593    87.4575      
1 1 1 52  2  8  o 0 7.4     6.8   ?     ?   73.4108   -155.566     26.3395    24.4345      93.4759    24.4345      
1 1 1 52  2  9  o 0 32.2    7.4   ?     ?   49.5372   -151.106     60.3403    -151.106     15.0752    -151.106     
1 1 1 52  2  10 o 0 43.4    9.2   ?     ?   162.647   24.496       105.018    24.496       43.9764    -155.504     
1 1 1 52  2  11 o 0 51.6    9.6   ?     ?   81.7481   -177.548     150.37     -177.548     75.6075    -177.548     
1 1 1 52  2  12 o 0 112.2   12.6  ?     ?   251.933   -106.1       227.707    -106.1       4.23623    73.9         
1 1 1 52  2  13 o 0 59.4    12.4  ?     ?   169.557   -98.7126     161.386    -98.7126     7.64925    81.2874      
1 1 1 52  2  14 o 0 105.1   15.8  ?     ?   148.682   -16.4895     301.302    -16.4895     152.398    -16.4895     
1 1 1 52  2  15 o 0 -20.2   18.4  ?     ?   143.752   94.6811      56.2502    -85.3189     194.909    -85.3189     
1 1 1 52  2  16 o 0 75.5    16.9  ?     ?   174.588   93.397       210.029    93.397       45.7517    93.397       
1 1 1 52  2  17 o 0 42      19.8  ?     ?   143.13    105.85       115.663    105.85       16.7102    -74.1497     
1 1 1 52  2  18 o 0 33      19.6  ?     ?   126.421   29.8433      99.3737    29.8433      17.279     -150.157     
1 1 1 -52 4  19 < 0 49.3    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 4  18 f 1 30.1    3.1   ?     ?   103.305   -120.533     116.792    -120.533     30.2287    -120.533     
1 1 1 -52 4  17 o 0 41.2    3     ?     ?   45.3095   19.4294      139.032    19.4294      100.987    19.4294      
1 1 1 -52 4  16 o 0 153.5   4.8   ?     ?   97.9934   -95.9913     409.596    -95.9912     325.473    -95.9912     
1 1 1 -52 4  15 o 0 61.1    3.4   ?     ?   201.552   -86.1262     141.091    -86.1262     37.1325    93.8738      
1 1 1 -52 4  14 o 0 188.5   5.2   ?     ?   255.114   -169.618     353.86     -169.618     118.512    -169.618     
1 1 1 -52 4  13 o 0 27.1    2.4   ?     ?   166.244   103.929      42.8606    103.929      110.533    -76.0712     
1 1 1 -52 4  12 o 0 34.4    2.2   ?     ?   68.3766   176.101      94.1886    176.101      32.8134    176.101      
1 1 1 -52 4  11 f 1 119.6   3.6   ?     ?   220.73    173.321      253.824    173.321      62.5726    173.321      
1 1 1 -52 4  10 o 0 21      2.2   ?     ?   119.283   -73.732      29.0629    -73.732      73.5216    106.268      
1 1 1 -52 4  9  o 0 14.2    2.1   ?     ?   63.8837   -109.993     5.19739    -109.993     50.072     70.0065      
1 1 1 -52 4  8  o 0 2.2     1.9   ?     ?   95.4207   -79.3414     67.4536    100.659      150.156    100.659      
1 1 1 -52 4  7  o 0 1.5     1.8   ?     ?   186.453   -79.7567     139.789    100.243      302.227    100.243      
1 1 1 -52 4  6  o 0 25.7    2.1   ?     ?   255.175   -98.0369     37.3969    81.9631      266.472    81.9631      
1 1 1 -52 4  5  o 0 43.9    2.3   ?     ?   150.663   49.8874      100.451    49.8874      35.3953    -130.113     
1 1 1 -52 4  4  o 0 15.8    2.1   ?     ?   174.907   -147.581     34.3634    32.4193      192.704    32.4193      
1 1 1 -52 4  3  o 0 319.6   7     ?     ?   469.244   176.358      360.409    176.358      65.9369    -3.64209     
1 1 1 -52 4  2  o 0 156.6   4.4   ?     ?   246.763   157.819      306.626    157.819      81.6861    157.819      
1 1 1 -52 4  1  o 0 41.5    2.9   ?     ?   172       85.2953      82.3395    85.2953      74.9063    -94.7047     
1 1 1 52  4  0  o 0 60.4    3.1   ?     ?   141.586   -170.952     143.706    -170.952     10.675     -170.952     
1 1 1 52  4  1  o 0 290.6   7.3   ?     ?   235.546   -144.967     527.926    -144.967     309.888    -144.967     
1 1 1 52  4  2  o 0 48.5    3.9   ?     ?   127.432   -2.22006     127.625    -2.22006     9.4745     -2.22006     
1 1 1 52  4  3  o 0 142.7   5.4   ?     ?   314.945   -63.714      230.112    -63.714      62.2622    116.286      
1 1 1 52  4  4  o 0 288.1   7.8   ?     ?   403.301   -49.6097     385.232    -49.6097     10.4917    -49.6097     
1 1 1 52  4  5  o 0 166     6.6   ?     ?   294.208   136.444      290.891    136.444      17.3681    136.444      
1 1 1 52  4  6  o 0 63.5    6.1   ?     ?   181.006   96.4746      158.74     96.4746      5.37961    -83.5254     
1 1 1 52  4  7  o 0 18.1    6.1   ?     ?   99.8924   -126.511     13.8697    -126.511     76.6853    53.4891      
1 1 1 52  4  8  o 0 101.8   7.9   ?     ?   250.403   -78.2211     205.901    -78.2211     20.9612    101.779      
1 1 1 52  4  9  o 0 47.3    7.7   ?     ?   89.617    122.078      138.415    122.078      56.999     122.078      
1 1 1 52  4  10 o 0 100.3   9.3   ?     ?   200.702   156.983      241.648    156.983      57.972     156.983      
1 1 1 52  4  11 f 1 16.4    10.4  ?     ?   159.176   -95.73       13.5203    84.27        159.676    84.27        
1 1 1 52  4  12 o 0 56.3    11.6  ?     ?   187.819   -169.967     136.251    -169.967     49.5818    10.0335      
1 1 1 52  4  13 o 0 34.6    13.1  ?     ?   111.16    69.987       103.909    69.987       6.60646    -110.013     
1 1 1 52  4  14 o 0 -29.9   18.8  ?     ?   99.2643   -82.0969     38.3609    97.9031      133.434    97.9031      
1 1 1 52  4  15 o 0 60.7    18.3  ?     ?   140.768   21.7206      185.165    21.7206      53.6124    21.7206      
1 1 1 52  4  16 o 0 59.4    20.9  ?     ?   93.7269   -63.6597     200.849    -63.6597     114.738    -63.6597     
1 1 1 52  4  17 o 0 41.1    26.9  ?     ?   102.086   -0.161393    134.671    -0.161393    41.0743    -0.161393    
1 1 1 52  4  18 < 1 49.8    23.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 6  18 < 0 7.1     3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 6  17 < 0 9.4     2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 6  16 o 0 183.1   6     ?     ?   298.645   134.722      317.765    134.722      70.0653    134.722      
1 1 1 -52 6  15 o 0 144.9   4.3   ?     ?   292.323   85.9931      259.815    85.9931      15.7555    85.9931      
1 1 1 -52 6  14 o 0 91.5    3.4   ?     ?   243.413   94.7531      188.495    94.7531      19.1488    -85.2469     
1 1 1 -52 6  13 o 0 35.2    2.5   ?     ?   149.048   73.7427      94.093     73.7427      36.7973    -106.257     
1 1 1 -52 6  12 o 0 274.1   6.3   ?     ?   259.186   -2.91368     472.104    -2.91368     234.788    -2.91368     
1 1 1 -52 6  11 o 0 48.2    2.2   ?     ?   212.313   -61.415      86.6539    -61.415      107.666    118.585      
1 1 1 -52 6  10 o 0 257.5   5.9   ?     ?   302.409   -166.312     418.686    -166.312     140.062    -166.312     
1 1 1 -52 6  9  o 0 365.4   7.5   ?     ?   421.064   169.907      444.251    169.907      84.6452    169.907      
1 1 1 -52 6  8  o 0 44.3    2     ?     ?   131.9     176.233      123.257    176.233      9.95467    176.233      
1 1 1 -52 6  7  o 0 81.1    3.2   ?     ?   295.137   80.5041      113.982    80.5041      138.694    -99.4959     
1 1 1 -52 6  6  o 0 58.6    2.6   ?     ?   314.375   90.322       40.6075    90.322       229.878    -89.678      
1 1 1 -52 6  5  o 0 1.5     1.6   ?     ?   50.9867   13.0487      37.7253    -166.951     81.6289    -166.951     
1 1 1 -52 6  4  o 0 41.4    2.1   ?     ?   107.163   -98.0323     112.299    -98.0323     19.6384    -98.0323     
1 1 1 -52 6  3  f 1 94.4    3.1   ?     ?   270.71    -61.3392     165.334    -61.3392     70.8339    118.661      
1 1 1 -52 6  2  o 0 321.8   7     ?     ?   303.525   -110.259     504.895    -110.259     240.56     -110.259     
1 1 1 -52 6  1  o 0 200.5   5.2   ?     ?   368.103   -153.08      286.686    -153.08      34.8531    26.9198      
1 1 1 52  6  0  o 0 8.5     2.6   ?     ?   133.42    175.918      50.0968    -4.08154     168.464    -4.08154     
1 1 1 52  6  1  o 0 35.1    3.1   ?     ?   126.2     57.7479      88.0302    57.7479      24.1326    -122.252     
1 1 1 52  6  2  o 0 82.8    4.2   ?     ?   194.707   31.3394      198.814    31.3394      25.5136    31.3394      
1 1 1 52  6  3  f 1 193.3   6.1   ?     ?   247.483   6.22411      377.348    6.22411      155.698    6.22411      
1 1 1 52  6  4  o 0 20.3    5.8   ?     ?   110.695   -74.5998     25.3919    -74.5998     73.3132    105.4        
1 1 1 52  6  5  o 0 30      7.3   ?     ?   84.1738   -32.8657     71.3257    -32.8657     4.04096    147.134      
1 1 1 52  6  6  o 0 79.9    6.7   ?     ?   185.638   140.455      198.159    140.455      31.9482    140.455      
1 1 1 52  6  7  o 0 130     9.1   ?     ?   270.936   34.6066      245.948    34.6067      3.46449    34.6067      
1 1 1 52  6  8  o 0 120.1   8.3   ?     ?   308.075   35.2998      195.878    35.2998      82.0353    -144.7       
1 1 1 52  6  9  o 0 1.8     8.2   ?     ?   108.264   129.944      52.132     -50.0561     154.4      -50.0561     
1 1 1 52  6  10 o 0 66      9.5   ?     ?   275.983   179.622      90.1667    179.622      179.326    -0.378495    
1 1 1 52  6  11 o 0 13.9    11.6  ?     ?   116.572   122.974      7.84025    122.974      106.611    -57.0259     
1 1 1 52  6  12 o 0 53.5    12.9  ?     ?   250.769   50.6647      70.1157    50.6647      175.485    -129.335     
1 1 1 52  6  13 o 0 -6.6    14.6  ?     ?   38.1405   -112.518     6.34837    67.4818      42.3412    67.4818      
1 1 1 52  6  14 o 0 -5.3    14.6  ?     ?   47.3211   106.811      3.64364    -73.1886     47.2249    -73.1886     
1 1 1 52  6  15 o 0 53.1    16    ?     ?   191.911   -66.7422     129.954    -66.7422     43.8376    113.258      
1 1 1 52  6  16 o 0 11.5    18.3  ?     ?   183.303   -26.1999     8.98751    153.8        174.669    153.8        
1 1 1 52  6  17 < 0 33.7    21    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 8  15 < 0 16.9    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 8  14 o 0 138.3   4.1   ?     ?   224.653   92.8397      296.589    92.8397      112.827    92.8397      
1 1 1 -52 8  13 o 0 3       1.7   ?     ?   65.3549   165.321      31.7453    -14.6786     85.525     -14.6786     
1 1 1 -52 8  12 o 0 10      1.5   ?     ?   95.4197   -116.761     1.20532    -116.761     78.9721    63.2394      
1 1 1 -52 8  11 o 0 4.9     5.2   ?     ?   55.4478   -151.939     18.4241    28.0608      66.3568    28.0608      
1 1 1 -52 8  10 o 0 59.5    6.7   ?     ?   211.834   9.51647      125.312    9.51647      59.0773    -170.484     
1 1 1 -52 8  9  o 0 95.9    6.8   ?     ?   187.312   -60.284      229.727    -60.284      59.911     -60.284      
1 1 1 -52 8  8  o 0 174.5   7.4   ?     ?   276.714   -40.1007     308.278    -40.1007     55.8961    -40.1007     
1 1 1 -52 8  7  o 0 55.2    5.7   ?     ?   207.745   51.6718      110.387    51.6718      78.7334    -128.328     
1 1 1 -52 8  6  o 0 3.8     5.1   ?     ?   147.279   100.248      79.8833    -79.7517     214.652    -79.7517     
1 1 1 -52 8  5  o 0 8.7     5.6   ?     ?   194.043   94.913       82.583     -85.087      260.988    -85.087      
1 1 1 -52 8  4  f 1 80.3    6.7   ?     ?   26.1552   -142.675     128.555    -142.675     106.192    -142.675     
1 1 1 -52 8  3  o 0 457.2   15.3  ?     ?   482.149   -90.6904     488.982    -90.6904     77.2371    -90.6904     
1 1 1 -52 8  1  o 0 377.8   9.7   ?     ?   346.869   70.4406      521.389    70.4406      223.202    70.4406      
1 1 1 52  8  0  o 0 18.8    2.8   ?     ?   69.6933   179.665      30.9827    179.665      30.2236    -0.3352      
1 1 1 52  8  1  o 0 76.5    4     ?     ?   234.343   -98.4758     152.605    -98.4758     53.5335    81.5242      
1 1 1 52  8  2  o 0 13.6    3.4   ?     ?   138.189   22.484       12.3547    -157.516     134.064    -157.516     
1 1 1 52  8  3  o 0 16.1    4.1   ?     ?   149.016   -5.99972     3.34687    174          134.708    174          
1 1 1 52  8  4  f 1 23.6    5     ?     ?   94.6859   134.948      55.3249    134.948      32.6779    -45.052      
1 1 1 52  8  5  o 0 236.9   8.6   ?     ?   371.198   97.0362      341.726    97.0362      13.7099    -82.9638     
1 1 1 52  8  6  o 0 178.9   8.3   ?     ?   311.94    90.6855      301.727    90.6855      3.11115    90.6855      
1 1 1 52  8  7  o 0 52      7.8   ?     ?   122.423   106.726      169.454    106.726      51.4574    106.726      
1 1 1 52  8  8  o 0 1.9     8.9   ?     ?   92.4209   -19.9086     33.5869    160.091      122.571    160.091      
1 1 1 52  8  9  o 0 -0.8    9.1   ?     ?   123.124   19.4712      53.8644    -160.529     168.25     -160.529     
1 1 1 52  8  10 o 0 35.7    11.7  ?     ?   147.295   -133.135     91.0706    -133.135     45.513     46.8654      
1 1 1 52  8  11 o 0 73.7    12.7  ?     ?   244.668   -94.221      147.857    -94.221      73.7777    85.779       
1 1 1 52  8  12 o 0 13.8    14.2  ?     ?   134.373   -123.437     18.4303    -123.437     101.38     56.5628      
1 1 1 52  8  13 o 0 6.8     15.1  ?     ?   57.8503   -36.6701     36.1868    -36.6701     15.3474    143.33       
1 1 1 52  8  14 < 0 37.1    17.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 52  8  15 < 0 7.2     18.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 10 12 < 0 9.9     5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 10 11 < 0 10.9    5.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 10 10 o 0 47.9    7     ?     ?   159.631   176.153      137.307    176.153      7.79886    176.153      
1 1 1 -52 10 9  o 0 27.8    8.1   ?     ?   165.781   164.974      58.3546    164.974      76.7395    -15.0261     
1 1 1 -52 10 8  o 0 131.8   11.3  ?     ?   276.045   131.833      240.777    131.833      14.4229    131.833      
1 1 1 -52 10 7  o 0 117.4   7.2   ?     ?   197.48    122.083      271.63     122.083      106.607    122.083      
1 1 1 -52 10 6  o 0 97.4    7.5   ?     ?   284.827   48.5887      165.086    48.5887      74.2069    -131.411     
1 1 1 -52 10 5  f 1 0.3     6.5   ?     ?   115.147   58.8037      56.7903    -121.196     156.587    -121.196     
1 1 1 -52 10 4  o 0 139.7   8.6   ?     ?   229.946   -179.556     288.224    -179.556     89.0589    -179.556     
1 1 1 -52 10 3  o 0 243.6   12.4  ?     ?   255.202   -49.8714     432.554    -49.8714     210.612    -49.8714     
1 1 1 -52 10 2  o 0 38.7    8.8   ?     ?   65.2816   -29.9865     123.576    -29.9865     66.5947    -29.9865     
1 1 1 -52 10 1  o 0 26      6.2   ?     ?   36.5539   -100.284     55.1524    -100.284     23.143     -100.284     
1 1 1 52  10 0  o 0 18.4    3     ?     ?   78.2573   98.9158      47.0651    98.9158      23.4035    -81.0842     
1 1 1 52  10 1  o 0 82.4    4.7   ?     ?   226.601   8.58091      180.328    8.5809       24.0084    -171.419     
1 1 1 52  10 2  o 0 99.9    6.7   ?     ?   212.627   114.358      232.552    114.358      40.6192    114.358      
1 1 1 52  10 3  o 0 56.7    8.6   ?     ?   121.957   179.292      183.726    179.292      73.5663    179.292      
1 1 1 52  10 4  o 0 91.6    7.4   ?     ?   233.925   135.22       195.747    135.22       15.6059    -44.7805     
1 1 1 52  10 5  f 1 11      8.3   ?     ?   123.097   107.744      6.40668    -72.2563     115.853    -72.2563     
1 1 1 52  10 6  o 0 138.9   9.7   ?     ?   187.915   4.08577      336.324    4.08577      170.19     4.08577      
1 1 1 52  10 7  o 0 39      8.9   ?     ?   203.483   56.1567      72.9735    56.1567      106.757    -123.843     
1 1 1 52  10 8  o 0 70.8    10.4  ?     ?   146.94    -173.233     216.708    -173.233     88.7833    -173.233     
1 1 1 52  10 9  o 0 21      9     ?     ?   42.8432   -154.678     70.9259    -154.678     33.6086    -154.678     
1 1 1 52  10 10 o 0 120.1   13.5  ?     ?   231.869   -8.28493     267.031    -8.28493     65.5044    -8.28493     
1 1 1 52  10 11 < 0 53.5    14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 52  10 12 < 0 25.6    20    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 12 7  < 0 77.7    8.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 12 6  < 0 32.8    7.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 12 5  < 0 45.6    9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 12 4  < 0 20.8    9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 12 3  < 0 74.5    10.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 12 2  o 0 6.3     8     ?     ?   18.6411   129.171      5.73534    129.171      9.32446    -50.8294     
1 1 1 -52 12 1  o 0 22.8    9.6   ?     ?   58.7887   39.2884      80.5526    39.2884      32.8982    39.2884      
1 1 1 52  12 0  o 0 85.2    4.8   ?     ?   190.192   2.21805      221.298    2.21805      61.6365    2.21805      
1 1 1 52  12 1  o 0 14.4    4.4   ?     ?   48.6258   -71.6319     48.0581    -71.6319     7.18921    -71.6319     
1 1 1 52  12 2  < 0 13.8    5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 52  12 3  < 0 125.6   8     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 52  12 4  < 0 94.9    8.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 52  12 5  < 0 33.3    15.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 52  12 6  < 0 9.8     8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 1  19 < 0 61.2    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 1  18 o 0 123     4.9   ?     ?   205.214   -154.565     289.222    -154.565     116.024    -154.565     
1 1 1 -53 1  17 o 0 42.4    3.2   ?     ?   133.947   -159.59      134.574    -159.59      18.9889    -159.59      
1 1 1 -53 1  16 o 0 31.5    3.1   ?     ?   116.101   -37.8187     98.6032    -37.8187     4.60177    142.181      
1 1 1 -53 1  15 o 0 128.5   4.2   ?     ?   202.914   -101.797     292.42     -101.797     104.224    -101.797     
1 1 1 -53 1  14 o 0 53.1    2.9   ?     ?   174.642   -65.0622     131.995    -65.0622     30.0238    114.938      
1 1 1 -53 1  13 o 0 281.4   6.7   ?     ?   360.6     103.201      406.11     103.201      69.1126    103.201      
1 1 1 -53 1  12 o 0 21.1    2.4   ?     ?   117.617   -59.2065     36.6819    -59.2065     65.2776    120.794      
1 1 1 -53 1  11 o 0 13      2     ?     ?   75.1795   -65.0022     1.0645     114.998      66.0905    114.998      
1 1 1 -53 1  10 f 1 8.1     1.8   ?     ?   162.986   -173.053     67.1058    6.94702      209.67     6.94702      
1 1 1 -53 1  9  o 0 378.7   8.5   ?     ?   454.666   -109.651     448.729    -109.651     52.3033    -109.651     
1 1 1 -53 1  8  o 0 20.7    2     ?     ?   107.994   -127.562     28.7237    -127.562     65.9373    52.4382      
1 1 1 -53 1  7  o 0 132.7   3.7   ?     ?   237.59    13.0767      266.297    13.0767      51.6671    13.0767      
1 1 1 -53 1  6  o 0 44.7    2.3   ?     ?   143.762   45.3411      106.805    45.3411      23.6569    -134.659     
1 1 1 -53 1  5  o 0 116     3.6   ?     ?   244.357   165.229      229.589    165.229      6.9047     165.229      
1 1 1 -53 1  4  o 0 368.6   7.9   ?     ?   536.126   -170.872     352.377    -170.872     146.414    9.12842      
1 1 1 -53 1  3  f 1 54.8    2.6   ?     ?   78.8414   33.226       118.327    33.226       44.3395    33.226       
1 1 1 -53 1  2  o 0 162.6   4.5   ?     ?   266.224   64.5835      294.764    64.5835      45.4206    64.5835      
1 1 1 -53 1  1  o 0 88.1    3.5   ?     ?   311.852   135.312      104.145    135.312      188.762    -44.6884     
1 1 1 53  1  0  o 0 85.4    3.9   ?     ?   247.379   143.609      149.772    143.609      83.6166    -36.3915     
1 1 1 53  1  1  o 0 59.8    3.4   ?     ?   114.993   162.463      146.648    162.463      37.9297    162.463      
1 1 1 53  1  2  o 0 6.1     3.3   ?     ?   121.643   -109.951     78.1466    70.0488      193.357    70.0488      
1 1 1 53  1  3  f 1 286.8   7.8   ?     ?   336.569   75.5584      431.449    75.5584      110.576    75.5584      
1 1 1 53  1  4  o 0 112.2   5.3   ?     ?   257.406   51.687       205.558    51.687       38.856     -128.313     
1 1 1 53  1  5  o 0 102.2   5.6   ?     ?   148.279   -62.3707     269.721    -62.3707     131.176    -62.3707     
1 1 1 53  1  6  o 0 15.8    5.5   ?     ?   78.7865   -25.5873     1.50306    154.413      75.1456    154.413      
1 1 1 53  1  7  o 0 15.5    5.9   ?     ?   63.7946   164.9        0.96822    -15.0999     60.5978    -15.0999     
1 1 1 53  1  8  o 0 53.5    6.2   ?     ?   215.329   -171.05      104.941    -171.05      91.2446    8.9498       
1 1 1 53  1  9  o 0 177.4   9     ?     ?   249.766   175.384      357.015    175.384      129.63     175.384      
1 1 1 53  1  10 f 1 12.9    8.1   ?     ?   270.728   -13.5136     116.293    166.486      364.672    166.486      
1 1 1 53  1  11 o 0 13.4    10.5  ?     ?   37.9235   105.645      6.39692    105.645      28.4664    -74.3548     
1 1 1 53  1  12 o 0 35.6    11.7  ?     ?   87.9099   4.64627      96.9319    4.64627      16.2757    4.64627      
1 1 1 53  1  13 o 0 12.5    12.7  ?     ?   202.621   -62.6496     58.3716    117.35       259.693    117.35       
1 1 1 53  1  14 o 0 63.6    15.7  ?     ?   39.2072   38.2214      176.103    38.2214      136.965    38.2214      
1 1 1 53  1  15 o 0 116.3   18.6  ?     ?   137.94    -9.78274     335.635    -9.78274     203        -9.78274     
1 1 1 53  1  16 o 0 1       17.3  ?     ?   43.8967   53.9343      11.8161    53.9343      29.3633    -126.066     
1 1 1 53  1  17 o 0 1.9     20.6  ?     ?   45.0624   -115.849     27.5561    -115.849     13.9987    64.151       
1 1 1 53  1  18 o 0 14      24.5  ?     ?   52.4593   -86.504      73.8869    -86.504      25.6157    -86.504      
1 1 1 53  1  19 < 0 23.8    25.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 3  19 < 1 71      4.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 3  18 o 0 192.9   5.9   ?     ?   306.113   -78.8719     329.342    -78.8719     73.6064    -78.8719     
1 1 1 -53 3  17 o 0 9.6     2.5   ?     ?   84.6462   -121.331     8.88807    -121.331     62.3309    58.6694      
1 1 1 -53 3  16 o 0 14.5    2.5   ?     ?   68.0142   -127.545     32.1308    -127.545     26.3682    52.4549      
1 1 1 -53 3  15 o 0 12.2    3     ?     ?   63.1722   -134.927     14.3659    -134.927     41.5966    45.0727      
1 1 1 -53 3  14 o 0 86.2    3.3   ?     ?   149.134   -150.807     240.699    -150.807     102.883    -150.807     
1 1 1 -53 3  13 o 0 15.3    2.5   ?     ?   54.418    -118.684     19.8146    -118.684     30.4792    61.316       
1 1 1 -53 3  12 o 0 216.4   5.4   ?     ?   296.399   -144.802     375.06     -144.802     108.597    -144.802     
1 1 1 -53 3  11 o 0 158.3   5.3   ?     ?   295.085   -107.641     269.012    -107.641     14.2675    -107.641     
1 1 1 -53 3  10 o 0 14.6    2     ?     ?   15.0923   158.627      2.67317    158.627      10.3245    -21.3731     
1 1 1 -53 3  9  o 0 24.8    2.1   ?     ?   7.9578    14.2439      7.27025    14.2439      0.376328   14.2439      
1 1 1 -53 3  8  o 0 144.6   4.2   ?     ?   247.079   136.131      286.112    136.131      71.6922    136.131      
1 1 1 -53 3  7  o 0 68.5    2.7   ?     ?   137.838   93.5563      190.03     93.5563      69.7987    93.5563      
1 1 1 -53 3  6  o 0 47.9    2.4   ?     ?   183.901   28.1863      95.9084    28.1863      69.3764    -151.814     
1 1 1 -53 3  5  o 0 211.3   5.6   ?     ?   213.534   -135.6       418.808    -135.6       226.053    -135.6       
1 1 1 -53 3  4  o 0 91.9    3.2   ?     ?   145.109   156.274      239.569    156.274      108.059    156.274      
1 1 1 -53 3  3  f 1 54.8    2.6   ?     ?   165.575   40.9471      129.447    40.9471      21.9306    -139.053     
1 1 1 -53 3  2  f 1 128.7   4     ?     ?   258.187   36.5922      244.08     36.5922      7.26021    36.5922      
1 1 1 -53 3  1  o 0 281.3   6.6   ?     ?   403.918   26.7472      369.988    26.7472      0.318008   26.7472      
1 1 1 53  3  0  o 0 358.5   8.8   ?     ?   431.234   96.1687      447.88     96.1687      49.7812    96.1687      
1 1 1 53  3  1  o 0 80.1    3.9   ?     ?   111.06    -98.3938     224.237    -98.3938     121.504    -98.3938     
1 1 1 53  3  2  f 1 57.7    4     ?     ?   248.737   -96.7173     82.5863    -96.7173     149.076    83.2827      
1 1 1 53  3  3  f 1 126.4   5     ?     ?   223.308   -124.972     270.651    -124.972     62.3924    -124.972     
1 1 1 53  3  4  o 0 4.6     3.9   ?     ?   80.9123   -146.54      50.0624    33.46        125.211    33.46        
1 1 1 53  3  5  o 0 120.4   5.8   ?     ?   277.794   179.708      216.304    179.708      41.8654    -0.29178     
1 1 1 53  3  6  o 0 -6.6    4.9   ?     ?   64.7479   54.9432      50.1672    -125.057     108.859    -125.057     
1 1 1 53  3  7  o 0 155.9   7.2   ?     ?   272.988   -135.035     298.986    -135.035     51.5582    -135.035     
1 1 1 53  3  8  o 0 119.2   8.1   ?     ?   272.678   -108.149     226.442    -108.149     20.5819    71.8511      
1 1 1 53  3  9  o 0 67.8    8     ?     ?   180.786   139.206      171.002    139.206      6.75383    139.206      
1 1 1 53  3  10 o 0 65.7    9.3   ?     ?   182.621   149.209      166.304    149.209      0.847028   -30.7909     
1 1 1 53  3  11 o 0 22.2    10.7  ?     ?   178.318   -120.805     2.87352    -120.805     160.061    59.1948      
1 1 1 53  3  12 o 0 197     14.6  ?     ?   273.082   -93.1521     376.663    -93.1521     106.368    -93.1521     
1 1 1 53  3  13 o 0 18.9    12.1  ?     ?   79.2422   80.4559      41.6564    80.4559      37.1654    -99.5441     
1 1 1 53  3  14 o 0 18.1    14.2  ?     ?   72.5437   141.912      41.4497    141.912      28.0742    -38.0878     
1 1 1 53  3  15 o 0 -8.2    15.2  ?     ?   63.6598   134.807      9.28436    -45.1935     68.8216    -45.1935     
1 1 1 53  3  16 o 0 -11.5   14.5  ?     ?   109.812   -92.3016     28.6854    87.6984      129.665    87.6984      
1 1 1 53  3  17 o 0 4.1     14.7  ?     ?   56.2643   -77.1673     28.4752    -77.1673     23.1639    102.833      
1 1 1 53  3  18 < 0 43      23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 5  18 < 0 27      3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 5  17 o 0 111.9   4.1   ?     ?   217.08    85.4535      255.273    85.4535      75.8326    85.4535      
1 1 1 -53 5  16 o 0 85.5    3.7   ?     ?   258.674   50.9092      165.745    50.9092      49.5656    -129.091     
1 1 1 -53 5  15 o 0 57.1    2.9   ?     ?   164.411   9.44107      159.203    9.44107      19.3294    9.44107      
1 1 1 -53 5  14 f 1 14.5    2.2   ?     ?   61.6279   12.7466      25.8596    12.7466      28.4107    -167.253     
1 1 1 -53 5  13 o 0 118.4   3.6   ?     ?   172.475   -0.696173    291.635    -0.696173    134.031    -0.696173    
1 1 1 -53 5  12 o 0 68      2.7   ?     ?   98.5557   25.0912      220.799    25.0912      130.07     25.0912      
1 1 1 -53 5  11 o 0 29.4    2.1   ?     ?   154.651   170.093      60.2519    170.093      82.0473    -9.90708     
1 1 1 -53 5  10 f 1 225     5.3   ?     ?   342.169   155.655      330.592    155.655      37.1497    155.655      
1 1 1 -53 5  9  o 0 179.2   5     ?     ?   319.798   167.689      282.618    167.689      8.08337    167.689      
1 1 1 -53 5  8  o 0 59.8    2.6   ?     ?   189.285   65.6046      135.356    65.6046      26.6501    -114.395     
1 1 1 -53 5  7  o 0 154.5   4.2   ?     ?   314.701   -1.9722      248.343    -1.9722      22.4405    178.028      
1 1 1 -53 5  6  o 0 45.2    2.3   ?     ?   168.178   13.937       104.84     13.937       40.5819    -166.063     
1 1 1 -53 5  5  o 0 29.6    2.2   ?     ?   70.9196   -47.8064     62.769     -47.8064     1.39944    -47.8064     
1 1 1 -53 5  4  o 0 36.6    2.3   ?     ?   316.532   -157.578     31.4414    22.4223      306.483    22.4223      
1 1 1 -53 5  3  o 0 13.1    2.2   ?     ?   100.8     -129.01      8.12783    50.9903      96.0443    50.9903      
1 1 1 -53 5  2  f 1 414.4   8.6   ?     ?   492.583   172.865      456.188    172.865      22.8973    172.865      
1 1 1 -53 5  1  o 0 110.5   3.9   ?     ?   267.595   146.583      206.181    146.583      28.7024    -33.4171     
1 1 1 53  5  0  o 0 73.1    3.5   ?     ?   214.313   -153.374     160.208    -153.374     30.4538    26.626       
1 1 1 53  5  1  o 0 18.3    3.1   ?     ?   148.018   -70.2741     2.97817    -70.274      128.954    109.726      
1 1 1 53  5  2  f 1 261.8   6.9   ?     ?   245.963   -11.4141     482.494    -11.4141     261.791    -11.4141     
1 1 1 53  5  3  o 0 155.3   6.7   ?     ?   243.109   -36.9606     317.133    -36.9606     99.846     -36.9606     
1 1 1 53  5  4  o 0 19.2    5.3   ?     ?   115.14    -130.416     19.1444    -130.416     83.8524    49.5843      
1 1 1 53  5  5  o 0 202.5   7.8   ?     ?   365.811   113.493      298.378    113.493      29.0098    -66.5074     
1 1 1 53  5  6  o 0 89      6.4   ?     ?   119.395   130.329      256.556    130.329      149.288    130.329      
1 1 1 53  5  7  o 0 492     12.2  ?     ?   513.08    -29.5903     531.715    -29.5903     70.8795    -29.5903     
1 1 1 53  5  8  o 0 195.6   8.9   ?     ?   243.127   -108.878     387.582    -108.878     167.448    -108.878     
1 1 1 53  5  9  o 0 0.5     8.3   ?     ?   172.26    -168.259     92.5586    11.741       248.36     11.741       
1 1 1 53  5  10 f 1 101     10.2  ?     ?   216.119   142.582      234.262    142.582      21.299     142.582      
1 1 1 53  5  11 o 0 62.8    13.2  ?     ?   190.704   149.005      151.335    149.005      35.2687    -30.9953     
1 1 1 53  5  12 o 0 176.2   18.2  ?     ?   298.335   129.561      309.454    129.561      16.0231    129.561      
1 1 1 53  5  13 o 0 89.4    18.4  ?     ?   73.2943   72.5858      290.653    72.5858      221.181    72.5858      
1 1 1 53  5  14 f 1 14.5    17.3  ?     ?   43.1772   -71.2984     34.7952    -71.2984     5.35654    108.702      
1 1 1 53  5  15 o 0 84.8    16.5  ?     ?   268.401   -110.211     159.456    -110.211     84.7523    69.7887      
1 1 1 53  5  16 o 0 79.3    17.2  ?     ?   268.738   -157.336     143.799    -157.336     100.291    22.6638      
1 1 1 53  5  17 < 0 64.5    22.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 7  16 < 0 32.8    2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 7  15 o 0 108.4   3.8   ?     ?   258.794   103.195      213.989    103.195      2.08308    103.195      
1 1 1 -53 7  14 f 1 151.6   4.6   ?     ?   237.467   119.979      309.352    119.979      112.67     119.979      
1 1 1 -53 7  13 o 0 78.1    3.3   ?     ?   107.908   -124.086     244.942    -124.086     154.115    -124.086     
1 1 1 -53 7  12 o 0 111.8   3.3   ?     ?   151.554   -21.7158     297.693    -21.7158     169.144    -21.7158     
1 1 1 -53 7  11 o 0 128.1   3.8   ?     ?   214.264   -32.6538     281.852    -32.6538     94.8939    -32.6538     
1 1 1 -53 7  10 o 0 221.6   19.8  ?     ?   192.042   -98.8665     443.695    -98.8665     269.104    -98.8665     
1 1 1 -53 7  9  o 0 132.7   6.1   ?     ?   215.263   -124.884     286.267    -124.884     89.3131    -124.884     
1 1 1 -53 7  8  o 0 -5      4.2   ?     ?   63.0866   25.2704      48.2605    -154.73      105.893    -154.73      
1 1 1 -53 7  7  f 1 300.1   10.3  ?     ?   359.625   66.2483      422.078    66.2483      90.025     66.2483      
1 1 1 -53 7  6  o 0 67.5    5.5   ?     ?   275.243   103.905      93.5427    103.905      140.568    -76.0952     
1 1 1 -53 7  5  o 0 24.2    4.6   ?     ?   123.982   -28.4054     47.7743    -28.4054     58.1759    151.595      
1 1 1 -53 7  4  o 0 121.9   6.7   ?     ?   133.897   -138.276     313.057    -138.276     198.141    -138.276     
1 1 1 -53 7  3  f 1 376.8   11.3  ?     ?   237.881   -64.91       606.197    -64.91       400.189    -64.91       
1 1 1 -53 7  2  o 0 331.6   9.9   ?     ?   261.3     -35.8052     538.63     -35.8052     314.674    -35.8052     
1 1 1 -53 7  1  o 0 28.7    2.4   ?     ?   150.199   113.449      52.341     113.449      76.7911    -66.5514     
1 1 1 53  7  0  o 0 9       2.5   ?     ?   64.2481   2.33241      16.3906    -177.668     72.6884    -177.668     
1 1 1 53  7  1  o 0 60.2    3.5   ?     ?   197.06    74.1423      134.638    74.1423      38.3359    -105.858     
1 1 1 53  7  2  o 0 67.4    4     ?     ?   226.783   101.792      133.906    101.792      65.4324    -78.2075     
1 1 1 53  7  3  f 1 101.3   5.2   ?     ?   112.129   172.339      288.998    172.339      188.962    172.339      
1 1 1 53  7  4  o 0 55      5.2   ?     ?   117.482   162.842      166.965    162.842      62.6225    162.842      
1 1 1 53  7  5  o 0 91.6    8.8   ?     ?   189.599   2.80924      222.446    2.80924      54.0079    2.80924      
1 1 1 53  7  6  o 0 140.5   7.8   ?     ?   216.653   45.458       316.503    45.458       107.591    45.458       
1 1 1 53  7  7  f 1 81      7     ?     ?   242.719   -18.5975     159.533    -18.5975     75.5972    161.403      
1 1 1 53  7  8  o 0 86.9    9.1   ?     ?   216.018   -13.1272     197.24     -13.1272     10.7646    166.873      
1 1 1 53  7  9  o 0 25.7    9.6   ?     ?   132.336   -167.587     55.3598    -167.587     72.8546    12.4134      
1 1 1 53  7  10 o 0 38.7    10.4  ?     ?   214.713   -157.186     57.5821    -157.186     143.093    22.8142      
1 1 1 53  7  11 o 0 -15.9   13.3  ?     ?   29.1513   41.088       11.7671    -138.912     38.9543    -138.912     
1 1 1 53  7  12 o 0 12.5    13.1  ?     ?   92.5589   98.4791      23.5294    98.479       60.7776    -81.521      
1 1 1 53  7  13 o 0 15.1    14.8  ?     ?   53.8506   -65.5183     43.6146    -65.5183     4.65196    114.482      
1 1 1 53  7  14 f 1 64.1    17.7  ?     ?   167.639   -35.0076     179.885    -35.0076     29.0304    -35.0076     
1 1 1 53  7  15 < 0 90.3    17.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 9  13 < 1 39.8    6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 9  12 o 0 20.6    5.6   ?     ?   92.6888   88.7111      75.8738    88.7111      0.765395   88.7111      
1 1 1 -53 9  11 o 0 83.1    6.1   ?     ?   232.204   100.526      175.764    100.526      13.3869    -79.4736     
1 1 1 -53 9  10 o 0 23.3    6     ?     ?   76.5976   89.058       81.2928    89.058       18.4561    89.058       
1 1 1 -53 9  9  f 1 169.7   7.6   ?     ?   261.394   82.0038      316.172    82.0038      96.342     82.0038      
1 1 1 -53 9  8  o 0 133     6.7   ?     ?   263.589   132.31       253.733    132.31       31.8269    132.31       
1 1 1 -53 9  7  o 0 54.2    5.6   ?     ?   165.945   51.9321      143.062    51.9321      0.43628    -128.068     
1 1 1 -53 9  6  o 0 25.3    5.3   ?     ?   27.1712   -168.35      42.0292    -168.35      18.4086    -168.35      
1 1 1 -53 9  5  o 0 57.5    5.9   ?     ?   197.24    98.5159      125.036    98.5159      53.2724    -81.4841     
1 1 1 -53 9  4  o 0 60.7    10.2  ?     ?   121.74    -138.423     184.192    -138.423     73.6468    -138.423     
1 1 1 -53 9  3  o 0 115.8   16.4  ?     ?   268.863   -27.9511     201.989    -27.9511     43.1385    152.049      
1 1 1 -53 9  2  o 0 89.7    9.2   ?     ?   155.801   102.945      239.927    102.945      97.3651    102.945      
1 1 1 -53 9  1  f 1 69.3    8     ?     ?   219.22    90.808       140.722    90.808       61.5498    -89.192      
1 1 1 53  9  0  o 0 56.7    3.1   ?     ?   239.331   -68.0569     94.0291    -68.0569     131.313    111.943      
1 1 1 53  9  1  f 1 82      4.5   ?     ?   127.818   -31.6835     248.472    -31.6835     127.32     -31.6835     
1 1 1 53  9  2  o 0 114.7   5.5   ?     ?   314.694   112.391      172.313    112.391      124.792    -67.6085     
1 1 1 53  9  3  o 0 91.9    5.9   ?     ?   256.037   161.343      172.87     161.343      69.0486    -18.657      
1 1 1 53  9  4  o 0 128     6.8   ?     ?   229.83    114.961      273.774    114.961      56.5275    114.961      
1 1 1 53  9  5  o 0 113.8   8.9   ?     ?   298.126   74.3803      192.894    74.3803      79.4272    -105.62      
1 1 1 53  9  6  o 0 91.2    10.3  ?     ?   110.005   169.7        284.156    169.7        183.71     169.7        
1 1 1 53  9  7  o 0 177.5   9.4   ?     ?   157.087   178.165      432.418    178.165      292.079    178.165      
1 1 1 53  9  8  o 0 -5.1    9.6   ?     ?   90.1331   56.8579      36.4517    -123.142     116.881    -123.142     
1 1 1 53  9  9  f 1 284.7   13.5  ?     ?   427.392   3.90132      372.554    3.90132      5.1913     -176.099     
1 1 1 53  9  10 o 0 50.1    12.4  ?     ?   268.155   4.40579      61.2375    4.40579      174.087    -175.594     
1 1 1 53  9  11 o 0 27      12.6  ?     ?   116.51    -45.3447     85.5347    -45.3447     16.6934    134.655      
1 1 1 53  9  12 < 0 16.9    14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 53  9  13 < 1 29.9    14    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 11 9  < 0 68.3    6.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 11 8  < 0 8.7     6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 11 7  < 0 54.6    6.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -53 11 6  o 0 10.9    6.9   ?     ?   15.6502   19.7792      10.7474    19.7792      1.88943    -160.221     
1 1 1 -53 11 5  o 0 118.8   8.9   ?     ?   199.13    69.5719      275.017    69.5719      113.414    69.5719      
1 1 1 -53 11 4  f 1 261.9   13.7  ?     ?   239.385   79.6391      462.729    79.6391      266.994    79.6391      
1 1 1 -53 11 3  o 0 47.1    7.5   ?     ?   138.981   2.93258      144.615    2.93258      31.0834    2.93258      
1 1 1 -53 11 2  f 1 44.9    7.4   ?     ?   193.693   21.177       100.756    21.177       58.8817    -158.823     
1 1 1 -53 11 1  o 0 28.7    7.8   ?     ?   97.1356   -176.014     99.9045    -176.014     19.9905    -176.014     
1 1 1 53  11 0  o 0 11.6    4.4   ?     ?   137.222   114.283      4.49155    -65.7175     121.091    -65.7175     
1 1 1 53  11 1  o 0 15.8    3.9   ?     ?   92.3656   -82.7599     45.0416    -82.7599     33.5474    97.2401      
1 1 1 53  11 2  f 1 15.2    5.3   ?     ?   92.5959   84.9663      37.3375    84.9663      41.9273    -95.0337     
1 1 1 53  11 3  o 0 29.4    5.6   ?     ?   147.459   143.857      82.6569    143.857      42.9967    -36.1433     
1 1 1 53  11 4  f 1 22.4    7     ?     ?   141.921   94.4562      58.9697    94.4562      62.8798    -85.5438     
1 1 1 53  11 5  o 0 33.9    8.2   ?     ?   117.32    18.3002      122.761    18.3002      22.5715    18.3002      
1 1 1 53  11 6  o 0 71.3    10.3  ?     ?   57.6765   75.3362      257.472    75.3362      208.248    75.3362      
1 1 1 53  11 7  < 0 26.5    9.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 53  11 8  < 0 36.2    11.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 0  19 < 0 28.2    5.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 0  18 o 0 107.8   6.1   ?     ?   266.893   180          224.042    180          0.922363   1.70435e-12  
1 1 1 -54 0  17 o 0 16      4.4   ?     ?   102.429   0            68.2994    0            18.6217    180          
1 1 1 -54 0  16 o 0 70.3    5.2   ?     ?   186.182   0            183.88     0            22.4253    0            
1 1 1 -54 0  15 o 0 187.9   7.5   ?     ?   187.339   180          303.785    180          136.515    180          
1 1 1 -54 0  14 f 1 75.9    4.8   ?     ?   130.159   0            192.506    0            70.6892    0            
1 1 1 -54 0  13 o 0 5.9     3.3   ?     ?   40.1561   180          7.76315    180          29.6191    1.83907e-15  
1 1 1 -54 0  12 o 0 1.4     3.5   ?     ?   174.844   0            10.0149    0            140.958    180          
1 1 1 -54 0  11 o 0 60.5    4.9   ?     ?   136.212   0            162.071    0            43.6956    0            
1 1 1 -54 0  10 o 0 41.5    3.1   ?     ?   128.091   180          123.187    180          12.1666    180          
1 1 1 -54 0  9  o 0 142.4   8.2   ?     ?   236.012   180          262.338    180          57.3923    180          
1 1 1 -54 0  8  o 0 148.5   5.5   ?     ?   460.076   180          269.759    180          131.868    1.43539e-14  
1 1 1 -54 0  7  o 0 149.2   5.9   ?     ?   256.193   0            271.675    0            46.9314    0            
1 1 1 -54 0  6  o 0 32.3    3     ?     ?   88.4747   180          78.0344    180          1.92295    2.84742e-13  
1 1 1 -54 0  5  f 1 118.1   5.4   ?     ?   321.177   180          243.777    180          49.1957    3.47695e-14  
1 1 1 -54 0  4  o 0 365.3   11.5  ?     ?   428.519   180          430.526    180          40.1422    180          
1 1 1 -54 0  3  o 0 179.8   6.4   ?     ?   203.582   0            302.905    0            116.79     0            
1 1 1 -54 0  2  o 0 225.1   7.5   ?     ?   328.196   0            340.274    0            34.1744    0            
1 1 1 -54 0  1  o 0 23.1    3.7   ?     ?   144.2     180          73.1163    180          61.7568    8.30736e-15  
1 1 1 54  0  0  o 0 345.1   12    ?     ?   237.645   0            423.437    0            200.606    0            
1 1 1 54  0  1  o 0 489     15.7  ?     ?   287.563   0            505.127    0            234.905    0            
1 1 1 54  0  2  o 0 47.9    5.4   ?     ?   56.0878   0            79.3482    0            27.4281    0            
1 1 1 54  0  3  o 0 199.6   8.5   ?     ?   216.735   0            323.657    0            122.727    0            
1 1 1 54  0  4  o 0 78.1    7     ?     ?   182.42    0            198.167    0            28.8559    0            
1 1 1 54  0  5  f 1 5.3     6.8   ?     ?   39.6261   0            5.082      0            31.9147    180          
1 1 1 54  0  6  o 0 36.5    7.5   ?     ?   277.704   0            133.721    0            124.339    180          
1 1 1 54  0  7  o 0 66.2    9.4   ?     ?   195.692   180          182.626    180          5.29421    180          
1 1 1 54  0  8  o 0 116.1   11.1  ?     ?   195.851   180          245.702    180          68.284     180          
1 1 1 54  0  9  o 0 -2.4    11.3  ?     ?   31.2827   0            3.76849    0            24.6563    180          
1 1 1 54  0  10 o 0 280.2   16.9  ?     ?   334.535   0            382.737    0            79.1008    0            
1 1 1 54  0  11 o 0 286.8   18.2  ?     ?   313.582   0            386.294    0            99.6136    0            
1 1 1 54  0  12 o 0 116.2   17.5  ?     ?   190.07    0            254.213    0            65.9454    0            
1 1 1 54  0  13 o 0 189.9   22.6  ?     ?   273.183   0            325.251    0            53.257     0            
1 1 1 54  0  14 f 1 36.6    22.5  ?     ?   41.5141   180          48.9877    180          7.55419    180          
1 1 1 54  0  15 o 0 -11.9   25.7  ?     ?   5.81028   0            1.84864    0            3.70911    180          
1 1 1 54  0  16 o 0 82.6    27    ?     ?   190.778   180          193.365    180          15.3101    180          
1 1 1 -54 2  19 < 0 32      3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 2  18 o 0 50      3.1   ?     ?   147.31    -148.062     158.968    -148.062     35.8799    -148.062     
1 1 1 -54 2  17 o 0 13.6    2.6   ?     ?   60.8991   115.306      35.1179    115.306      16.1249    -64.6938     
1 1 1 -54 2  16 o 0 107.4   4.3   ?     ?   128.2     -24.5019     306.906    -24.5019     196.642    -24.5019     
1 1 1 -54 2  15 f 1 40.1    3.5   ?     ?   176.669   -85.5427     93.3681    -85.5427     63.9264    94.4573      
1 1 1 -54 2  14 o 0 36.6    2.8   ?     ?   77.619    -141.49      122.914    -141.49      51.1981    -141.49      
1 1 1 -54 2  13 o 0 93.6    3.3   ?     ?   237.985   100.887      189.25     100.887      30.6392    -79.1127     
1 1 1 -54 2  12 o 0 227.8   5.6   ?     ?   318.258   -168.042     366.053    -168.042     69.9058    -168.042     
1 1 1 -54 2  11 o 0 154     4.3   ?     ?   306.42    179.304      252.58     179.305      11.8399    -0.695503    
1 1 1 -54 2  10 o 0 56.3    2.4   ?     ?   243.173   -168.623     88.5516    -168.623     120.771    11.3772      
1 1 1 -54 2  9  o 0 68.2    3.1   ?     ?   255.782   -143.142     112.76     -143.142     108.707    36.8584      
1 1 1 -54 2  8  o 0 181.1   4.6   ?     ?   283.718   -157.519     321.136    -157.519     75.0647    -157.519     
1 1 1 -54 2  7  o 0 13.8    1.9   ?     ?   39.1996   -91.5588     2.7249     -91.5588     31.4458    88.4412      
1 1 1 -54 2  6  o 0 40.6    2.9   ?     ?   123.237   -160.165     108.25     -160.165     0.318626   -160.165     
1 1 1 -54 2  5  f 1 78.2    3.3   ?     ?   216.613   -139.654     160.475    -139.654     35.9268    40.3455      
1 1 1 -54 2  4  o 0 78.1    3.3   ?     ?   146.336   116.064      204.595    116.064      72.0681    116.064      
1 1 1 -54 2  3  f 1 73.1    2.9   ?     ?   71.362    -29.7119     186.297    -29.7119     121.103    -29.7119     
1 1 1 -54 2  2  o 0 77.8    3.1   ?     ?   235.973   39.0336      147.741    39.0336      67.4352    -140.966     
1 1 1 -54 2  1  o 0 378.5   10    ?     ?   517.839   66.516       391.008    66.516       82.5691    -113.484     
1 1 1 54  2  0  o 0 155.5   4.8   ?     ?   242.07    98.2824      311.295    98.2824      88.4173    98.2824      
1 1 1 54  2  1  o 0 67.8    3.7   ?     ?   47.3074   175.677      139.143    175.677      95.4954    175.677      
1 1 1 54  2  2  o 0 89.6    4.3   ?     ?   232.19    -149.662     182.168    -149.662     32.4377    30.3381      
1 1 1 54  2  3  f 1 208.1   6.2   ?     ?   237.829   -166.594     404.906    -166.594     183.645    -166.594     
1 1 1 54  2  4  o 0 5.3     4.2   ?     ?   106.218   -54.3979     62.516     125.602      160.935    125.602      
1 1 1 54  2  5  f 1 138.9   6     ?     ?   323.794   -70.4318     213.463    -70.4318     88.3129    109.568      
1 1 1 54  2  6  o 0 35.9    5.4   ?     ?   74.6827   -157.8       89.8899    -157.8       22.3423    -157.8       
1 1 1 54  2  7  o 0 251.8   8.8   ?     ?   350.772   -159.614     389.439    -159.614     72.1891    -159.614     
1 1 1 54  2  8  o 0 80.8    7.5   ?     ?   268.203   -119.952     140.737    -119.951     102.649    60.0485      
1 1 1 54  2  9  o 0 60.8    7.6   ?     ?   171.505   159.249      156.509    159.249      0.998277   159.249      
1 1 1 54  2  10 o 0 110     8.6   ?     ?   191.669   9.84995      269.933    9.84995      94.8271    9.84995      
1 1 1 54  2  11 o 0 5.1     10    ?     ?   34.9078   -43.0779     8.31283    136.922      41.6938    136.922      
1 1 1 54  2  12 o 0 72      12.1  ?     ?   202.476   -177.46      171.283    -177.46      28.7911    2.54033      
1 1 1 54  2  13 o 0 48.8    13.8  ?     ?   189.105   106.351      109.287    106.351      78.5214    -73.6492     
1 1 1 54  2  14 o 0 144.2   16.8  ?     ?   208.178   129.867      338.976    129.867      139.752    129.867      
1 1 1 54  2  15 f 1 34.8    19.4  ?     ?   144.983   -149.576     85.6439    -149.576     50.4666    30.4235      
1 1 1 54  2  16 o 0 0.4     20.6  ?     ?   35.7397   -29.4352     21.9158    -29.4352     10.91      150.565      
1 1 1 54  2  17 o 0 87.7    22.5  ?     ?   175.727   -58.8112     235.428    -58.8112     74.3191    -58.8112     
1 1 1 54  2  18 < 0 0.5     23.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 4  18 < 0 3.5     2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 4  17 f 1 200     5.5   ?     ?   322.538   -9.1316      323.617    -9.13161     54.5888    -9.13161     
1 1 1 -54 4  16 o 0 6.6     2.5   ?     ?   52.4337   -77.0755     5.49055    102.924      49.3001    102.924      
1 1 1 -54 4  15 o 0 29.3    2.5   ?     ?   125.666   83.9626      89.2857    83.9626      18.0204    -96.0374     
1 1 1 -54 4  14 o 0 78.6    5.2   ?     ?   196.6     138.17       189.729    138.17       16.866     138.17       
1 1 1 -54 4  13 o 0 8.4     2.4   ?     ?   139.749   -50.6647     42.1392    129.335      170.287    129.335      
1 1 1 -54 4  12 o 0 96.8    3.1   ?     ?   307.443   -27.7404     136.718    -27.7404     147.278    152.26       
1 1 1 -54 4  11 o 0 137.6   3.8   ?     ?   235.04    -24.7514     283.52     -24.7514     66.5304    -24.7514     
1 1 1 -54 4  10 o 0 58.4    2.6   ?     ?   224.758   -129.046     108.159    -129.046     84.2324    50.9537      
1 1 1 -54 4  9  o 0 62.6    2.7   ?     ?   265.646   -179.522     89.7341    -179.522     139.04     0.47764      
1 1 1 -54 4  8  o 0 69      2.8   ?     ?   178.012   135.191      168.019    135.191      15.1842    135.191      
1 1 1 -54 4  7  o 0 45.2    2.5   ?     ?   156.375   163.975      111.004    163.975      23.9613    -16.0245     
1 1 1 -54 4  6  o 0 185.9   5     ?     ?   274.196   90.0243      334.979    90.0243      98.0623    90.0243      
1 1 1 -54 4  5  o 0 7.9     1.9   ?     ?   149.248   88.5164      61.488     -91.4836     191.023    -91.4836     
1 1 1 -54 4  4  o 0 65.7    2.7   ?     ?   183.144   14.9619      157.982    14.9619      1.62516    -165.038     
1 1 1 -54 4  3  o 0 244.4   5.8   ?     ?   317.572   47.5317      393.625    47.5317      115.832    47.5317      
1 1 1 -54 4  2  o 0 94.1    3.5   ?     ?   154.882   -154.492     247.487    -154.492     111.55     -154.492     
1 1 1 -54 4  1  o 0 30.9    2.7   ?     ?   104.13    144.761      63.1625    144.761      30.8446    -35.2394     
1 1 1 54  4  0  o 0 92.5    3.7   ?     ?   271.385   165.685      156.529    165.685      91.2834    -14.3146     
1 1 1 54  4  1  o 0 164.1   5.1   ?     ?   298.691   -64.7051     288.911    -64.7051     22.4277    -64.7051     
1 1 1 54  4  2  o 0 85.3    3.9   ?     ?   136.009   -49.6958     239.7      -49.6958     118.157    -49.6958     
1 1 1 54  4  3  o 0 108.8   5.2   ?     ?   223.418   156.667      240.07     156.667      40.1559    156.667      
1 1 1 54  4  4  o 0 181     6.5   ?     ?   310.139   -159.218     309.72     -159.218     31.9452    -159.218     
1 1 1 54  4  5  o 0 37.8    5.1   ?     ?   122.935   27.0494      99.7084    27.0494      10.462     -152.951     
1 1 1 54  4  6  o 0 265.1   8.5   ?     ?   429.975   -62.6091     336.731    -62.6091     50.1302    117.391      
1 1 1 54  4  7  o 0 474.9   12.4  ?     ?   395.357   -92.1534     616.552    -92.1534     260.898    -92.1534     
1 1 1 54  4  8  o 0 498.5   13.5  ?     ?   438.272   -125.27      603.518    -125.27      209.481    -125.27      
1 1 1 54  4  9  o 0 56.7    8.4   ?     ?   134.431   146.7        167.327    146.7        45.5219    146.7        
1 1 1 54  4  10 o 0 23.9    9.5   ?     ?   118.795   109.316      49.3063    109.316      67.3785    -70.6842     
1 1 1 54  4  11 o 0 65.4    10.7  ?     ?   104.022   46.9322      216.578    46.9322      114.585    46.9322      
1 1 1 54  4  12 o 0 107.1   13    ?     ?   306.01    63.4047      167.069    63.4047      134.567    -116.595     
1 1 1 54  4  13 o 0 82.5    17.6  ?     ?   115.211   -2.92338     262.673    -2.92338     153.218    -2.92338     
1 1 1 54  4  14 o 0 61.2    16.4  ?     ?   212.347   -128.317     137.092    -128.317     59.8483    51.6833      
1 1 1 54  4  15 o 0 156.9   20.2  ?     ?   296.862   -170.064     290.068    -170.064     19.2616    -170.064     
1 1 1 54  4  16 o 0 74.3    17.3  ?     ?   231.129   173.678      162.068    173.678      48.4404    -6.32163     
1 1 1 54  4  17 < 1 24.3    23.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 6  17 < 1 20.3    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 6  16 < 0 11.1    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 6  15 o 0 38.6    2.8   ?     ?   132.154   24.3586      130.514    24.3586      21.4762    24.3586      
1 1 1 -54 6  14 o 0 24.4    2.5   ?     ?   126.178   -56.9302     73.6362    -56.9302     31.1213    123.07       
1 1 1 -54 6  13 o 0 97.4    3.4   ?     ?   200.565   -17.0591     232.942    -17.0591     62.8655    -17.0591     
1 1 1 -54 6  12 o 0 119.7   3.9   ?     ?   185.928   27.0436      286.812    27.0436      124.563    27.0436      
1 1 1 -54 6  11 o 0 134.9   3.7   ?     ?   308.695   176.215      211.126    176.215      69.6436    -3.78538     
1 1 1 -54 6  10 o 0 5.2     1.6   ?     ?   59.5284   -166.616     24.4725    13.3842      78.9812    13.3842      
1 1 1 -54 6  9  o 0 222.9   5     ?     ?   277.311   165.789      387.498    165.789      133.87     165.789      
1 1 1 -54 6  8  o 0 28.1    1.9   ?     ?   151.492   36.2303      56.7305    36.2303      82.6407    -143.77      
1 1 1 -54 6  7  o 0 268.7   7.7   ?     ?   305.585   49.9989      419.758    49.9989      159.355    49.9989      
1 1 1 -54 6  6  o 0 82.6    3.1   ?     ?   168.181   44.8271      209.339    44.8271      65.2989    44.8271      
1 1 1 -54 6  5  o 0 23.4    1.8   ?     ?   166.686   -79.5744     24.9548    -79.5744     118.471    100.426      
1 1 1 -54 6  4  o 0 0.8     1.6   ?     ?   45.1629   108.066      34.2381    -71.9339     72.9254    -71.9339     
1 1 1 -54 6  3  o 0 39.5    2.7   ?     ?   147.045   -148.232     95.4841    -148.232     30.9643    31.7681      
1 1 1 -54 6  2  f 1 46.9    2.5   ?     ?   173.762   146.569      106.396    146.569      44.3179    -33.4313     
1 1 1 -54 6  1  o 0 8.7     2.5   ?     ?   101.293   -139.582     31.2073    40.418       118.886    40.418       
1 1 1 54  6  0  o 0 160.6   4.7   ?     ?   325.176   3.68895      256.301    3.68895      29.9192    -176.311     
1 1 1 54  6  1  o 0 24.8    3.1   ?     ?   166.739   -3.67898     27.5181    -3.67898     119.516    176.321      
1 1 1 54  6  2  f 1 2.2     3.6   ?     ?   100.936   65.987       66.2347    -114.013     155.833    -114.013     
1 1 1 54  6  3  o 0 107.3   5     ?     ?   184.382   -148.251     260.986    -148.251     97.9683    -148.251     
1 1 1 54  6  4  o 0 9.9     4.6   ?     ?   44.295    -83.8103     9.52164    96.1897      48.7144    96.1897      
1 1 1 54  6  5  o 0 15.4    5.1   ?     ?   97.9406   -176.47      9.52867    -176.47      77.9243    3.52973      
1 1 1 54  6  6  o 0 62.4    6.5   ?     ?   147.257   -106.467     176.083    -106.467     44.5924    -106.467     
1 1 1 54  6  7  o 0 273.3   9.2   ?     ?   327.726   -38.0532     439.27     -38.0532     121.72     -38.0532     
1 1 1 54  6  8  o 0 32.7    8     ?     ?   152.395   -89.4789     76.1407    -89.4789     71.4086    90.5211      
1 1 1 54  6  9  o 0 -5.6    10.1  ?     ?   148.269   -137.49      81.0253    42.5097      225.488    42.5097      
1 1 1 54  6  10 o 0 7.4     11.5  ?     ?   113.853   -93.5895     16.2018    86.4105      126.958    86.4105      
1 1 1 54  6  11 o 0 66.3    13.9  ?     ?   167.834   -70.9585     184.614    -70.9585     27.1558    -70.9585     
1 1 1 54  6  12 o 0 -0.4    12.3  ?     ?   63.297    -1.02885     6.89501    178.971      64.9014    178.971      
1 1 1 54  6  13 o 0 -8.8    16.3  ?     ?   18.4937   119.29       0.461901   -60.7104     17.3622    -60.7104     
1 1 1 54  6  14 o 0 7.2     16.6  ?     ?   100.673   -113.766     23.7195    -113.766     66.787     66.2339      
1 1 1 54  6  15 o 0 11.5    16.3  ?     ?   113.647   -81.2323     35.5677    -81.2323     66.4604    98.7677      
1 1 1 54  6  16 < 0 29.5    18.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 8  14 < 0 30.2    2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 8  13 o 0 12.4    1.8   ?     ?   66.3503   -121.534     40.086     -121.534     13.8697    58.4662      
1 1 1 -54 8  12 o 0 24.8    4.7   ?     ?   147.224   9.03797      61.0789    9.03797      59.316     -170.962     
1 1 1 -54 8  11 o 0 70.1    5.4   ?     ?   227.948   43.863       149.546    43.863       38.2472    -136.137     
1 1 1 -54 8  10 o 0 68.3    5.1   ?     ?   127.288   61.172       209.884    61.172       102.891    61.172       
1 1 1 -54 8  9  o 0 111     6.6   ?     ?   237.72    128.583      225.995    128.583      20.5846    128.583      
1 1 1 -54 8  8  o 0 58.8    5.3   ?     ?   134.398   116.904      177.243    116.904      60.4016    116.904      
1 1 1 -54 8  7  o 0 15.7    5.1   ?     ?   113.511   127.353      18.0471    127.353      84.6553    -52.6474     
1 1 1 -54 8  6  o 0 36.9    5.6   ?     ?   129.705   -101.739     106.176    -101.739     11.7954    78.2607      
1 1 1 -54 8  5  o 0 111.3   7.2   ?     ?   148.002   107.895      293.638    107.895      158.373    107.895      
1 1 1 -54 8  4  o 0 20.7    5.7   ?     ?   86.6885   -145.157     45.0445    -145.157     33.9412    34.8431      
1 1 1 -54 8  3  o 0 83.4    6.6   ?     ?   155.629   -7.69337     224.681    -7.69337     82.3114    -7.69337     
1 1 1 -54 8  2  o 0 74.9    7.9   ?     ?   182.096   67.2319      184.77     67.2319      17.5886    67.2319      
1 1 1 -54 8  1  o 0 59.8    3.2   ?     ?   206.37    149.99       127.112    149.99       62.9623    -30.0097     
1 1 1 54  8  0  o 0 294.1   7.1   ?     ?   299.599   -121.52      480.72     -121.52      198.403    -121.52      
1 1 1 54  8  1  o 0 1.8     4.1   ?     ?   81.9695   113.748      52.3407    -66.2515     129.71     -66.2515     
1 1 1 54  8  2  o 0 25.1    4.1   ?     ?   181.782   176.667      23.0539    176.667      148.75     -3.33345     
1 1 1 54  8  3  o 0 106     5.8   ?     ?   287.086   -122.448     179.437    -122.448     92.1424    57.5523      
1 1 1 54  8  4  o 0 107.2   5.5   ?     ?   181.234   58.131       272.831    58.131       100.004    58.131       
1 1 1 54  8  5  o 0 161.7   7.6   ?     ?   266.559   66.6434      308.613    66.6434      54.3755    66.6434      
1 1 1 54  8  6  o 0 134.8   8     ?     ?   228.685   48.2549      290.387    48.2549      72.32      48.2549      
1 1 1 54  8  7  o 0 -23.2   8.2   ?     ?   85.1456   20.8156      61.8826    -159.184     140.293    -159.184     
1 1 1 54  8  8  o 0 149.9   8.9   ?     ?   324.083   2.42327      244.965    2.42327      53.1804    -177.577     
1 1 1 54  8  9  o 0 56.6    9.7   ?     ?   189.763   -9.2549      144.204    -9.2549      26.4903    170.745      
1 1 1 54  8  10 o 0 44.6    10.7  ?     ?   56.0316   -86.9758     150.544    -86.9758     100.235    -86.9758     
1 1 1 54  8  11 o 0 48.4    13.7  ?     ?   89.4963   -114.684     178.2      -114.684     99.0687    -114.684     
1 1 1 54  8  12 o 0 21.1    13.4  ?     ?   82.9639   1.5254       76.4268    1.5254       3.10164    1.5254       
1 1 1 54  8  13 < 0 6.2     14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 54  8  14 < 0 57.1    16.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 10 11 < 0 -8.9    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 10 10 < 0 23.2    6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 10 9  o 0 76.5    6.5   ?     ?   240.773   60.8674      153.889    60.8674      40.0353    -119.133     
1 1 1 -54 10 8  o 0 69.7    6.6   ?     ?   165.052   65.5657      193.74     65.5657      59.962     65.5657      
1 1 1 -54 10 7  o 0 72.1    8.3   ?     ?   140.88    79.443       211.494    79.443       96.8935    79.443       
1 1 1 -54 10 6  o 0 12.1    10.6  ?     ?   82.0852   83.4274      24.1941    83.4274      42.9432    -96.5726     
1 1 1 -54 10 5  o 0 22.2    8.4   ?     ?   133.961   111.508      49.8975    111.508      60.2186    -68.4915     
1 1 1 -54 10 4  o 0 43.4    7     ?     ?   87.3448   70.1039      149.507    70.1039      76.4276    70.1039      
1 1 1 -54 10 3  o 0 33.5    7.6   ?     ?   154.129   -46.1513     84.8783    -46.1513     44.6143    133.849      
1 1 1 -54 10 2  o 0 51.4    8.2   ?     ?   167.017   147.279      136.717    147.279      4.12914    -32.7207     
1 1 1 -54 10 1  o 0 36.5    8.6   ?     ?   133.691   109.155      108.153    109.155      4.96322    -70.8445     
1 1 1 54  10 0  o 0 103.2   4.1   ?     ?   148.482   48.462       289.341    48.462       159.934    48.462       
1 1 1 54  10 1  o 0 16.6    3.8   ?     ?   136.582   82.1121      23.4744    82.1121      95.7355    -97.8879     
1 1 1 54  10 2  o 0 21.9    4.5   ?     ?   102.332   176.187      66.4732    176.187      22.9397    -3.81324     
1 1 1 54  10 3  o 0 79.9    6.7   ?     ?   231.186   -106.683     173.687    -106.683     28.456     73.3168      
1 1 1 54  10 4  o 0 101.5   7.8   ?     ?   96.0011   -39.7659     320.46     -39.7659     237.587    -39.7659     
1 1 1 54  10 5  o 0 30.6    8.5   ?     ?   73.6562   -96.1366     115.492    -96.1366     51.9136    -96.1366     
1 1 1 54  10 6  o 0 17.7    8.4   ?     ?   124.052   -149.251     34.8509    -149.251     72.1777    30.7486      
1 1 1 54  10 7  o 0 44.2    9.6   ?     ?   166.521   -131.494     126.322    -131.494     17.545     48.5061      
1 1 1 54  10 8  o 0 15.5    12.1  ?     ?   183.712   -89.4855     8.91507    90.5145      167.431    90.5145      
1 1 1 54  10 9  < 0 33.1    13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 54  10 10 < 0 42.7    14.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 12 3  < 0 78.8    9.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 12 2  < 0 8.9     8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -54 12 1  < 0 5.5     9.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 54  12 0  < 0 49.6    5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 54  12 1  < 0 59.1    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 54  12 2  < 0 14.3    5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 1  18 < 0 7.2     2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 1  17 o 0 126.3   4.5   ?     ?   218.697   -9.02778     287.265    -9.02778     103.169    -9.02778     
1 1 1 -55 1  16 o 0 96.4    4     ?     ?   210.94    9.79875      225.594    9.79875      44.5146    9.79875      
1 1 1 -55 1  15 f 1 22      2.7   ?     ?   73.0678   -92.0824     63.4231    -92.0824     1.50214    87.9176      
1 1 1 -55 1  14 o 0 14.3    2.6   ?     ?   98.6362   65.7168      21.1325    65.7168      66.7511    -114.283     
1 1 1 -55 1  13 o 0 5.7     2.3   ?     ?   88.1752   159.243      37.1826    -20.7568     119.09     -20.7568     
1 1 1 -55 1  12 o 0 143.1   4     ?     ?   211.265   -139.019     314.879    -139.019     118.724    -139.019     
1 1 1 -55 1  11 o 0 147.7   3.9   ?     ?   306.622   140.486      240.791    140.486      23.2049    -39.5139     
1 1 1 -55 1  10 o 0 74.6    3     ?     ?   132.545   158.4        211.798    158.4        96.9697    158.4        
1 1 1 -55 1  9  o 0 305.1   6.8   ?     ?   341.511   177.364      447.802    177.364      152.805    177.364      
1 1 1 -55 1  8  o 0 160.8   5.6   ?     ?   234.274   141.232      323.645    141.232      120.182    141.232      
1 1 1 -55 1  7  o 0 87.4    3     ?     ?   221.292   10.6694      187.186    10.6694      5.24642    -169.331     
1 1 1 -55 1  6  o 0 20.1    2     ?     ?   240.046   90.5359      43.579     -89.4641     253.295    -89.4641     
1 1 1 -55 1  5  o 0 7.7     2.1   ?     ?   93.0254   -98.7445     35.034     81.2555      116.655    81.2555      
1 1 1 -55 1  4  o 0 320.5   7.3   ?     ?   391.663   116.136      426.097    116.136      72.2833    116.136      
1 1 1 -55 1  3  o 0 37.9    2.4   ?     ?   128.02    125.517      87.2424    125.517      28.8219    -54.4827     
1 1 1 -55 1  2  o 0 208.3   5.4   ?     ?   355.213   -44.1572     303.914    -44.1572     19.1731    135.843      
1 1 1 -55 1  1  o 0 20.1    2.6   ?     ?   78.6854   43.0153      19.286     43.0153      52.4916    -136.985     
1 1 1 55  1  0  o 0 137.7   4.8   ?     ?   348.204   -0.215258    189.698    -0.215258    129.445    179.785      
1 1 1 55  1  1  o 0 45.5    3.3   ?     ?   217.683   -63.5206     67.0039    -63.5206     132.943    116.479      
1 1 1 55  1  2  o 0 127.1   5     ?     ?   246.743   -123.781     252.781    -123.781     25.7287    -123.781     
1 1 1 55  1  3  o 0 110.1   5     ?     ?   289.05    -95.7261     183.488    -95.7261     82.8893    84.2739      
1 1 1 55  1  4  o 0 40.5    4.6   ?     ?   281.316   -86.8493     0.443887   -86.8493     259.099    93.1507      
1 1 1 55  1  5  o 0 3       4.5   ?     ?   175.401   -154.54      111.501    25.4603      269.42     25.4603      
1 1 1 55  1  6  o 0 173.2   7.3   ?     ?   238.444   -127.142     355.115    -127.142     140.349    -127.142     
1 1 1 55  1  7  o 0 299.5   10.5  ?     ?   405.902   -147.712     406.409    -147.712     40.7997    -147.712     
1 1 1 55  1  8  o 0 -2.2    6.5   ?     ?   46.6687   -8.76276     29.6122    171.237      71.7922    171.237      
1 1 1 55  1  9  o 0 56.3    8.3   ?     ?   201.505   -46.4216     121.972    -46.4216     60.0173    133.578      
1 1 1 55  1  10 o 0 171.6   10.7  ?     ?   247.129   -28.6471     344.962    -28.6471     120.064    -28.6471     
1 1 1 55  1  11 o 0 6       10.6  ?     ?   9.32491   163.047      0.86594    -16.9529     10.0638    -16.9529     
1 1 1 55  1  12 o 0 84.3    11.3  ?     ?   194.175   81.1472      211.817    81.1472      20.6558    81.1472      
1 1 1 55  1  13 o 0 207.1   16.1  ?     ?   262.6     51.3018      399.353    51.3018      139.495    51.3018      
1 1 1 55  1  14 o 0 243.4   18.1  ?     ?   223.177   134.396      498.762    134.396      285.933    134.396      
1 1 1 55  1  15 f 1 82.2    17.7  ?     ?   118.714   -173.296     263.514    -173.296     152.444    -173.296     
1 1 1 55  1  16 o 0 -17.8   19.3  ?     ?   90.7066   114.408      7.62141    -65.5921     90.6585    -65.5921     
1 1 1 55  1  17 o 0 40.9    21.7  ?     ?   164.162   19.8311      95.0046    19.8311      55.0239    -160.169     
1 1 1 55  1  18 < 0 20.1    23.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 3  18 < 0 -1.7    2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 3  17 o 0 27.5    2.7   ?     ?   54.6134   65.8206      113.252    65.8206      67.845     65.8206      
1 1 1 -55 3  16 o 0 47.1    2.9   ?     ?   105.17    -9.89143     168.953    -9.89143     80.9213    -9.89143     
1 1 1 -55 3  15 o 0 18      2.4   ?     ?   100.201   65.1533      47.0584    65.1533      38.6513    -114.847     
1 1 1 -55 3  14 o 0 25.7    2.7   ?     ?   78.267    100.701      80.7259    100.701      11.7959    100.701      
1 1 1 -55 3  13 o 0 14.5    2.4   ?     ?   98.1088   45.9723      18.6639    45.9723      71.4405    -134.028     
1 1 1 -55 3  12 o 0 58.1    3.2   ?     ?   159.382   -103.466     159.436    -103.466     11.9927    -103.466     
1 1 1 -55 3  11 o 0 17.3    2.2   ?     ?   167.883   -159.95      6.31524    20.0496      161.522    20.0496      
1 1 1 -55 3  10 o 0 36.3    2.7   ?     ?   160.858   -167.393     80.4739    -167.393     57.4021    12.6066      
1 1 1 -55 3  9  o 0 108.4   3.9   ?     ?   307.57    171.551      165.041    171.551      100.173    -8.44941     
1 1 1 -55 3  8  o 0 145.5   4.1   ?     ?   293.552   161.223      248.724    161.223      3.6124     -18.7775     
1 1 1 -55 3  7  o 0 53.6    2.6   ?     ?   136.51    151.927      147.118    151.927      29.1609    151.927      
1 1 1 -55 3  6  o 0 208.6   5.1   ?     ?   251.523   86.864       388.117    86.864       170.549    86.864       
1 1 1 -55 3  5  o 0 11.6    2     ?     ?   81.2526   -9.39443     10.4688    170.606      81.0656    170.606      
1 1 1 -55 3  4  o 0 109.5   3.5   ?     ?   277.664   9.75618      195.051    9.75618      47.1838    -170.244     
1 1 1 -55 3  3  o 0 83.7    3.2   ?     ?   162.335   22.8927      218.046    22.8927      75.8985    22.8927      
1 1 1 -55 3  2  o 0 -1      2.3   ?     ?   79.7948   -163.776     63.1044    16.2235      133.21     16.2235      
1 1 1 -55 3  1  o 0 218.4   6.1   ?     ?   423.049   96.0864      270.994    96.0864      101.8      -83.9136     
1 1 1 55  3  0  o 0 328.5   7.7   ?     ?   450.091   179.274      401.531    179.274      1.18274    179.274      
1 1 1 55  3  1  o 0 345.2   9.2   ?     ?   363.054   -150.738     496.426    -150.738     172.829    -150.738     
1 1 1 55  3  2  o 0 292.4   7.6   ?     ?   296.187   -176.433     485.483    -176.433     221.029    -176.433     
1 1 1 55  3  3  o 0 420.2   9.9   ?     ?   322.287   157.182      618.859    157.182      330.704    157.182      
1 1 1 55  3  4  o 0 115.4   5.9   ?     ?   187.473   -14.1625     279.626    -14.1625     111.835    -14.1625     
1 1 1 55  3  5  o 0 126.7   6.1   ?     ?   318.639   -19.0404     202.72     -19.0404     82.6585    160.96       
1 1 1 55  3  6  o 0 129.4   10    ?     ?   189.241   -138.801     307.081    -138.801     136.903    -138.801     
1 1 1 55  3  7  o 0 127     7.4   ?     ?   317.709   -169.014     203.455    -169.014     82.2273    10.9864      
1 1 1 55  3  8  o 0 165.9   8     ?     ?   341.456   -82.8579     256.433    -82.8579     53.149     97.1421      
1 1 1 55  3  9  o 0 36      7.1   ?     ?   113.829   102.572      103.604    102.572      0.488929   102.572      
1 1 1 55  3  10 o 0 57.5    9.7   ?     ?   228.84    53.021       106.702    53.021       118.048    -126.979     
1 1 1 55  3  11 o 0 163.8   11.9  ?     ?   300.989   6.63962      290.138    6.63962      4.98292    -173.36      
1 1 1 55  3  12 o 0 25.2    13.5  ?     ?   133.154   70.698       49.6529    70.698       81.6136    -109.302     
1 1 1 55  3  13 o 0 102.6   14.5  ?     ?   92.6374   -146.367     326.357    -146.367     238.326    -146.367     
1 1 1 55  3  14 o 0 1.5     14.8  ?     ?   91.256    -135.215     0.955405   44.7853      85.6215    44.7853      
1 1 1 55  3  15 o 0 48.9    18.4  ?     ?   113.372   100.612      159.937    100.612      56.4639    100.612      
1 1 1 55  3  16 o 0 19.5    13.8  ?     ?   25.4198   122.409      45.8705    122.409      22.7038    122.409      
1 1 1 55  3  17 < 0 4.4     14.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 5  17 < 0 79.4    3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 5  16 o 0 2.6     2.3   ?     ?   47.1528   22.0085      19.5273    -157.991     58.3067    -157.991     
1 1 1 -55 5  15 o 0 30.5    2.7   ?     ?   92.8101   -132.207     112.998    -132.207     36.1657    -132.207     
1 1 1 -55 5  14 o 0 27.7    2.3   ?     ?   121.948   -78.4447     83.6736    -78.4447     19.4743    101.555      
1 1 1 -55 5  13 o 0 24.2    2.1   ?     ?   48.4523   21.924       68.4836    21.924       27.1743    21.924       
1 1 1 -55 5  12 o 0 27.4    2.2   ?     ?   196.661   16.9231      30.4294    16.9231      142.099    -163.077     
1 1 1 -55 5  11 o 0 5.8     1.9   ?     ?   61.0623   -12.1883     21.8387    167.812      77.6682    167.812      
1 1 1 -55 5  10 o 0 19.3    1.9   ?     ?   107.795   -63.2688     35.5387    -63.2688     62.9369    116.731      
1 1 1 -55 5  9  o 0 45.4    2.4   ?     ?   212.908   -101.715     77.3684    -101.715     118.349    78.2854      
1 1 1 -55 5  8  o 0 78.4    3     ?     ?   171.771   -1.67317     205.348    -1.67317     51.959     -1.67317     
1 1 1 -55 5  7  o 0 13.6    1.9   ?     ?   111.874   -76.4772     0.913122   103.523      96.7197    103.523      
1 1 1 -55 5  6  o 0 138.5   4.3   ?     ?   201.813   122.934      303.802    122.934      130.106    122.934      
1 1 1 -55 5  5  o 0 27.1    2.2   ?     ?   133.899   -66.1894     52.1236    -66.1894     62.6469    113.811      
1 1 1 -55 5  4  o 0 24.3    2.3   ?     ?   59.9219   -58.5419     41.8478    -58.5419     9.73079    121.458      
1 1 1 -55 5  3  o 0 58.8    2.8   ?     ?   175.407   -1.1389      142.439    -1.1389      9.12482    178.861      
1 1 1 -55 5  2  f 1 150     4.3   ?     ?   218.58    170.973      314.915    170.973      124.418    170.973      
1 1 1 -55 5  1  o 0 13.6    2.8   ?     ?   171.748   -27.597      34.5317    152.403      183.907    152.403      
1 1 1 55  5  0  o 0 48.8    3.1   ?     ?   161.105   -3.85856     122.824    -3.85856     19.3411    176.141      
1 1 1 55  5  1  o 0 169.7   5.4   ?     ?   397.094   -5.91868     213.522    -5.91868     137.569    174.081      
1 1 1 55  5  2  f 1 30.7    3.4   ?     ?   212.279   95.15        23.7528    95.15        165.199    -84.85       
1 1 1 55  5  3  o 0 171.8   5.8   ?     ?   246.458   -126.213     340.274    -126.213     121.75     -126.213     
1 1 1 55  5  4  o 0 6.1     4.5   ?     ?   62.7538   -71.3238     28.2853    108.676      83.9753    108.676      
1 1 1 55  5  5  o 0 9.6     5     ?     ?   55.0086   -87.7467     13.3459    92.2533      62.1875    92.2533      
1 1 1 55  5  6  o 0 59.8    6.2   ?     ?   226.693   -61.7303     114.907    -61.7303     88.1616    118.27       
1 1 1 55  5  7  o 0 142.1   7.9   ?     ?   304.639   -63.6625     240.614    -63.6625     32.2099    116.338      
1 1 1 55  5  8  o 0 11.2    7.7   ?     ?   170.097   -154.049     50.4444    25.9507      215.702    25.9507      
1 1 1 55  5  9  o 0 20.9    9.4   ?     ?   176.246   89.3847      1.90986    -90.6153     172.964    -90.6153     
1 1 1 55  5  10 o 0 39.7    10.7  ?     ?   124.407   -10.1379     124.168    -10.1379     2.69482    -10.1379     
1 1 1 55  5  11 o 0 22.1    11.6  ?     ?   124.029   -54.468      43.0602    -54.468      73.7503    125.532      
1 1 1 55  5  12 o 0 31.9    13    ?     ?   169.715   -18.9196     55.1696    -18.9196     104.308    161.08       
1 1 1 55  5  13 o 0 28      15.7  ?     ?   188.155   -49.4501     29.5418    -49.4501     143.117    130.55       
1 1 1 55  5  14 o 0 88.6    15.2  ?     ?   295.326   -68.4029     146.954    -68.4029     119.692    111.597      
1 1 1 55  5  15 o 0 53.4    19.3  ?     ?   168.879   -151.303     137.205    -151.303     15.0846    28.6974      
1 1 1 55  5  16 < 0 -4.1    18.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 7  15 < 1 24.9    2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 7  14 o 0 66.3    2.8   ?     ?   151.255   -71.0058     197.28     -71.0058     74.1363    -71.0058     
1 1 1 -55 7  13 o 0 10.8    2     ?     ?   72.323    16.3329      29.9682    16.3329      29.3984    -163.667     
1 1 1 -55 7  12 f 1 84.7    2.8   ?     ?   226.93    47.2931      185.998    47.2931      2.2722     -132.707     
1 1 1 -55 7  11 o 0 22.2    1.9   ?     ?   105.324   120.864      65.7872    120.864      22.9429    -59.1358     
1 1 1 -55 7  10 o 0 4.4     4.7   ?     ?   51.6274   -145.738     19.5745    34.2621      64.3011    34.2621      
1 1 1 -55 7  9  o 0 73.2    5.7   ?     ?   221.298   120.383      155.358    120.383      37.6022    -59.6171     
1 1 1 -55 7  8  o 0 10.2    4.7   ?     ?   63.5518   122.704      1.80664    -57.296      59.4982    -57.296      
1 1 1 -55 7  7  f 1 7.6     4.7   ?     ?   59.9623   157.548      13.1917    -22.4517     68.2124    -22.4517     
1 1 1 -55 7  6  o 0 13.8    4.2   ?     ?   56.0807   -15.0518     12.7829    -15.0518     38.2962    164.948      
1 1 1 -55 7  5  o 0 24.8    4.6   ?     ?   156.111   -162.913     37.9805    -162.913     104.889    17.0866      
1 1 1 -55 7  4  o 0 26.7    4.5   ?     ?   183.42    -165.827     28.2845    -165.827     140.313    14.1725      
1 1 1 -55 7  3  o 0 5.2     1.6   ?     ?   154.696   -144.354     83.3249    35.646       226.087    35.646       
1 1 1 -55 7  2  o 0 3.4     1.8   ?     ?   55.3678   -98.801      34.9133    81.199       86.1926    81.199       
1 1 1 -55 7  1  o 0 110.4   5.4   ?     ?   161.347   148.371      287.477    148.371      142.697    148.371      
1 1 1 55  7  0  o 0 100.9   3.9   ?     ?   272.798   -35.3936     187.484    -35.3936     62.3424    144.606      
1 1 1 55  7  1  o 0 27.5    3.2   ?     ?   101.702   -136.346     73.0106    -136.346     20.2928    43.6543      
1 1 1 55  7  2  o 0 191     6     ?     ?   335.174   -112.631     300.262    -112.631     18.577     67.3691      
1 1 1 55  7  3  o 0 55.9    4.7   ?     ?   136.446   -132.209     169.74     -132.209     39.8068    -132.209     
1 1 1 55  7  4  o 0 20.5    6     ?     ?   135.487   87.8121      29.2616    87.8121      99.8462    -92.1879     
1 1 1 55  7  5  o 0 338.8   10.4  ?     ?   408.038   -15.6906     445.277    -15.6906     56.3297    -15.6906     
1 1 1 55  7  6  o 0 20.9    7.3   ?     ?   81.0953   -31.3263     51.9699    -31.3263     25.9054    148.674      
1 1 1 55  7  7  f 1 70.8    9.4   ?     ?   187.46    -45.9105     176.969    -45.9105     3.88905    134.089      
1 1 1 55  7  8  o 0 2.3     9.6   ?     ?   63.5793   -85.745      15.4193    94.255       74.3399    94.255       
1 1 1 55  7  9  o 0 123.1   11.4  ?     ?   236.533   -86.3405     267.506    -86.3405     48.581     -86.3405     
1 1 1 55  7  10 o 0 11.6    11    ?     ?   79.8945   -68.0115     18.2362    -68.0115     54.0481    111.988      
1 1 1 55  7  11 o 0 -5.6    11    ?     ?   22.1047   86.7581      3.97528    -93.2419     23.6727    -93.2419     
1 1 1 55  7  12 f 1 28.9    13.9  ?     ?   86.4242   86.2993      98.2173    86.2993      21.0014    86.2993      
1 1 1 55  7  13 o 0 4.9     17.6  ?     ?   37.3427   -61.0708     31.8317    -61.0708     1.33963    118.929      
1 1 1 55  7  14 < 0 92.7    18.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 9  12 < 0 19.3    5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 9  11 < 0 27.2    5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 9  10 o 0 15.2    6     ?     ?   39.9517   -153.352     41.6428    -153.352     9.25639    -153.352     
1 1 1 -55 9  9  o 0 -1.6    5.7   ?     ?   71.3554   112.177      31.823     -67.8227     89.9237    -67.8227     
1 1 1 -55 9  8  o 0 61.2    6.1   ?     ?   69.4394   26.9873      212.218    26.9873      155.323    26.9873      
1 1 1 -55 9  7  f 1 63.5    6.3   ?     ?   150.259   25.0945      181.133    25.0945      55.0217    25.0945      
1 1 1 -55 9  6  o 0 28.9    5.5   ?     ?   142.093   130.656      75.7806    130.656      43.5083    -49.3438     
1 1 1 -55 9  5  o 0 38.2    6     ?     ?   125.679   116.523      120.202    116.523      14.1684    116.523      
1 1 1 -55 9  4  o 0 -5.7    5.4   ?     ?   15.8032   49.7038      10.1761    -130.296     23.8548    -130.296     
1 1 1 -55 9  3  o 0 7.8     7     ?     ?   120.769   -32.9325     27.5863    147.067      132.551    147.067      
1 1 1 -55 9  2  f 1 53.2    10.8  ?     ?   146.234   -89.8717     151.527    -89.8717     23.3022    -89.8717     
1 1 1 -55 9  1  o 0 91.6    14.1  ?     ?   123.994   -51.4591     263.844    -51.459      155.319    -51.459      
1 1 1 55  9  0  o 0 96.3    4.1   ?     ?   157.342   -14.6094     265.596    -14.6094     124.121    -14.6094     
1 1 1 55  9  1  o 0 57.7    4.1   ?     ?   229.433   90.9984      111.687    90.9984      94.9362    -89.0016     
1 1 1 55  9  2  f 1 35.3    7.2   ?     ?   77.9334   -59.5566     121.049    -59.5566     50.4165    -59.5566     
1 1 1 55  9  3  o 0 152     7.2   ?     ?   211.028   -87.8638     338.392    -87.8638     147.952    -87.8638     
1 1 1 55  9  4  o 0 50.5    6.3   ?     ?   149.35    18.7913      153.634    18.7913      21.6044    18.7913      
1 1 1 55  9  5  o 0 47.2    7.7   ?     ?   57.0782   -157.967     161.614    -157.967     111.151    -157.967     
1 1 1 55  9  6  o 0 26.7    7.6   ?     ?   129.434   -119.381     75.3641    -119.381     39.0312    60.6191      
1 1 1 55  9  7  f 1 -4      8.2   ?     ?   81.1921   21.5849      31.5867    -158.415     102.723    -158.415     
1 1 1 55  9  8  o 0 74.8    9.8   ?     ?   186.316   -30.5789     199.851    -30.5789     37.6266    -30.5789     
1 1 1 55  9  9  o 0 15.1    10    ?     ?   99.0182   -50.6269     42.4654    -50.6269     43.8116    129.373      
1 1 1 55  9  10 < 0 70.4    11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 55  9  11 < 0 49.2    19.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 11 7  < 0 52.7    10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 11 6  < 0 13.9    6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 11 5  < 0 26.6    7.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 11 4  < 0 62.5    8.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 11 3  < 0 133.6   9.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -55 11 2  o 0 50.2    8.6   ?     ?   116.32    -97.7686     170.588    -97.7686     76.2928    -97.7686     
1 1 1 -55 11 1  o 0 25.8    8.3   ?     ?   80.6252   173.403      97.0216    173.403      31.4381    173.403      
1 1 1 55  11 0  o 0 31.9    4.3   ?     ?   143.591   -12.508      100.121    -12.508      20.7337    167.492      
1 1 1 55  11 1  o 0 30      3.9   ?     ?   138.915   -47.5347     96.1807    -47.5347     20.9002    132.465      
1 1 1 55  11 2  o 0 14.2    4.8   ?     ?   71.4873   73.5107      47.2981    73.5107      13.0133    -106.489     
1 1 1 55  11 3  < 0 12.2    6     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 55  11 4  < 0 10.6    7.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 55  11 5  < 0 44.1    9.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 55  11 6  < 0 61      13.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 0  18 < 0 3.1     3.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 0  17 o 0 35.1    4.7   ?     ?   147.538   0            125.823    0            2.08874    0            
1 1 1 -56 0  16 o 0 15.6    3.8   ?     ?   98.4201   180          66.567     180          16.5043    2.83005e-14  
1 1 1 -56 0  15 o 0 22      3.8   ?     ?   76.3214   0            72.39      0            6.58153    0            
1 1 1 -56 0  14 f 1 15.4    3.5   ?     ?   32.4608   180          24.236     180          4.72127    3.60194e-14  
1 1 1 -56 0  13 o 0 147.5   6.9   ?     ?   402.788   180          269.526    180          103.144    1.83353e-14  
1 1 1 -56 0  12 o 0 494.3   15.8  ?     ?   552.144   180          496.847    180          13.7468    2.53603e-13  
1 1 1 -56 0  11 o 0 344     12    ?     ?   417.376   180          417.325    180          28.8205    180          
1 1 1 -56 0  10 o 0 2.3     2.7   ?     ?   86.3453   180          5.57511    180          68.9212    5.67589e-16  
1 1 1 -56 0  9  o 0 29.8    3.3   ?     ?   257.034   180          116.701    180          106.343    7.70015e-15  
1 1 1 -56 0  8  o 0 0.8     2.6   ?     ?   65.2848   180          2.47442    180          53.9876    3.21598e-16  
1 1 1 -56 0  7  o 0 251.8   8.6   ?     ?   441.973   0            348.364    0            35.7958    180          
1 1 1 -56 0  6  o 0 11.3    3.1   ?     ?   100.646   180          33.961     180          53.5959    4.44614e-15  
1 1 1 -56 0  5  o 0 26.8    3.2   ?     ?   176.516   0            101.942    0            52.2765    180          
1 1 1 -56 0  4  o 0 13.1    2.7   ?     ?   77.5777   180          32.5089    180          35.5358    6.41903e-15  
1 1 1 -56 0  3  o 0 19.3    3.3   ?     ?   5.30287   180          3.53237    180          1.13554    2.18271e-14  
1 1 1 -56 0  2  o 0 162.6   6.1   ?     ?   304.14    0            285.552    0            10.1031    0            
1 1 1 -56 0  1  o 0 -3.1    3     ?     ?   150.463   180          2.70796    180          133.957    1.41844e-16  
1 1 1 56  0  0  o 0 1.5     5.7   ?     ?   94.3378   2.49758e-13  6.74101    0            79.1654    -180         
1 1 1 56  0  1  o 0 523.1   16.1  ?     ?   320.528   180          515.973    180          223.442    180          
1 1 1 56  0  2  o 0 862.3   25    ?     ?   538.282   180          663.456    180          183.518    180          
1 1 1 56  0  3  o 0 -1.6    5.6   ?     ?   101.227   180          5.55774    180          84.8358    4.59677e-16  
1 1 1 56  0  4  o 0 11.8    5.8   ?     ?   45.9757   180          14.3124    180          26.7917    3.74839e-15  
1 1 1 56  0  5  o 0 507.1   17.8  ?     ?   558.55    180          510.555    180          10.7764    180          
1 1 1 56  0  6  o 0 15.1    7.6   ?     ?   62.9356   180          24.9726    180          31.5792    5.54877e-15  
1 1 1 56  0  7  o 0 27      8.7   ?     ?   182.894   180          99.5865    180          64.7712    1.07883e-14  
1 1 1 56  0  8  o 0 35.4    10.1  ?     ?   41.1988   0            47.2465    0            10.2339    0            
1 1 1 56  0  9  o 0 11.6    10.9  ?     ?   99.4175   0            29.1018    0            60.9358    180          
1 1 1 56  0  10 o 0 -0.2    13.4  ?     ?   80.6233   180          16.1782    180          62.9998    1.80188e-15  
1 1 1 56  0  11 o 0 80.9    16.7  ?     ?   101.493   0            197.249    0            97.721     0            
1 1 1 56  0  12 o 0 96.1    19.4  ?     ?   48.7171   180          178.831    180          130.787    180          
1 1 1 56  0  13 o 0 9.7     19.4  ?     ?   199.947   180          59.3508    180          130.766    3.18468e-15  
1 1 1 56  0  14 f 1 207.2   22.3  ?     ?   273.74    180          334.824    180          79.3365    180          
1 1 1 56  0  15 o 0 137.1   26.3  ?     ?   298.166   180          264.857    180          7.56619    2.45622e-13  
1 1 1 56  0  16 o 0 64.5    32.5  ?     ?   94.6476   0            141.126    0            54.7528    0            
1 1 1 -56 2  18 < 0 16.9    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 2  17 o 0 73      3.3   ?     ?   149.722   13.6474      219.58     13.6474      95.1008    13.6474      
1 1 1 -56 2  16 o 0 60.7    3.4   ?     ?   220.069   19.1653      133.583    19.1653      50.6041    -160.835     
1 1 1 -56 2  15 o 0 36.6    2.8   ?     ?   95.5768   -172.725     129.505    -172.725     47.7668    -172.725     
1 1 1 -56 2  14 o 0 81.4    3.4   ?     ?   248.806   81.0578      156.379    81.0578      62.685     -98.9422     
1 1 1 -56 2  13 f 1 6.5     2.2   ?     ?   147.93    49.6617      65.2249    -130.338     201.736    -130.338     
1 1 1 -56 2  12 o 0 13.2    2.3   ?     ?   46.0048   155.825      15.6619    155.825      26.8787    -24.1752     
1 1 1 -56 2  11 o 0 41.3    2.5   ?     ?   180.84    69.4325      88.1562    69.4325      78.9462    -110.568     
1 1 1 -56 2  10 o 0 154.3   4.2   ?     ?   227.959   6.33187      326.672    6.33187      121.94     6.33187      
1 1 1 -56 2  9  o 0 18.9    2.1   ?     ?   171.488   54.0988      0.20564    54.0988      147.576    -125.901     
1 1 1 -56 2  8  o 0 376.1   9.1   ?     ?   457.091   82.9169      434.439    82.9169      41.783     82.9169      
1 1 1 -56 2  7  o 0 200.9   6     ?     ?   397.835   69.6866      257.97     69.6866      85.5527    -110.313     
1 1 1 -56 2  6  o 0 165.2   5.1   ?     ?   330.531   86.5519      256.192    86.5519      30.5838    -93.4481     
1 1 1 -56 2  5  o 0 254.9   5.9   ?     ?   341.926   107.527      385.774    107.527      88.9184    107.527      
1 1 1 -56 2  4  o 0 164.7   5.1   ?     ?   258.731   88.933       314.314    88.933       88.7754    88.933       
1 1 1 -56 2  3  f 1 82.8    3.8   ?     ?   250.134   161.74       154.887    161.74       65.0891    -18.2597     
1 1 1 -56 2  2  o 0 149.6   4.3   ?     ?   251.613   -5.97318     295.186    -5.97318     74.306     -5.97318     
1 1 1 -56 2  1  o 0 29.4    2.8   ?     ?   60.2777   125.801      57.9933    125.801      4.91984    125.801      
1 1 1 56  2  0  o 0 243.6   6.6   ?     ?   359.989   -154.367     362.919    -154.367     43.653     -154.367     
1 1 1 56  2  1  o 0 177.7   5.4   ?     ?   147.869   -156.777     419.158    -156.777     287.735    -156.777     
1 1 1 56  2  2  o 0 56.7    4     ?     ?   152.11    -142.489     152.668    -142.489     17.2322    -142.489     
1 1 1 56  2  3  f 1 5.6     3.8   ?     ?   58.7665   -156.678     29.8255    23.3219      82.4957    23.3219      
1 1 1 56  2  4  o 0 137.9   5.6   ?     ?   162.013   -0.357319    340.666    -0.357319    196.043    -0.357319    
1 1 1 56  2  5  o 0 90.1    5.6   ?     ?   203.053   1.61043      212.093    1.61043      30.0167    1.61043      
1 1 1 56  2  6  o 0 29.1    5.7   ?     ?   187.797   -148.547     33.6945    -148.547     134.766    31.4532      
1 1 1 56  2  7  o 0 13.5    6.1   ?     ?   101.481   -113.554     9.00388    66.4458      100.036    66.4458      
1 1 1 56  2  8  o 0 216.7   9.3   ?     ?   369.025   -4.79049     315.56     -4.79049     18.2444    175.21       
1 1 1 56  2  9  o 0 44.3    7.7   ?     ?   157.175   -34.6777     114.187    -34.6777     27.8774    145.322      
1 1 1 56  2  10 o 0 188.9   10.6  ?     ?   364.022   -40.6146     277.348    -40.6146     79.4076    139.385      
1 1 1 56  2  11 o 0 167     11.7  ?     ?   266.66    -55.8099     327.059    -55.8099     64.1712    -55.8099     
1 1 1 56  2  12 o 0 80.1    12.2  ?     ?   228.946   116.603      170.048    116.603      55.2174    -63.3965     
1 1 1 56  2  13 f 1 99.5    15.4  ?     ?   287.615   41.445       172.946    41.445       101.274    -138.555     
1 1 1 56  2  14 o 0 7.8     15.9  ?     ?   133.236   22.983       0.178693   -157.017     123.583    -157.017     
1 1 1 56  2  15 o 0 111.1   19.9  ?     ?   222.905   92.1936      257.069    92.1936      53.9493    92.1936      
1 1 1 56  2  16 o 0 100.5   21.5  ?     ?   257.629   72.5607      200.307    72.5607      34.1436    -107.439     
1 1 1 56  2  17 < 0 50.9    24.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 4  17 < 0 11.1    2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 4  16 o 0 47.5    2.7   ?     ?   143.644   178.165      152.029    178.165      33.4579    178.165      
1 1 1 -56 4  15 o 0 34.2    2.5   ?     ?   169.078   101.711      86.2859    101.711      54.188     -78.2887     
1 1 1 -56 4  14 o 0 72.9    3.1   ?     ?   138.729   -9.23259     217.849    -9.23259     100.096    -9.23259     
1 1 1 -56 4  13 o 0 82.8    3.1   ?     ?   242.247   -60.3749     163.804    -60.3749     47.8494    119.625      
1 1 1 -56 4  12 o 0 40.3    2.5   ?     ?   125.791   -17.898      126.2      -17.898      15.4766    -17.898      
1 1 1 -56 4  11 o 0 9.7     2.2   ?     ?   114.283   121.335      18.4099    -58.6646     123.239    -58.6646     
1 1 1 -56 4  10 o 0 38.7    2.2   ?     ?   251.567   -173.687     22.9741    -173.687     207.575    6.31285      
1 1 1 -56 4  9  o 0 19.3    2     ?     ?   65.3443   4.22658      39.3343    4.22658      20.9208    -175.773     
1 1 1 -56 4  8  o 0 12      2.1   ?     ?   110.452   127.77       9.70166    -52.2301     104.068    -52.2301     
1 1 1 -56 4  7  o 0 45.4    2.6   ?     ?   151.581   86.6722      117.249    86.6722      12.9515    -93.3278     
1 1 1 -56 4  6  o 0 96.5    3.5   ?     ?   300.724   70.5031      145.033    70.5031      112.302    -109.497     
1 1 1 -56 4  5  o 0 206.2   5.6   ?     ?   342.822   -87.0391     309.543    -87.039      14.8407    -87.039      
1 1 1 -56 4  4  o 0 72.9    3     ?     ?   272.237   -129.017     112.209    -129.017     122.799    50.9835      
1 1 1 -56 4  3  o 0 94.2    3.6   ?     ?   152.055   168.075      246.452    168.075      114.689    168.075      
1 1 1 -56 4  2  o 0 152     5.2   ?     ?   332.958   164.562      231.688    164.562      57.8296    -15.4378     
1 1 1 -56 4  1  o 0 129.8   4.2   ?     ?   217.931   92.9464      280.288    92.9464      90.2063    92.9464      
1 1 1 56  4  0  f 1 105.5   4.1   ?     ?   195.492   -66.7618     248.702    -66.7618     75.1988    -66.7618     
1 1 1 56  4  1  o 0 234.7   7.6   ?     ?   410.017   -67.46       305.101    -67.46       57.671     112.54       
1 1 1 56  4  2  o 0 12.8    4.2   ?     ?   127.354   -126.578     18.4073    53.4224      131.277    53.4224      
1 1 1 56  4  3  o 0 36.6    3.9   ?     ?   195.032   -97.584      59.5208    -97.584      113.56     82.416       
1 1 1 56  4  4  o 0 6.9     4.4   ?     ?   96.0156   -73.0204     41.4439    106.98       126.736    106.98       
1 1 1 56  4  5  o 0 128.5   6.1   ?     ?   196.396   72.6637      298.122    72.6637      123.553    72.6637      
1 1 1 56  4  6  o 0 164.9   7.5   ?     ?   308.361   173.696      279.7      173.696      3.14122    173.696      
1 1 1 56  4  7  o 0 26.7    6.6   ?     ?   114.461   -148.577     63.54      -148.577     39.1025    31.4231      
1 1 1 56  4  8  o 0 104.2   8.6   ?     ?   96.5968   40.828       320.896    40.828       226.914    40.828       
1 1 1 56  4  9  o 0 21.4    8.2   ?     ?   158.076   78.8641      14.7866    78.8641      138.87     -101.136     
1 1 1 56  4  10 o 0 1.3     10.3  ?     ?   63.7379   39.8607      17.1234    -140.139     79.462     -140.139     
1 1 1 56  4  11 o 0 1.7     10.8  ?     ?   62.1848   -0.903028    14.5759    179.097      75.291     179.097      
1 1 1 56  4  12 o 0 29.9    12.2  ?     ?   205.198   -45.4135     23.5761    -45.4135     169.616    134.587      
1 1 1 56  4  13 o 0 93.3    14.9  ?     ?   282.659   -70.3655     166.367    -70.3655     93.5448    109.635      
1 1 1 56  4  14 o 0 -6.1    16.2  ?     ?   70.4242   -0.939884    2.50299    -0.939884    61.222     179.06       
1 1 1 56  4  15 o 0 23.7    12.5  ?     ?   150.33    40.9803      50.6624    40.9803      85.2173    -139.02      
1 1 1 56  4  16 < 0 29.6    17.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 6  15 < 0 33.7    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 6  14 o 0 7.9     1.9   ?     ?   86.5938   99.2493      6.16995    99.2493      64.8545    -80.7507     
1 1 1 -56 6  13 o 0 6.9     2.1   ?     ?   58.7302   39.8569      3.29324    -140.143     51.7475    -140.143     
1 1 1 -56 6  12 o 0 4.3     1.9   ?     ?   20.767    158.671      8.33104    -21.3286     25.8245    -21.3286     
1 1 1 -56 6  11 o 0 64.6    2.8   ?     ?   195.576   -79.8218     157.661    -79.8218     8.28308    100.178      
1 1 1 -56 6  10 o 0 64.4    2.9   ?     ?   193.326   -88.6843     154.539    -88.6843     14.1346    91.3157      
1 1 1 -56 6  9  o 0 47      2.5   ?     ?   97.2254   165.849      156.041    165.849      67.695     165.849      
1 1 1 -56 6  8  o 0 177.6   4.5   ?     ?   273.156   27.4801      317.813    27.4801      68.1197    27.4801      
1 1 1 -56 6  7  o 0 165.4   4.7   ?     ?   254.769   -29.4538     313.882    -29.4538     81.4435    -29.4538     
1 1 1 -56 6  6  o 0 19      1.7   ?     ?   59.4777   -79.8141     36.5256    -79.8141     18.0187    100.186      
1 1 1 -56 6  5  o 0 116.3   3.6   ?     ?   309.965   -87.3607     177.514    -87.3607     108.091    92.6393      
1 1 1 -56 6  4  o 0 -1      1.8   ?     ?   41.7101   96.3051      34.0969    -83.6949     71.3757    -83.6949     
1 1 1 -56 6  3  o 0 13      2.1   ?     ?   27.9792   -89.0635     4.18332    -89.0635     19.7633    90.9365      
1 1 1 -56 6  2  o 0 116.5   3.8   ?     ?   202.846   67.8841      260.371    67.8841      86.1421    67.8841      
1 1 1 -56 6  1  o 0 45.7    3.1   ?     ?   143.188   -40.3711     122.852    -40.3711     0.525718   139.629      
1 1 1 56  6  0  o 0 162.2   4.9   ?     ?   235.687   4.91225      326.947    4.91225      120.192    4.91225      
1 1 1 56  6  1  o 0 53.6    3.4   ?     ?   76.6281   -165.238     160.707    -165.238     93.3581    -165.238     
1 1 1 56  6  2  o 0 42.1    3.8   ?     ?   149.9     129.642      109.491    129.642      22.4576    -50.3578     
1 1 1 56  6  3  o 0 33.7    4.2   ?     ?   93.7778   132.07       95.6874    132.07       13.0432    132.07       
1 1 1 56  6  4  o 0 10.4    6.1   ?     ?   77.8632   50.6276      9.09196    -129.372     83.6403    -129.372     
1 1 1 56  6  5  o 0 18.4    5.6   ?     ?   87.0441   176.776      35.47      176.776      47.9045    -3.22443     
1 1 1 56  6  6  o 0 14.4    5.8   ?     ?   114.084   -97.9204     1.12413    -97.9204     108.156    82.0796      
1 1 1 56  6  7  o 0 112.2   8.1   ?     ?   204.384   26.231       267.173    26.231       69.9917    26.231       
1 1 1 56  6  8  o 0 152.6   10.6  ?     ?   289.265   -151.865     273.374    -151.865     5.49568    28.1349      
1 1 1 56  6  9  o 0 12.9    8.1   ?     ?   133.517   -140.789     8.68843    39.2109      132.934    39.2109      
1 1 1 56  6  10 o 0 -11.4   11.1  ?     ?   79.1197   114.327      38.6383    -65.6727     112.152    -65.6727     
1 1 1 56  6  11 o 0 -5      13.2  ?     ?   49.7243   59.0531      7.57282    -120.947     52.7233    -120.947     
1 1 1 56  6  12 o 0 17.6    15.6  ?     ?   103.538   50.2057      49.5521    50.2057      43.0193    -129.794     
1 1 1 56  6  13 o 0 -0.8    18.2  ?     ?   88.9418   -61.1481     24.0208    -61.1481     55.4606    118.852      
1 1 1 56  6  14 < 0 257.2   21.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 56  6  15 < 0 -12.9   18.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 8  13 < 0 46.9    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 8  12 < 0 29.3    5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 8  11 o 0 0.9     5.5   ?     ?   54.3336   112.784      14.7617    -67.2159     58.9853    -67.2159     
1 1 1 -56 8  10 o 0 66.4    6.3   ?     ?   249.054   -160.094     122.702    -160.094     80.9857    19.9057      
1 1 1 -56 8  9  o 0 31.5    4.9   ?     ?   138.816   -105.423     93.7317    -105.423     20.5512    74.5772      
1 1 1 -56 8  8  o 0 89.7    5.9   ?     ?   150.979   -58.7448     246.965    -58.7448     120.246    -58.7448     
1 1 1 -56 8  7  o 0 3.7     5     ?     ?   57.3819   -21.0583     20.0376    158.942      68.477     158.942      
1 1 1 -56 8  6  o 0 8.9     5     ?     ?   87.1259   155.659      11.8862    -24.3413     87.4019    -24.3413     
1 1 1 -56 8  5  o 0 33.4    8.4   ?     ?   118.29    -140.036     100.197    -140.036     2.83492    39.9642      
1 1 1 -56 8  4  f 1 50.8    5.9   ?     ?   136.644   -70.9617     152.146    -70.9617     31.9764    -70.9617     
1 1 1 -56 8  3  o 0 19.7    6.6   ?     ?   121.348   -109.662     31.9852    -109.662     78.3361    70.3377      
1 1 1 -56 8  2  o 0 -2.4    6.5   ?     ?   90.2594   -112.333     52.0543    67.6666      134.415    67.6666      
1 1 1 -56 8  1  o 0 24.4    2.4   ?     ?   191.092   -133.7       15.3457    -133.7       159.596    46.2996      
1 1 1 56  8  0  o 0 150.3   5.3   ?     ?   252.745   -23.1628     295.423    -23.1628     58.3455    -23.1628     
1 1 1 56  8  1  o 0 6       3.2   ?     ?   64.8538   -20.2702     24.4876    159.73       85.4253    159.73       
1 1 1 56  8  2  o 0 2.3     3.9   ?     ?   23.346    -3.52042     13.4623    176.48       35.4281    176.48       
1 1 1 56  8  3  o 0 7       4.3   ?     ?   91.8036   76.2589      26.7254    -103.741     110.275    -103.741     
1 1 1 56  8  4  f 1 63.3    6.2   ?     ?   273.034   51.86        90.845     51.86        159.066    -128.14      
1 1 1 56  8  5  o 0 105.3   9.8   ?     ?   162.525   -31.9563     283.988    -31.9563     135.956    -31.9563     
1 1 1 56  8  6  o 0 28      7.6   ?     ?   158.589   27.764       57.5978    27.764       86.8247    -152.236     
1 1 1 56  8  7  o 0 52.5    7.4   ?     ?   141.739   -94.9762     165.743    -94.9762     39.4287    -94.9762     
1 1 1 56  8  8  o 0 86.2    9     ?     ?   223.231   -87.9586     197.395    -87.9586     1.35338    92.0414      
1 1 1 56  8  9  o 0 62.1    10.4  ?     ?   311.99    -135.103     63.9592    -135.103     209.819    44.8966      
1 1 1 56  8  10 o 0 121.7   12.1  ?     ?   322.606   -176.841     198.681    -176.841     84.5474    3.15857      
1 1 1 56  8  11 o 0 88.5    11.6  ?     ?   194.66    -160.774     230.231    -160.774     59.7033    -160.774     
1 1 1 56  8  12 < 0 50.6    18.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 10 9  < 0 46.3    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 10 8  < 0 74      7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 10 7  < 0 78.2    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -56 10 6  f 1 89      7.6   ?     ?   255.358   -106.837     170.379    -106.837     37.0718    73.1634      
1 1 1 -56 10 5  o 0 161.7   9.3   ?     ?   282.157   -119.276     288.175    -119.276     58.963     -119.276     
1 1 1 -56 10 4  f 1 111.7   9     ?     ?   231.852   -122.463     237.414    -122.463     47.2147    -122.463     
1 1 1 -56 10 3  o 0 91.1    10.8  ?     ?   218.683   -93.4125     201.79     -93.4125     22.9559    -93.4125     
1 1 1 -56 10 2  o 0 48      12.5  ?     ?   155.443   -41.5866     132.422    -41.5866     4.81763    -41.5866     
1 1 1 -56 10 1  o 0 123.1   10.4  ?     ?   217.346   20.3928      270.639    20.3928      91.6115    20.3928      
1 1 1 56  10 0  f 1 4.8     3.9   ?     ?   89.4918   55.6515      28.1951    -124.348     104.645    -124.348     
1 1 1 56  10 1  o 0 7.8     3.7   ?     ?   74.4935   169.856      3.89673    -10.1441     67.3049    -10.1441     
1 1 1 56  10 2  o 0 1.8     4.8   ?     ?   153.07    -33.3085     75.2553    146.691      205.695    146.691      
1 1 1 56  10 3  o 0 69.8    6.1   ?     ?   198.259   20.8641      180.051    20.8641      10.5963    20.8641      
1 1 1 56  10 4  f 1 109.4   7.8   ?     ?   327.064   40.4966      166.331    40.4966      114.756    -139.503     
1 1 1 56  10 5  o 0 40      7.6   ?     ?   146.218   28.8706      127.253    28.8706      2.23526    28.8706      
1 1 1 56  10 6  < 1 36.5    8.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 56  10 7  < 0 22.4    11    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 56  10 8  < 0 12      12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 1  17 < 0 50.8    3.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 1  16 o 0 33.5    3     ?     ?   127.815   169.624      116.704    169.624      9.70453    169.624      
1 1 1 -57 1  15 o 0 84.3    3.5   ?     ?   232.81    -69.3025     185.064    -69.3025     11.0309    110.698      
1 1 1 -57 1  14 o 0 45      2.7   ?     ?   149.143   131.343      133.814    131.343      5.51555    131.343      
1 1 1 -57 1  13 o 0 47.5    2.6   ?     ?   199.927   -136.32      101.745    -136.32      75.231     43.6795      
1 1 1 -57 1  12 o 0 15.8    2.2   ?     ?   89.3251   170.875      28.5606    170.875      53.8494    -9.12543     
1 1 1 -57 1  11 o 0 48.8    2.6   ?     ?   145.072   30.232       137.437    30.232       3.69911    30.232       
1 1 1 -57 1  10 o 0 594.6   13.3  ?     ?   481.234   -37.3545     635.826    -37.3545     189.387    -37.3545     
1 1 1 -57 1  9  o 0 90.4    3.2   ?     ?   213.024   11.9861      197.82     11.9861      14.6929    11.9861      
1 1 1 -57 1  8  o 0 110.8   3.4   ?     ?   142.631   5.30566      288.992    5.30566      165.7      5.30566      
1 1 1 -57 1  7  o 0 40.2    2.2   ?     ?   156.532   86.0471      93.6372    86.0471      41.1851    -93.9529     
1 1 1 -57 1  6  o 0 212.7   5.5   ?     ?   285.918   110.745      366.695    110.745      119.258    110.745      
1 1 1 -57 1  5  o 0 94.9    3.3   ?     ?   231.427   162.94       196.815    162.94       4.34647    -17.0597     
1 1 1 -57 1  4  o 0 336.2   8.2   ?     ?   401.449   92.6784      442.021    92.6784      92.9807    92.6784      
1 1 1 -57 1  3  o 0 74.6    3.1   ?     ?   188.359   72.7359      178.62     72.7359      14.2479    72.7359      
1 1 1 -57 1  2  o 0 189.7   5.1   ?     ?   354.395   22.2636      281.421    22.2636      28.8731    -157.736     
1 1 1 -57 1  1  o 0 106.4   3.9   ?     ?   197.576   122.094      248.81     122.094      75.3044    122.094      
1 1 1 57  1  0  o 0 110.8   4.6   ?     ?   330.622   -147.337     157.526    -147.337     134.276    32.6628      
1 1 1 57  1  1  o 0 206.4   6     ?     ?   306.396   -148.012     350.063    -148.012     79.0434    -148.012     
1 1 1 57  1  2  o 0 22.3    3.6   ?     ?   198.581   177.156      4.84721    -2.84418     180.828    -2.84418     
1 1 1 57  1  3  o 0 205.7   6.4   ?     ?   274.177   93.8574      375.841    93.8574      132.496    93.8574      
1 1 1 57  1  4  o 0 50.8    5.4   ?     ?   190.191   32.9628      112.084    32.9628      57.5539    -147.037     
1 1 1 57  1  5  o 0 32.8    5.3   ?     ?   154.742   91.0743      68.4591    91.0743      69.6724    -88.9257     
1 1 1 57  1  6  o 0 221.4   8.1   ?     ?   289.821   -10.4312     388.129    -10.4312     129.302    -10.4312     
1 1 1 57  1  7  o 0 128.9   8     ?     ?   268.583   47.3149      246.217    47.3149      4.2373     47.3149      
1 1 1 57  1  8  o 0 5.2     7.1   ?     ?   109.921   39.4529      44.5569    -140.547     143.56     -140.547     
1 1 1 57  1  9  o 0 344.4   12.2  ?     ?   320.51    -85.9136     544.818    -85.9136     231.668    -85.9136     
1 1 1 57  1  10 o 0 0       10    ?     ?   44.6705   -150.389     16.4519    29.6114      60.0494    29.6114      
1 1 1 57  1  11 o 0 63      11.9  ?     ?   134.693   104.026      197.055    104.026      64.8058    104.026      
1 1 1 57  1  12 o 0 44.2    11.7  ?     ?   104.081   76.788       151.934    76.788       53.3672    76.788       
1 1 1 57  1  13 o 0 57.7    15.3  ?     ?   224.987   48.3291      108.236    48.3291      104.348    -131.671     
1 1 1 57  1  14 o 0 49.3    16.5  ?     ?   181.097   -48.5734     114.631    -48.5734     52.469     131.427      
1 1 1 57  1  15 o 0 52.3    20.4  ?     ?   72.2806   51.578       179.836    51.578       114.213    51.578       
1 1 1 57  1  16 o 0 132.1   24.8  ?     ?   218.425   -4.46916     297.352    -4.46916     99.2845    -4.46916     
1 1 1 57  1  17 < 0 136.3   23.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 3  17 < 0 24.3    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 3  16 o 0 73.3    3.2   ?     ?   193.323   43.9181      187.75     43.9181      27.8956    43.9181      
1 1 1 -57 3  15 o 0 36.5    2.6   ?     ?   110.766   113.271      129.781    113.271      37.6039    113.271      
1 1 1 -57 3  14 o 0 29.1    2.7   ?     ?   117.423   45.5186      91.9008    45.5186      7.9222     -134.481     
1 1 1 -57 3  13 o 0 19.6    2.3   ?     ?   60.9481   -59.2651     55.842     -59.2651     3.62513    -59.2651     
1 1 1 -57 3  12 o 0 6.6     2.2   ?     ?   133.594   146.489      49.8441    -33.511      167.599    -33.511      
1 1 1 -57 3  11 o 0 160.6   4.3   ?     ?   343.953   85.4451      229.133    85.4451      86.783     -94.5549     
1 1 1 -57 3  10 o 0 116.4   3.8   ?     ?   268.086   40.3308      212.517    40.3308      33.478     -139.669     
1 1 1 -57 3  9  f 1 241.9   6.2   ?     ?   342.763   54.7911      360.713    54.7911      42.6426    54.7911      
1 1 1 -57 3  8  f 1 199     5.3   ?     ?   357.232   30.5558      280.848    30.5558      26.2737    -149.444     
1 1 1 -57 3  7  o 0 261.6   6.1   ?     ?   405.792   40.3487      333.236    40.3487      15.6963    -139.651     
1 1 1 -57 3  6  o 0 49.2    2.5   ?     ?   141.31    37.2057      135.538    37.2057      13.4299    37.2057      
1 1 1 -57 3  5  o 0 51.4    2.6   ?     ?   191.861   148.561      109.597    148.561      55.5006    -31.4393     
1 1 1 -57 3  4  o 0 141.8   4.1   ?     ?   315.885   160.142      225.633    160.142      47.322     -19.8581     
1 1 1 -57 3  3  o 0 525.5   10.9  ?     ?   558.173   130.092      508.29     130.092      24.1423    130.092      
1 1 1 -57 3  2  o 0 105.4   4.2   ?     ?   189.326   132.39       249.714    132.39       84.9333    132.39       
1 1 1 -57 3  1  o 0 77.1    4.7   ?     ?   111.163   135.104      221.993    135.104      124.945    135.104      
1 1 1 57  3  0  f 1 163.6   6.6   ?     ?   321.004   -89.7242     263.718    -89.7242     20.8086    90.2758      
1 1 1 57  3  1  o 0 304.3   7.5   ?     ?   357.319   -66.4379     443.878    -66.4379     128.117    -66.4379     
1 1 1 57  3  2  o 0 72.9    4.4   ?     ?   205.856   -74.2637     164.658    -74.2637     17.5787    105.736      
1 1 1 57  3  3  o 0 29.7    3.7   ?     ?   126.94    -80.7993     67.2461    -80.7993     45.2887    99.2007      
1 1 1 57  3  4  o 0 6.2     4.5   ?     ?   143.679   89.2162      71.1915    -90.7838     198.702    -90.7838     
1 1 1 57  3  5  o 0 135.8   6.5   ?     ?   311.267   71.2973      223.762    71.2973      52.6708    -108.703     
1 1 1 57  3  6  o 0 78.4    6     ?     ?   221.251   -177.508     169.909    -177.508     28.3699    2.49181      
1 1 1 57  3  7  o 0 18.9    6.7   ?     ?   105.213   55.6052      24.5403    55.6052      69.7446    -124.395     
1 1 1 57  3  8  f 1 55.9    7.2   ?     ?   263.674   5.46868      70.408     5.46868      187.299    -174.531     
1 1 1 57  3  9  f 1 46.4    9.3   ?     ?   135.885   41.3287      138.544    41.3287      5.84187    41.3287      
1 1 1 57  3  10 o 0 61.9    10.4  ?     ?   162.54    -24.2599     174.197    -24.2599     15.2833    -24.2599     
1 1 1 57  3  11 o 0 111     12.1  ?     ?   191.737   -72.0155     281.69     -72.0155     100.834    -72.0155     
1 1 1 57  3  12 o 0 64.1    14.3  ?     ?   149.426   -42.7347     189.677    -42.7347     49.013     -42.7347     
1 1 1 57  3  13 o 0 72.8    13.7  ?     ?   206.9     -8.24114     177.293    -8.24114     12.9534    171.759      
1 1 1 57  3  14 o 0 11.6    17.1  ?     ?   113.151   62.4571      30.4292    62.4571      71.9688    -117.543     
1 1 1 57  3  15 o 0 73.5    19.3  ?     ?   171.079   116.887      204.437    116.887      49.7659    116.887      
1 1 1 57  3  16 < 0 3.9     18.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 5  16 < 0 12.7    2.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 5  15 < 0 42.6    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 5  14 o 0 29.4    2.4   ?     ?   136.481   25.3787      94.0377    25.3787      18.5089    -154.621     
1 1 1 -57 5  13 o 0 1.2     2.1   ?     ?   84.5521   4.15693      51.5188    -175.843     121.647    -175.843     
1 1 1 -57 5  12 f 1 4.8     1.9   ?     ?   78.888    172.236      30.8062    -7.76414     97.9498    -7.76414     
1 1 1 -57 5  11 o 0 83.1    3.1   ?     ?   201.443   142.615      195.537    142.615      20.0759    142.615      
1 1 1 -57 5  10 o 0 182.7   4.9   ?     ?   267.472   -148.683     336.731    -148.683     102.182    -148.683     
1 1 1 -57 5  9  o 0 2.9     1.9   ?     ?   17.6529   87.6006      10.9935    -92.3994     27.1144    -92.3994     
1 1 1 -57 5  8  o 0 47      2.9   ?     ?   156.864   86.5556      126.001    86.5556      18.0982    -93.4444     
1 1 1 -57 5  7  o 0 10.8    2     ?     ?   15.0965   170.715      0.978922   170.715      12.8617    -9.28545     
1 1 1 -57 5  6  o 0 23      2.2   ?     ?   107.436   -146.668     54.4048    -146.668     44.5964    33.3322      
1 1 1 -57 5  5  o 0 129.6   4.1   ?     ?   327.851   -57.2058     197.877    -57.2058     95.2741    122.794      
1 1 1 -57 5  4  o 0 63.5    2.9   ?     ?   230.557   -42.6097     118.038    -42.6097     79.448     137.39       
1 1 1 -57 5  3  o 0 17.5    2.6   ?     ?   52.4268   -64.3654     22.1027    -64.3654     22.9805    115.635      
1 1 1 -57 5  2  o 0 1.1     2.2   ?     ?   28.4935   -64.7364     20.2871    115.264      44.8762    115.264      
1 1 1 -57 5  1  o 0 32      2.9   ?     ?   149.819   -52.346      70.9107    -52.346      58.7886    127.654      
1 1 1 57  5  0  o 0 328.1   7.8   ?     ?   415.093   -26.3707     418.206    -26.3707     53.2289    -26.3707     
1 1 1 57  5  1  o 0 336.9   7.9   ?     ?   319.56    -33.4949     509.427    -33.4949     227.891    -33.4949     
1 1 1 57  5  2  o 0 5.5     4.2   ?     ?   45.5532   155.33       19.9766    -24.6699     60.1751    -24.6699     
1 1 1 57  5  3  o 0 9.7     5.3   ?     ?   10.0403   -115.819     1.40775    64.1806      10.2792    64.1806      
1 1 1 57  5  4  o 0 74.7    5.3   ?     ?   193.866   83.1013      178.304    83.1013      6.85121    83.1013      
1 1 1 57  5  5  o 0 284.9   8.5   ?     ?   285.072   119.762      490.224    119.762      216.395    119.762      
1 1 1 57  5  6  o 0 73.5    6.2   ?     ?   186.551   -47.7518     186.815    -47.7518     7.59084    -47.7518     
1 1 1 57  5  7  o 0 19.2    7.5   ?     ?   39.5332   -93.5446     26.1316    -93.5446     11.841     86.4554      
1 1 1 57  5  8  o 0 76.6    7.6   ?     ?   174.686   -165.007     206.241    -165.007     37.2926    -165.007     
1 1 1 57  5  9  o 0 142.3   10.6  ?     ?   211.189   148.166      322.487    148.166      118.437    148.166      
1 1 1 57  5  10 o 0 63.2    12.2  ?     ?   113.744   120.856      211.08     120.856      105.029    120.856      
1 1 1 57  5  11 o 0 7.5     11.6  ?     ?   16.7762   99.078       4.32264    99.078       10.9653    -80.922      
1 1 1 57  5  12 f 1 5.6     11.8  ?     ?   91.8567   141.575      4.6532     141.575      78.2063    -38.4254     
1 1 1 57  5  13 o 0 28.7    15.4  ?     ?   109.113   -128.336     89.3105    -128.336     8.35716    51.6639      
1 1 1 57  5  14 o 0 8.1     15.4  ?     ?   65.909    -26.1494     39.9544    -26.1494     18.9959    153.851      
1 1 1 57  5  15 < 0 58      16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 7  14 < 0 40.7    2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 7  13 < 0 7.3     1.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 7  12 o 0 12.4    1.6   ?     ?   113.955   -46.4388     25.3191    -46.4388     67.5889    133.561      
1 1 1 -57 7  11 o 0 39.2    2.2   ?     ?   224.677   -77.9987     62.9728    -77.9987     121.155    102.001      
1 1 1 -57 7  10 o 0 50.1    5.1   ?     ?   201.508   -134.631     114.254    -134.631     52.0408    45.3691      
1 1 1 -57 7  9  o 0 10.1    4.7   ?     ?   159.779   178.759      34.3669    -1.24079     168.844    -1.24079     
1 1 1 -57 7  8  o 0 11.3    4.3   ?     ?   30.3925   41.7045      5.4159     41.7045      20.8687    -138.296     
1 1 1 -57 7  7  o 0 10      5     ?     ?   37.9999   105.597      2.11422    105.597      30.9372    -74.4035     
1 1 1 -57 7  6  o 0 3.8     3.7   ?     ?   92.0278   -81.7431     44.5918    98.2569      125.059    98.2569      
1 1 1 -57 7  5  o 0 13.3    4.3   ?     ?   183.216   -91.5946     37.7417    88.4054      204.333    88.4054      
1 1 1 -57 7  4  o 0 20      5.5   ?     ?   168.895   54.321       9.18907    54.321       145.067    -125.679     
1 1 1 -57 7  3  f 1 201.1   7.8   ?     ?   183.797   50.7619      428.236    50.7619      258.82     50.7619      
1 1 1 -57 7  2  o 0 483.2   10.8  ?     ?   432.987   59.8825      561.383    59.8825      162.86     59.8825      
1 1 1 -57 7  1  f 1 125.4   4     ?     ?   141.353   47.4124      330.485    47.4124      199.286    47.4124      
1 1 1 57  7  0  o 0 51.4    3.2   ?     ?   90.1311   144.567      178.067    144.567      93.012     144.567      
1 1 1 57  7  1  f 1 172.2   5.4   ?     ?   386.931   146.293      215.248    146.293      152.439    -33.7075     
1 1 1 57  7  2  o 0 200.1   6.2   ?     ?   382.62    116.945      267.749    116.945      94.5107    -63.0554     
1 1 1 57  7  3  f 1 97.3    5.3   ?     ?   272.908   58.865       170.326    58.865       89.6739    -121.135     
1 1 1 57  7  4  o 0 -8.3    8.7   ?     ?   125.118   -17.6651     76.4485    162.335      195.125    162.335      
1 1 1 57  7  5  o 0 267.5   8.8   ?     ?   395.192   -74.4813     369.52     -74.4813     7.16904    -74.4813     
1 1 1 57  7  6  o 0 13.3    6.3   ?     ?   105.323   -156.448     7.80918    -156.448     88.7583    23.5522      
1 1 1 57  7  7  o 0 15.7    7.2   ?     ?   68.1897   -159.12      26.4749    -159.12      36.02      20.8803      
1 1 1 57  7  8  o 0 118.9   9.4   ?     ?   221.281   -147.048     274.793    -147.048     76.3829    -147.048     
1 1 1 57  7  9  o 0 25.8    10.1  ?     ?   189.731   178.001      23.8046    178.001      146.11     -1.99945     
1 1 1 57  7  10 o 0 309.5   15.5  ?     ?   346.803   136.66       476.154    136.66       170.116    136.66       
1 1 1 57  7  11 o 0 219.6   14.8  ?     ?   270.346   -175.561     414.778    -175.561     176.156    -175.561     
1 1 1 57  7  12 < 0 90.4    17.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 57  7  13 < 0 14.9    15.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 9  10 < 0 124.9   7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 9  9  < 0 14.3    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 9  8  o 0 19.7    6.1   ?     ?   69.6211   141.117      75.743     141.117      19.3894    141.117      
1 1 1 -57 9  7  o 0 129     7.7   ?     ?   243.068   -137.851     262.986    -137.851     65.0757    -137.851     
1 1 1 -57 9  6  o 0 95.6    7     ?     ?   268.824   -128.951     176.008    -128.951     43.5791    51.0493      
1 1 1 -57 9  5  o 0 178.7   8.8   ?     ?   306.428   -138.26      299.114    -138.26      47.5466    -138.26      
1 1 1 -57 9  4  o 0 10.7    7     ?     ?   56.9667   -175.639     15.1852    -175.639     31.7991    4.36067      
1 1 1 -57 9  3  o 0 34.4    6.1   ?     ?   153.051   -162.729     89.8689    -162.729     38.5686    17.2706      
1 1 1 -57 9  2  o 0 49.7    6.2   ?     ?   201.485   -86.8598     108.316    -86.8598     61.4083    93.1402      
1 1 1 -57 9  1  o 0 16.2    8.7   ?     ?   16.33     62.0857      11.9912    62.0857      1.81128    -117.914     
1 1 1 57  9  0  o 0 31.3    3.1   ?     ?   95.1705   -75.3087     110.851    -75.3087     28.0824    -75.3087     
1 1 1 57  9  1  o 0 82.5    4.7   ?     ?   134.353   172.543      250.03     172.543      132.993    172.543      
1 1 1 57  9  2  o 0 8.3     5.1   ?     ?   67.7401   -60.3218     5.36162    119.678      64.4459    119.678      
1 1 1 57  9  3  o 0 0.3     6     ?     ?   67.4944   -55.4924     26.1005    124.508      84.2547    124.508      
1 1 1 57  9  4  o 0 27.2    6.5   ?     ?   169.59    -48.2886     58.101     -48.2886     88.0952    131.711      
1 1 1 57  9  5  o 0 -4.8    6.2   ?     ?   73.1403   -100.385     38.1165    79.6151      101.175    79.6151      
1 1 1 57  9  6  o 0 21.9    6.9   ?     ?   65.5592   64.4829      91.4785    64.4829      34.8442    64.4829      
1 1 1 57  9  7  o 0 38.6    7.7   ?     ?   79.8625   131.737      160.07     131.737      91.1247    131.737      
1 1 1 57  9  8  < 0 37.4    8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 57  9  9  < 0 134.7   11.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 57  9  10 < 0 29.4    10.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 11 3  < 1 13.9    8.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 11 2  < 0 18.9    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -57 11 1  < 0 94      10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 57  11 0  < 0 18.8    4.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 57  11 1  < 0 8.6     3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 57  11 2  < 0 4.4     5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 0  17 < 0 188     8.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 0  16 o 0 72.7    4.8   ?     ?   192.388   180          181.968    180          21.5371    180          
1 1 1 -58 0  15 o 0 27.3    3.7   ?     ?   63.9432   0            83.3382    0            29.6916    0            
1 1 1 -58 0  14 o 0 154.2   6.1   ?     ?   335.899   180          269.785    180          18.011     1.05103e-13  
1 1 1 -58 0  13 o 0 1.5     3.2   ?     ?   84.1736   0            6.1637     0            68.0441    180          
1 1 1 -58 0  12 o 0 98.5    4.9   ?     ?   347.001   0            218.692    0            89.3944    180          
1 1 1 -58 0  11 o 0 391.7   13.6  ?     ?   592.796   0            439.063    0            109.229    180          
1 1 1 -58 0  10 o 0 732.9   24    ?     ?   584.222   0            603.881    0            64.1789    0            
1 1 1 -58 0  9  o 0 -1.6    3.3   ?     ?   46.4666   0            1.76216    0            41.4159    180          
1 1 1 -58 0  8  o 0 72.9    4.2   ?     ?   212.696   0            183.395    0            0.324567   0            
1 1 1 -58 0  7  o 0 119     5.2   ?     ?   95.9939   0            226.411    0            143.366    0            
1 1 1 -58 0  6  o 0 -1.5    2.8   ?     ?   26.7209   0            0.646436   0            22.3782    180          
1 1 1 -58 0  5  o 0 111.4   5.7   ?     ?   166.494   0            229.159    0            85.0677    0            
1 1 1 -58 0  4  o 0 50.7    3.6   ?     ?   121.317   0            138.725    0            33.31      0            
1 1 1 -58 0  3  o 0 11.7    3.3   ?     ?   179.438   0            54.1871    0            102.302    180          
1 1 1 -58 0  2  o 0 75.9    4.8   ?     ?   286.462   0            192.223    0            58.4319    180          
1 1 1 -58 0  1  o 0 2.7     3.7   ?     ?   25.3694   0            1.8916     0            20.3727    180          
1 1 1 58  0  0  o 0 111     6.3   ?     ?   312.56    180          233.931    180          41.094     -3.18185e-13 
1 1 1 58  0  1  o 0 148.8   7.9   ?     ?   387.144   180          271.471    180          69.9595    2.72277e-14  
1 1 1 58  0  2  o 0 7.9     5     ?     ?   60.7931   0            11.8336    0            41.885     180          
1 1 1 58  0  3  o 0 6.8     5.1   ?     ?   189.625   0            27.5863    0            140.238    180          
1 1 1 58  0  4  o 0 205.2   9.7   ?     ?   273.805   0            320.35     0            77.7262    0            
1 1 1 58  0  5  o 0 16.4    6.9   ?     ?   16.5079   0            7.91329    0            6.72739    180          
1 1 1 58  0  6  o 0 164.5   11.3  ?     ?   281.527   0            286.724    0            34.7264    0            
1 1 1 58  0  7  o 0 43.2    9     ?     ?   177.261   0            139.758    0            18.9312    180          
1 1 1 58  0  8  o 0 9.9     10    ?     ?   25.8942   0            8.25647    0            16.9014    180          
1 1 1 58  0  9  o 0 75.4    12.7  ?     ?   151.777   0            198.618    0            51.2493    0            
1 1 1 58  0  10 o 0 -8      13.9  ?     ?   91.878    180          15.1158    180          74.6721    1.42039e-15  
1 1 1 58  0  11 o 0 -14.3   16.9  ?     ?   60.6188   180          10.6619    180          48.4949    1.54268e-15  
1 1 1 58  0  12 o 0 144.7   20.9  ?     ?   248.396   0            276.531    0            42.7077    0            
1 1 1 58  0  13 o 0 283     25.6  ?     ?   426.159   0            388.188    0            3.74914    180          
1 1 1 58  0  14 o 0 424.5   32.1  ?     ?   535.35    0            473.799    0            10.8913    180          
1 1 1 58  0  15 o 0 -4.4    23.3  ?     ?   179.462   0            52.7817    0            109.58     180          
1 1 1 -58 2  17 < 0 30.9    2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 2  16 < 0 32.2    2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 2  15 o 0 9       2.5   ?     ?   35.1962   157.447      16.1928    157.447      13.1538    -22.5527     
1 1 1 -58 2  14 o 0 42.6    2.8   ?     ?   231.437   37.2201      70.6322    37.2201      123.478    -142.78      
1 1 1 -58 2  13 o 0 20.6    2.4   ?     ?   104.306   -38.0345     59.2537    -38.0345     30.07      141.966      
1 1 1 -58 2  12 o 0 7.9     2.2   ?     ?   82.1443   105.311      13.9539    -74.6887     86.3217    -74.6887     
1 1 1 -58 2  11 o 0 173.2   5.2   ?     ?   292.507   38.1738      295.067    38.1738      26.5584    38.1738      
1 1 1 -58 2  10 o 0 125.5   3.8   ?     ?   253.127   -3.89613     243.981    -3.89613     10.1177    -3.89613     
1 1 1 -58 2  9  o 0 41.7    2.4   ?     ?   118.768   33.7963      127.265    33.7963      17.6926    33.7963      
1 1 1 -58 2  8  o 0 60.5    2.8   ?     ?   135.282   -49.4568     180.258    -49.4568     54.7435    -49.4568     
1 1 1 -58 2  7  o 0 207.2   5.2   ?     ?   340.32    -114.406     309.765    -114.406     17.3592    -114.406     
1 1 1 -58 2  6  f 1 49.6    2.8   ?     ?   265.889   -57.7266     50.9187    -57.7266     179.834    122.273      
1 1 1 -58 2  5  o 0 95.6    3.6   ?     ?   183.674   -147.023     229.074    -147.023     71.1549    -147.023     
1 1 1 -58 2  4  o 0 48.1    2.5   ?     ?   95.5393   -114.201     136.908    -114.201     54.4243    -114.201     
1 1 1 -58 2  3  o 0 14.3    2.3   ?     ?   74.9449   92.7611      4.73042    92.7611      60.2175    -87.2389     
1 1 1 -58 2  2  o 0 57.1    3     ?     ?   257.687   29.458       80.7985    29.458       143.279    -150.542     
1 1 1 -58 2  1  o 0 10.8    2.6   ?     ?   55.7993   -38.4115     7.08016    141.588      55.7505    141.588      
1 1 1 58  2  0  o 0 23.6    3.2   ?     ?   28.9649   -32.6577     23.0139    -32.6577     2.44618    147.342      
1 1 1 58  2  1  o 0 164     5.2   ?     ?   394.375   -19.2819     205.21     -19.2819     142.205    160.718      
1 1 1 58  2  2  o 0 3.9     3.8   ?     ?   112.393   -89.6644     65.9218    90.3356      165.115    90.3356      
1 1 1 58  2  3  o 0 143.1   5.4   ?     ?   256.853   20.1648      279.998    20.1648      52.9706    20.1648      
1 1 1 58  2  4  o 0 92.8    5.3   ?     ?   202.011   13.9331      216.463    13.9331      37.705     13.9331      
1 1 1 58  2  5  o 0 330.2   9.5   ?     ?   322.633   56.1106      505.476    56.1106      217.254    56.1106      
1 1 1 58  2  6  f 1 87.7    6.8   ?     ?   219.021   110.658      192.96     110.658      3.78799    -69.3417     
1 1 1 58  2  7  o 0 192.1   8.2   ?     ?   231.517   102.463      404.687    102.463      187.754    102.463      
1 1 1 58  2  8  o 0 29.8    6.5   ?     ?   129.529   -30.8795     78.4015    -30.8795     47.2245    149.12       
1 1 1 58  2  9  o 0 158.2   9.8   ?     ?   223.318   -73.2727     345.733    -73.2727     129.301    -73.2727     
1 1 1 58  2  10 o 0 43.4    10.5  ?     ?   111.166   141.259      144.901    141.259      36.4747    141.259      
1 1 1 58  2  11 o 0 45.6    11.4  ?     ?   205.668   123.752      90.1947    123.752      103.357    -56.2481     
1 1 1 58  2  12 o 0 53.1    13.1  ?     ?   211.908   97.9366      113.521    97.9366      81.3724    -82.0634     
1 1 1 58  2  13 o 0 151.7   15.4  ?     ?   238.752   24.7514      328.05     24.7514      108.972    24.7514      
1 1 1 58  2  14 o 0 20      18.2  ?     ?   117.472   -150.479     56.2226    -150.479     49.8767    29.5206      
1 1 1 58  2  15 o 0 90.9    19.6  ?     ?   161.323   167.901      257.793    167.901      112.213    167.901      
1 1 1 58  2  16 < 0 99.3    20.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 4  16 < 0 82.9    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 4  15 < 0 27.8    2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 4  14 f 1 19.4    2.2   ?     ?   176.868   -12.5925     22.302     -12.5925     124.798    167.408      
1 1 1 -58 4  13 o 0 104.6   3.4   ?     ?   166.185   -162.681     276.527    -162.681     138.233    -162.681     
1 1 1 -58 4  12 o 0 105.5   3.5   ?     ?   261.628   127.542      204.033    127.542      18.2237    -52.4581     
1 1 1 -58 4  11 o 0 221.7   6.3   ?     ?   274.935   139.319      389.122    139.319      148.89     139.319      
1 1 1 -58 4  10 o 0 119.4   3.9   ?     ?   193.403   -176.305     282.788    -176.305     112.666    -176.305     
1 1 1 -58 4  9  o 0 2.9     2.2   ?     ?   90.9722   16.0589      57.4928    -163.941     140.822    -163.941     
1 1 1 -58 4  8  o 0 38.9    2.6   ?     ?   229.618   91.2788      41.3631    91.2788      168.622    -88.7212     
1 1 1 -58 4  7  o 0 175.7   4.9   ?     ?   297.944   38.8589      297.345    38.8589      23.3894    38.8589      
1 1 1 -58 4  6  o 0 18.9    2.2   ?     ?   68.0233   -34.9887     38.0173    -34.9887     24.846     145.011      
1 1 1 -58 4  5  o 0 50.6    2.7   ?     ?   160.53    -78.2152     128.082    -78.2152     9.22046    101.785      
1 1 1 -58 4  4  o 0 26.3    2.5   ?     ?   94.0574   105.281      64.0639    105.281      16.7285    -74.7188     
1 1 1 -58 4  3  o 0 30.7    2.6   ?     ?   176.214   -172.19      50.3845    -172.19      101.569    7.8102       
1 1 1 -58 4  2  o 0 101     3.8   ?     ?   229.457   -153.044     210.588    -153.044     12.024     -153.044     
1 1 1 -58 4  1  o 0 156.2   4.8   ?     ?   223.277   -84.016      322.523    -84.016      128.697    -84.016      
1 1 1 58  4  0  o 0 967.9   19.8  ?     ?   634.703   -44.0272     801.489    -44.0272     243.215    -44.0272     
1 1 1 58  4  1  o 0 391.6   9.2   ?     ?   354.521   -85.1405     543.95     -85.1405     231.471    -85.1405     
1 1 1 58  4  2  o 0 -0.7    3.6   ?     ?   74.7532   77.9892      53.0188    -102.011     119.021    -102.011     
1 1 1 58  4  3  o 0 23.1    4     ?     ?   124.255   171.84       44.3676    171.84       65.4925    -8.16041     
1 1 1 58  4  4  o 0 39.2    4.9   ?     ?   177.197   96.2414      82.9362    96.2414      73.8921    -83.7586     
1 1 1 58  4  5  o 0 90.4    5.8   ?     ?   204.36    41.8299      216.718    41.8299      20.2516    41.8299      
1 1 1 58  4  6  o 0 52.7    6.4   ?     ?   115.487   -146.153     171.119    -146.153     60.0617    -146.153     
1 1 1 58  4  7  o 0 55.7    7.9   ?     ?   206.128   -96.6894     118.442    -96.6894     79.7599    83.3106      
1 1 1 58  4  8  o 0 56.8    7.6   ?     ?   60.2152   52.9005      190.346    52.9005      132.04     52.9005      
1 1 1 58  4  9  o 0 101     10.2  ?     ?   154.688   20.5375      280.732    20.5375      131.079    20.5375      
1 1 1 58  4  10 o 0 156.4   13.1  ?     ?   188.004   37.1996      375.324    37.1996      199.787    37.1996      
1 1 1 58  4  11 o 0 83      11.9  ?     ?   256.955   29.8669      164.438    29.8669      70.0826    -150.133     
1 1 1 58  4  12 o 0 42.4    12.6  ?     ?   78.8528   78.2981      162.942    78.2981      92.0591    78.2981      
1 1 1 58  4  13 o 0 48.8    14.5  ?     ?   196.748   105.993      113.757    105.993      62.6694    -74.0068     
1 1 1 58  4  14 f 1 78.4    15.5  ?     ?   228.683   157.143      175.361    157.143      30.6275    -22.8572     
1 1 1 58  4  15 < 0 44      14.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 6  14 < 0 30.4    2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 6  13 o 0 7.6     1.9   ?     ?   63.45     -99.1716     9.5286     -99.1716     42.1695    80.8284      
1 1 1 -58 6  12 o 0 110.4   3.5   ?     ?   264.265   -171.584     214.496    -171.584     2.50048    8.41635      
1 1 1 -58 6  11 o 0 7.6     1.8   ?     ?   44.6027   144.523      2.34289    144.523      34.4684    -35.4771     
1 1 1 -58 6  10 f 1 29.8    1.9   ?     ?   187.467   141.785      50.8962    141.785      107.763    -38.2149     
1 1 1 -58 6  9  o 0 25.5    1.9   ?     ?   146.624   62.4065      61.1014    62.4065      63.1585    -117.594     
1 1 1 -58 6  8  o 0 20.8    1.9   ?     ?   57.6135   95.8098      53.3546    95.8098      3.18612    95.8098      
1 1 1 -58 6  7  o 0 99.7    3.4   ?     ?   198.049   -154.586     237.017    -154.586     63.5857    -154.586     
1 1 1 -58 6  6  o 0 132.2   3.8   ?     ?   252.654   144.608      253.883    144.608      23.724     144.608      
1 1 1 -58 6  5  f 1 25.7    2.2   ?     ?   223.423   46.5468      5.13787    -133.453     210.704    -133.453     
1 1 1 -58 6  4  o 0 60.3    2.9   ?     ?   244.357   82.3316      98.1146    82.3316      126.555    -97.6684     
1 1 1 -58 6  3  o 0 79.1    3.2   ?     ?   130.194   7.43351      230.882    7.43351      111.589    7.43351      
1 1 1 -58 6  2  f 1 227.4   5.8   ?     ?   383.814   4.57743      302.021    4.57743      52.7529    -175.423     
1 1 1 -58 6  1  f 1 48.8    3     ?     ?   147.139   18.4688      135.717    18.4688      0.732223   -161.531     
1 1 1 58  6  0  o 0 39.6    3.2   ?     ?   79.6637   90.2668      127.905    90.2668      52.9869    90.2668      
1 1 1 58  6  1  f 1 110.4   4.4   ?     ?   238.607   89.8795      229.293    89.8795      3.3094     89.8795      
1 1 1 58  6  2  f 1 28.1    4     ?     ?   200.208   104.695      21.883     104.695      168.032    -75.3049     
1 1 1 58  6  3  o 0 67.3    5.2   ?     ?   184.89    39.0584      170.718    39.0584      5.29166    -140.942     
1 1 1 58  6  4  o 0 126.6   6.1   ?     ?   195.612   148.247      302.093    148.247      115.718    148.247      
1 1 1 58  6  5  f 1 125.5   6.6   ?     ?   209.215   -82.1368     287.67     -82.1368     87.2147    -82.1368     
1 1 1 58  6  6  o 0 81.4    7.3   ?     ?   172.044   -4.83666     217.578    -4.83666     53.5644    -4.83666     
1 1 1 58  6  7  o 0 73.3    8.7   ?     ?   103.963   16.31        243.405    16.31        147.659    16.31        
1 1 1 58  6  8  o 0 89.2    8.8   ?     ?   229.195   -154.556     196.065    -154.556     14.8701    25.4437      
1 1 1 58  6  9  o 0 25.6    10.2  ?     ?   128.281   90.2111      64.6087    90.2111      50.8666    -89.7889     
1 1 1 58  6  10 f 1 148.8   12.1  ?     ?   226.144   103.226      332.998    103.226      131.347    103.226      
1 1 1 58  6  11 o 0 102.1   13.4  ?     ?   176.788   -148.263     274.694    -148.263     118.153    -148.263     
1 1 1 58  6  12 o 0 -11.4   15.1  ?     ?   53.5233   101.566      3.29429    101.566      44.0974    -78.4337     
1 1 1 58  6  13 < 0 35.8    16    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 8  11 < 0 2.8     4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 8  10 < 0 39.1    5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 8  9  o 0 31.9    5.4   ?     ?   102.787   0.124202     119.85     0.124202     36.2687    0.124202     
1 1 1 -58 8  8  o 0 6.5     4.9   ?     ?   81.7446   118.071      11.953     -61.9293     78.6912    -61.9293     
1 1 1 -58 8  7  o 0 22.4    5.2   ?     ?   139.532   -112.203     54.7228    -112.203     59.8611    67.7975      
1 1 1 -58 8  6  o 0 5.3     4.8   ?     ?   74.9154   103.123      21.5814    -76.8774     84.253     -76.8774     
1 1 1 -58 8  5  o 0 1.9     5.5   ?     ?   28.2885   -165.776     10.8872    14.2243      34.6708    14.2243      
1 1 1 -58 8  4  o 0 199.9   10    ?     ?   326.452   82.6028      315.528    82.6028      39.8019    82.6028      
1 1 1 -58 8  3  o 0 161.8   9.3   ?     ?   292.663   123.846      282.841    123.846      34.621     123.846      
1 1 1 -58 8  2  o 0 105.6   8.7   ?     ?   201.744   98.6327      248.216    98.6327      76.4624    98.6327      
1 1 1 -58 8  1  o 0 55.9    3.1   ?     ?   247.173   -159.456     89.0252    -159.456     126.609    20.5444      
1 1 1 58  8  0  o 0 39.3    3.2   ?     ?   86.8572   146.188      137.077    146.188      59.324     146.188      
1 1 1 58  8  1  o 0 211.2   6.2   ?     ?   369.217   160.605      303.07     160.605      28.0291    -19.3953     
1 1 1 58  8  2  o 0 66.9    4.5   ?     ?   174.579   133.259      184.75     133.259      31.2454    133.259      
1 1 1 58  8  3  o 0 14.4    4.2   ?     ?   111.301   -96.5339     22.7404    -96.5339     75.2248    83.4661      
1 1 1 58  8  4  o 0 131     7.9   ?     ?   219.275   -87.8132     296.559    -87.8132     103.432    -87.8132     
1 1 1 58  8  5  o 0 21.6    7.3   ?     ?   141.78    -94.0893     40.6034    -94.0893     84.3027    85.9107      
1 1 1 58  8  6  o 0 21.8    7.7   ?     ?   107.085   152.837      65.8772    152.837      27.2212    -27.1626     
1 1 1 58  8  7  o 0 56.8    10.4  ?     ?   145.59    -163.386     177.434    -163.386     50.9236    -163.386     
1 1 1 58  8  8  o 0 121.2   10.8  ?     ?   231.956   -147.856     271.928    -147.856     70.102     -147.856     
1 1 1 58  8  9  o 0 31.8    12.5  ?     ?   149.79    -153.291     83.1139    -153.291     47.0491    26.7092      
1 1 1 58  8  10 < 0 9.7     12.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 58  8  11 < 0 -0.4    13.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 10 6  < 0 109.7   8.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 10 5  < 0 -3.7    6.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 10 4  < 0 45.3    7.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 10 3  < 0 13.8    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 10 2  < 0 67.2    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -58 10 1  o 0 59.4    9.8   ?     ?   182.744   93.8593      152.2      93.8593      3.45357    93.8593      
1 1 1 58  10 0  o 0 96.3    5.8   ?     ?   264.116   -152.124     188.918    -152.124     33.2791    27.8756      
1 1 1 58  10 1  < 0 27.5    4.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 58  10 2  < 0 153.5   7     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 58  10 3  < 0 39.4    6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 58  10 4  < 0 118.6   7.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 58  10 5  < 0 24.6    7.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 58  10 6  < 0 27.2    9.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 1  16 < 0 46.2    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 1  15 o 0 17.4    2.6   ?     ?   116.958   -17.0261     52.3716    -17.0261     44.9346    162.974      
1 1 1 -59 1  14 f 1 32.1    2.5   ?     ?   113.668   131.993      112.334    131.993      16.7248    131.993      
1 1 1 -59 1  13 o 0 45.4    2.8   ?     ?   175.734   -11.976      116.35     -11.976      33.7924    168.024      
1 1 1 -59 1  12 f 1 79      3     ?     ?   367.312   46.1239      50.8677    46.1239      273.618    -133.876     
1 1 1 -59 1  11 o 0 127.9   4     ?     ?   303.281   -5.38937     213.186    -5.38937     55.1836    174.611      
1 1 1 -59 1  10 o 0 46.1    2.6   ?     ?   244.968   -24.2587     54.5377    -24.2587     171.225    155.741      
1 1 1 -59 1  9  o 0 13.5    2     ?     ?   29.4337   96.301       8.51069    96.301       18.5755    -83.699      
1 1 1 -59 1  8  o 0 3.2     2     ?     ?   10.901    40.2457      6.93749    -139.754     17.0255    -139.754     
1 1 1 -59 1  7  o 0 16.7    2.3   ?     ?   46.3241   -61.3498     18.7089    -61.3498     22.9109    118.65       
1 1 1 -59 1  6  o 0 145.1   4.4   ?     ?   328.065   -16.5769     218.956    -16.5769     63.5541    163.423      
1 1 1 -59 1  5  o 0 294.3   7.1   ?     ?   287.978   -54.3447     473.475    -54.3447     224.373    -54.3447     
1 1 1 -59 1  4  o 0 107     3.5   ?     ?   271.657   -72.9008     191.881    -72.9008     44.0727    107.099      
1 1 1 -59 1  3  o 0 282     6.4   ?     ?   373.64    -86.9846     392.58     -86.9846     69.6538    -86.9846     
1 1 1 -59 1  2  o 0 322.1   7.4   ?     ?   388.189   -78.6918     432.498    -78.6918     95.8534    -78.6918     
1 1 1 -59 1  1  o 0 294     7.2   ?     ?   351.86    -64.0473     428.356    -64.0473     122.284    -64.0473     
1 1 1 59  1  0  o 0 326.8   7.8   ?     ?   385.7     -102.371     443.875    -102.371     106.589    -102.371     
1 1 1 59  1  1  o 0 68.6    3.9   ?     ?   186.49    -21.2818     164.823    -21.2818     1.3719     -21.2818     
1 1 1 59  1  2  o 0 51.7    4     ?     ?   160.023   -46.6927     131.934    -46.6927     8.59001    133.307      
1 1 1 59  1  3  o 0 107     4.8   ?     ?   261.016   -24.4964     204.264    -24.4964     27.3184    155.504      
1 1 1 59  1  4  o 0 144.9   6.2   ?     ?   232.302   -83.5357     302.286    -83.5357     95.9307    -83.5357     
1 1 1 59  1  5  o 0 2.4     4.9   ?     ?   170.5     177.271      102.909    -2.72935     254.494    -2.72935     
1 1 1 59  1  6  o 0 32.7    6.1   ?     ?   161.646   -109.804     70.9361    -109.804     79.8062    70.1961      
1 1 1 59  1  7  o 0 28.7    6     ?     ?   97.5908   -94.9303     85.0186    -94.9303     9.22383    85.0697      
1 1 1 59  1  8  o 0 8.3     7.7   ?     ?   35.3541   -103.945     4.84003    76.0552      38.9721    76.0552      
1 1 1 59  1  9  o 0 51.9    9.2   ?     ?   113.676   87.5893      174.182    87.5893      63.683     87.5893      
1 1 1 59  1  10 o 0 381.9   14.3  ?     ?   355.888   137.313      548.696    137.313      203.112    137.313      
1 1 1 59  1  11 o 0 39.9    11.1  ?     ?   111.785   97.2395      134.625    97.2395      29.8798    97.2395      
1 1 1 59  1  12 f 1 299.8   15.4  ?     ?   320.719   11.8076      491.108    11.8076      195.877    11.8076      
1 1 1 59  1  13 o 0 394.6   19.2  ?     ?   400.53    20.2164      543.226    20.2164      181.994    20.2164      
1 1 1 59  1  14 f 1 10.4    19    ?     ?   128.9     -51.4577     29.5688    -51.4577     87.2399    128.542      
1 1 1 59  1  15 < 0 -7.7    19.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 59  1  16 < 0 89.6    23.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 3  16 < 0 224.5   6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 3  15 < 0 49.6    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 3  14 o 0 3.8     2.3   ?     ?   98.1566   70.9083      35.7189    -109.092     117.055    -109.092     
1 1 1 -59 3  13 o 0 27.1    2.5   ?     ?   122.067   173.669      87.7765    173.669      13.9428    -6.33133     
1 1 1 -59 3  12 o 0 39.6    2.6   ?     ?   173.465   138.733      98.1024    138.733      49.4502    -41.2675     
1 1 1 -59 3  11 o 0 24.2    2.7   ?     ?   110.744   71.4612      67.9557    71.4612      28.9293    -108.539     
1 1 1 -59 3  10 o 0 33.6    2.4   ?     ?   153.162   161.881      85.7243    161.881      49.1577    -18.119      
1 1 1 -59 3  9  o 0 16.9    2.9   ?     ?   30.2616   -38.3186     22.3109    -38.3186     5.43894    141.681      
1 1 1 -59 3  8  o 0 153     5.2   ?     ?   261.862   -71.0056     287.688    -71.0056     46.1652    -71.0056     
1 1 1 -59 3  7  o 0 24.9    2.4   ?     ?   78.1696   -43.8924     66.2508    -43.8924     5.69782    136.108      
1 1 1 -59 3  6  o 0 134.8   4.5   ?     ?   260.413   -47.4576     257.484    -47.4576     16.5916    -47.4576     
1 1 1 -59 3  5  o 0 15.9    2.2   ?     ?   60.7085   -78.2294     18.2065    -78.2294     36.2816    101.771      
1 1 1 -59 3  4  f 1 237.9   6     ?     ?   299.446   -85.0471     385.74     -85.0471     126.968    -85.0471     
1 1 1 -59 3  3  o 0 211.1   5.9   ?     ?   341.419   -64.4711     316.012    -64.4711     21.3369    -64.4711     
1 1 1 -59 3  2  o 0 85.8    3.5   ?     ?   248.167   -34.8484     162.41     -34.8484     52.5322    145.152      
1 1 1 -59 3  1  o 0 196.4   6.6   ?     ?   182.902   -96.2246     417.55     -96.2246     258.637    -96.2246     
1 1 1 59  3  0  o 0 33.2    3.2   ?     ?   82.3604   16.8858      92.5493    16.8858      20.2204    16.8858      
1 1 1 59  3  1  o 0 46.2    3.6   ?     ?   88.3856   -82.9023     140.581    -82.9023     62.7931    -82.9023     
1 1 1 59  3  2  o 0 85.5    4.6   ?     ?   170.139   92.4741      220.992    92.4741      70.9802    92.4741      
1 1 1 59  3  3  o 0 28.5    4.3   ?     ?   101.919   82.6869      74.1481    82.6869      15.846     -97.3131     
1 1 1 59  3  4  f 1 233.1   7.6   ?     ?   312.255   62.0864      378.736    62.0864      101.293    62.0864      
1 1 1 59  3  5  o 0 233.8   8.5   ?     ?   326.344   59.9524      379.02     59.9524      65.6356    59.9524      
1 1 1 59  3  6  o 0 140.4   7.1   ?     ?   325.312   179.299      219.892    179.299      92.6173    -0.701425    
1 1 1 59  3  7  o 0 94      7.4   ?     ?   154.41    145.915      262.895    145.915      114.562    145.915      
1 1 1 59  3  8  o 0 135.2   9.1   ?     ?   193.097   -12.8704     325.286    -12.8704     138.469    -12.8704     
1 1 1 59  3  9  o 0 70.7    9.7   ?     ?   158.525   -40.0464     200.552    -40.0464     47.3007    -40.0464     
1 1 1 59  3  10 o 0 31.1    10.7  ?     ?   56.1383   72.2604      91.6212    72.2604      39.2387    72.2604      
1 1 1 59  3  11 o 0 17      12.3  ?     ?   76.0685   48.0624      41.673     48.0624      27.7183    -131.938     
1 1 1 59  3  12 o 0 -2.1    14.1  ?     ?   116.805   60.1369      16.1452    -119.863     121.103    -119.863     
1 1 1 59  3  13 o 0 129     16.7  ?     ?   240.238   108.263      282.598    108.263      67.2331    108.263      
1 1 1 59  3  14 o 0 129.9   17.9  ?     ?   264.275   164.973      262.982    164.973      26.1878    164.973      
1 1 1 59  3  15 < 0 65.9    19.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 5  14 < 0 7       2     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 5  13 o 0 106.1   3.6   ?     ?   275.973   175.8        196.066    175.8        29.9641    -4.20011     
1 1 1 -59 5  12 o 0 62      2.7   ?     ?   248.978   156.337      113.378    156.337      91.653     -23.6632     
1 1 1 -59 5  11 o 0 17.8    1.8   ?     ?   40.9599   38.0919      46.5725    38.0919      12.5969    38.0919      
1 1 1 -59 5  10 o 0 68.1    3     ?     ?   183.788   -68.2743     174.969    -68.2743     19.4469    -68.2743     
1 1 1 -59 5  9  f 1 7       2     ?     ?   131.576   -106.363     43.3211    73.6374      158.351    73.6374      
1 1 1 -59 5  8  o 0 9.4     2.1   ?     ?   170.813   164.707      48.2938    -15.2934     197.757    -15.2934     
1 1 1 -59 5  7  o 0 111.7   3.9   ?     ?   277.041   58.1539      192.518    58.1539      59.7471    -121.846     
1 1 1 -59 5  6  o 0 117     3.9   ?     ?   200.896   54.777       267.38     54.777       83.5001    54.777       
1 1 1 -59 5  5  o 0 24.4    2.4   ?     ?   146.493   64.2683      47.0057    64.2683      87.7225    -115.732     
1 1 1 -59 5  4  o 0 27.8    2.5   ?     ?   137.18    162.543      63.345     162.543      62.4296    -17.457      
1 1 1 -59 5  3  o 0 188.6   5.2   ?     ?   340.027   174.73       282.54     174.73       30.4682    -5.26995     
1 1 1 -59 5  2  o 0 7.6     2.6   ?     ?   49.7992   83.251       13.6969    -96.749      59.7052    -96.749      
1 1 1 -59 5  1  o 0 108.6   4.1   ?     ?   131.412   66.8286      301.857    66.8286      180.054    66.8286      
1 1 1 59  5  0  o 0 186.5   5.6   ?     ?   276.526   -22.6201     341.639    -22.6201     81.0504    -22.6201     
1 1 1 59  5  1  o 0 63      4     ?     ?   115.396   -155.742     200.691    -155.742     91.7249    -155.742     
1 1 1 59  5  2  o 0 11      3.5   ?     ?   118.422   145.372      18.0021    -34.6281     130.013    -34.6281     
1 1 1 59  5  3  o 0 161.6   6.3   ?     ?   240.027   51.0429      331.229    51.0429      103.895    51.0429      
1 1 1 59  5  4  o 0 24.9    4.8   ?     ?   107.252   60.6003      71.2454    60.6003      31.1955    -119.4       
1 1 1 59  5  5  o 0 5.6     5.4   ?     ?   126.793   7.82621      54.8227    -172.174     175.999    -172.174     
1 1 1 59  5  6  o 0 12.8    6.3   ?     ?   143.017   -31.3955     19.5697    148.604      156.28     148.604      
1 1 1 59  5  7  o 0 10.4    7.8   ?     ?   66.2957   -129.564     2.64535    -129.564     58.5828    50.4358      
1 1 1 59  5  8  o 0 35.4    8.6   ?     ?   46.642    152.367      102.691    152.367      59.6382    152.367      
1 1 1 59  5  9  f 1 38.1    9.5   ?     ?   151.614   52.285       108.859    52.285       28.7443    -127.715     
1 1 1 59  5  10 o 0 97.8    10.9  ?     ?   266.56    67.9185      190.797    67.9184      49.5709    -112.082     
1 1 1 59  5  11 o 0 29.6    12.6  ?     ?   48.9519   -92.5167     91.9941    -92.5167     48.5033    -92.5167     
1 1 1 59  5  12 o 0 75.4    14    ?     ?   166.828   113.533      218.548    113.533      70.3157    113.533      
1 1 1 59  5  13 < 0 -6      14.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 59  5  14 < 0 -7.3    15.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 7  12 < 1 5.2     1.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 7  11 < 0 16      1.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 7  10 o 0 7       4.1   ?     ?   17.5933   -174.449     3.03626    -174.449     11.3015    5.5509       
1 1 1 -59 7  9  o 0 11.3    4.1   ?     ?   87.7989   48.1054      15.4071    48.1054      56.4591    -131.895     
1 1 1 -59 7  8  o 0 24      4.5   ?     ?   112.581   -14.3248     76.8909    -14.3248     15.8335    165.675      
1 1 1 -59 7  7  o 0 12.4    4.3   ?     ?   134.53    -23.1168     3.96365    156.883      116.88     156.883      
1 1 1 -59 7  6  o 0 25.4    3.8   ?     ?   186.712   91.7307      33.3905    91.7307      124.167    -88.2693     
1 1 1 -59 7  5  o 0 43.7    5.4   ?     ?   171.504   78.9118      111.673    78.9118      33.7699    -101.088     
1 1 1 -59 7  4  o 0 34.1    2.2   ?     ?   164.255   96.8977      79.4481    96.8977      63.4609    -83.1023     
1 1 1 -59 7  3  o 0 77.9    3.8   ?     ?   156.855   43.4528      215.386    43.4528      78.3487    43.4528      
1 1 1 -59 7  2  o 0 50.6    3.4   ?     ?   85.5199   28.3876      172.761    28.3876      97.7657    28.3876      
1 1 1 -59 7  1  o 0 122.2   4.1   ?     ?   274.287   -128.236     224.761    -128.236     16.5763    51.7638      
1 1 1 59  7  0  o 0 96.6    4.1   ?     ?   228.305   -175.481     212.743    -175.481     7.18113    -175.481     
1 1 1 59  7  1  o 0 43.2    3.7   ?     ?   156.043   57.3402      120.994    57.3402      19.7679    -122.66      
1 1 1 59  7  2  o 0 58.8    5.3   ?     ?   236.665   40.2888      109.163    40.2888      104.649    -139.711     
1 1 1 59  7  3  o 0 57.9    5.1   ?     ?   192.733   -101.021     141.145    -101.021     33.1765    78.9789      
1 1 1 59  7  4  o 0 64.3    6.2   ?     ?   183.941   -106.957     165.488    -106.957     1.00924    73.0434      
1 1 1 59  7  5  o 0 6.7     6.3   ?     ?   111.524   -167.599     26.9497    12.4009      125.832    12.4009      
1 1 1 59  7  6  o 0 203.3   9.9   ?     ?   291.173   79.6087      366.147    79.6087      107.977    79.6087      
1 1 1 59  7  7  o 0 194.9   10.5  ?     ?   324.728   134.483      329.359    134.483      45.2965    134.483      
1 1 1 59  7  8  o 0 3.3     8.6   ?     ?   67.5873   -174.962     7.36186    5.03787      66.4399    5.03787      
1 1 1 59  7  9  o 0 24.7    9     ?     ?   176.36    122.642      39.2039    122.642      115.119    -57.3581     
1 1 1 59  7  10 o 0 51.7    10.8  ?     ?   140.608   131.981      169.873    131.981      47.026     131.981      
1 1 1 59  7  11 < 0 9.2     11.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 9  8  < 0 25.4    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 9  7  < 0 7.4     5.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 9  6  < 0 12.8    6.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -59 9  5  o 0 21.9    5.3   ?     ?   98.6913   86.5624      79.9444    86.5624      0.0834766  -93.4376     
1 1 1 -59 9  4  o 0 48.6    7.7   ?     ?   148.698   112.391      146.944    112.391      25.7978    112.391      
1 1 1 -59 9  3  o 0 8.2     6.7   ?     ?   70.8081   170.553      12.2406    170.553      45.6952    -9.447       
1 1 1 -59 9  2  f 1 18      7.5   ?     ?   101.159   16.776       54.5711    16.776       28.9467    -163.224     
1 1 1 -59 9  1  f 1 49.1    3     ?     ?   88.1166   107.549      187.777    107.549      114.775    107.549      
1 1 1 59  9  0  o 0 47.1    3.3   ?     ?   115.484   178.79       173.324    178.79       75.227     178.79       
1 1 1 59  9  1  f 1 39.7    4.2   ?     ?   164.04    165.47       115.037    165.47       25.2597    -14.5295     
1 1 1 59  9  2  f 1 35.6    4.9   ?     ?   120.86    -122.156     129.611    -122.156     26.108     -122.156     
1 1 1 59  9  3  o 0 84.7    6.5   ?     ?   157.34    -134.248     247.247    -134.248     113.067    -134.248     
1 1 1 59  9  4  o 0 56.8    7     ?     ?   152.211   -85.0585     177.16     -85.0585     47.2807    -85.0585     
1 1 1 59  9  5  < 0 7.8     8.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 59  9  6  < 0 2.2     7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 59  9  7  < 0 118.8   15.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 0  16 < 0 31.5    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 0  15 < 0 1.9     3.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 0  14 o 0 6.8     3.1   ?     ?   124.942   180          38.1329    180          66.2265    4.04018e-15  
1 1 1 -60 0  13 o 0 45.9    3.5   ?     ?   252.718   0            145.885    0            66.3291    180          
1 1 1 -60 0  12 o 0 62.5    4.3   ?     ?   224.24    180          171.512    180          20.6474    5.82858e-14  
1 1 1 -60 0  11 o 0 4       2.9   ?     ?   70.254    180          9.50022    180          52.402     1.27209e-15  
1 1 1 -60 0  10 o 0 18.3    3     ?     ?   145.274   180          83.3791    180          45.4411    1.28748e-14  
1 1 1 -60 0  9  o 0 85.5    4.4   ?     ?   283.373   180          204.769    180          56.8204    2.52867e-14  
1 1 1 -60 0  8  o 0 112.4   5.2   ?     ?   221.852   180          236.109    180          31.7003    180          
1 1 1 -60 0  7  o 0 20.4    2.8   ?     ?   151.405   0            88.9385    0            51.2894    180          
1 1 1 -60 0  6  f 1 -4.4    3.1   ?     ?   236.926   0            5.2201     0            216.411    180          
1 1 1 -60 0  5  o 0 57.6    3.9   ?     ?   213.084   180          162.564    180          20.9353    5.4485e-14   
1 1 1 -60 0  4  o 0 346.8   10.8  ?     ?   356.956   180          403.142    180          94.484     180          
1 1 1 -60 0  3  o 0 205.5   7.4   ?     ?   381.132   180          311.528    180          19.2704    1.13433e-13  
1 1 1 -60 0  2  f 1 -5.7    3.4   ?     ?   143.919   180          2.78354    180          123.197    1.58536e-16  
1 1 1 -60 0  1  o 0 51.3    4.4   ?     ?   194.213   180          154.361    180          15.2903    7.08361e-14  
1 1 1 60  0  0  o 0 222     8.6   ?     ?   400.71    -180         326.692    180          24.2842    7.93883e-13  
1 1 1 60  0  1  o 0 102.1   6.2   ?     ?   213.455   0            221.698    0            34.2976    0            
1 1 1 60  0  2  f 1 9.7     5.3   ?     ?   111.948   0            28.7451    0            70.24      180          
1 1 1 60  0  3  o 0 106.4   7.7   ?     ?   110.136   0            220.108    0            123.064    0            
1 1 1 60  0  4  o 0 6.9     6.2   ?     ?   127.308   180          21.8608    180          90.4561    1.69575e-15  
1 1 1 60  0  5  o 0 565.1   20.2  ?     ?   566.055   180          550.378    180          7.7661     180          
1 1 1 60  0  6  f 1 28.4    8.3   ?     ?   283.779   180          117.061    180          156.514    5.24797e-15  
1 1 1 60  0  7  o 0 87.3    10.7  ?     ?   210.129   0            214.781    0            13.2085    0            
1 1 1 60  0  8  o 0 1.4     11.4  ?     ?   107.782   0            21.253     0            82.8955    180          
1 1 1 60  0  9  o 0 20.9    13    ?     ?   40.7908   0            28.8388    0            10.554     180          
1 1 1 60  0  10 o 0 180.7   17.5  ?     ?   164.642   180          309.265    180          155.767    180          
1 1 1 60  0  11 o 0 55.7    17.3  ?     ?   186.413   0            159.887    0            10.0558    180          
1 1 1 60  0  12 o 0 258.2   21.6  ?     ?   347.37    0            367.545    0            55.5359    0            
1 1 1 60  0  13 o 0 17.7    22    ?     ?   143.33    0            69.24      0            59.2263    180          
1 1 1 60  0  14 o 0 111.9   28.3  ?     ?   207.905   180          226.928    180          40.632     180          
1 1 1 -60 2  15 < 0 22.2    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 2  14 o 0 21.5    2.5   ?     ?   88.0358   -4.25086     85.8282    -4.25086     12.9124    -4.25086     
1 1 1 -60 2  13 o 0 17.8    2.4   ?     ?   130.036   179.661      40.0571    179.661      68.2452    -0.338675    
1 1 1 -60 2  12 o 0 29.2    2.5   ?     ?   152.41    125.51       73.1359    125.51       56.4285    -54.4903     
1 1 1 -60 2  11 o 0 99.4    3.3   ?     ?   138.839   11.9663      282.164    11.9663      163.312    11.9663      
1 1 1 -60 2  10 o 0 9.2     2     ?     ?   149.2     -25.0125     36.2584    154.987      167.557    154.987      
1 1 1 -60 2  9  o 0 10.5    2.1   ?     ?   40.9406   33.0419      4.33244    33.0419      33.1811    -146.958     
1 1 1 -60 2  8  o 0 239.2   6     ?     ?   279.257   -24.1575     409.761    -24.1575     152.406    -24.1575     
1 1 1 -60 2  7  o 0 100.8   3.6   ?     ?   212.189   -74.5549     225.402    -74.5549     30.2678    -74.5549     
1 1 1 -60 2  6  o 0 167.3   4.7   ?     ?   218.287   24.6689      351.26     24.6689      149.517    24.6689      
1 1 1 -60 2  5  o 0 43.8    2.5   ?     ?   156.619   -32.7641     114.307    -32.7641     31.1088    147.236      
1 1 1 -60 2  4  o 0 246.1   6.1   ?     ?   403.095   -62.1235     329.261    -62.1235     33.727     117.876      
1 1 1 -60 2  3  f 1 269.9   6.4   ?     ?   438.23    -41.6501     316.316    -41.6501     63.491     138.35       
1 1 1 -60 2  2  o 0 220.1   5.8   ?     ?   345.641   -77.3877     326.687    -77.3877     27.6142    -77.3877     
1 1 1 -60 2  1  o 0 213.2   5.6   ?     ?   352.097   -62.6949     312.266    -62.6949     6.65104    -62.6949     
1 1 1 60  2  0  o 0 23.5    3.3   ?     ?   86.4728   -51.0179     52.8227    -51.0179     22.8519    128.982      
1 1 1 60  2  1  o 0 65.2    4     ?     ?   249.061   -28.0368     111.209    -28.0368     107.24     151.963      
1 1 1 60  2  2  o 0 18.1    3.6   ?     ?   64.309    111.153      27.0154    111.153      29.4966    -68.847      
1 1 1 60  2  3  f 1 -0.8    3.9   ?     ?   54.4829   -116.44      37.9325    63.5598      86.1303    63.5598      
1 1 1 60  2  4  o 0 14.2    4.7   ?     ?   141.873   163.175      12.5927    -16.8247     148.298    -16.8247     
1 1 1 60  2  5  o 0 71.7    5.6   ?     ?   133.932   109.546      218.428    109.546      90.2134    109.546      
1 1 1 60  2  6  o 0 23.5    5.7   ?     ?   84.383    -78.7857     61.2768    -78.7857     19.5409    101.214      
1 1 1 60  2  7  o 0 94.2    6.9   ?     ?   161.287   -60.7577     260.971    -60.7577     105.326    -60.7577     
1 1 1 60  2  8  o 0 187.7   10.6  ?     ?   221.972   -25.665      395.842    -25.665      181.698    -25.665      
1 1 1 60  2  9  o 0 74.4    10    ?     ?   136.079   75.8708      230.111    75.8708      103.338    75.8708      
1 1 1 60  2  10 o 0 149.1   12.1  ?     ?   270.838   154.664      289.432    154.664      37.3848    154.664      
1 1 1 60  2  11 o 0 13.9    11.6  ?     ?   153.91    -162.04      4.54481    17.9601      144.586    17.9601      
1 1 1 60  2  12 o 0 15.9    13.1  ?     ?   127.544   92.9987      27.9264    92.9987      86.4003    -87.0013     
1 1 1 60  2  13 o 0 122.8   17.5  ?     ?   196.096   58.1976      305.356    58.1976      129.581    58.1976      
1 1 1 60  2  14 < 0 34.5    16.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  2  15 < 0 11.6    19.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 4  14 < 0 57.7    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 4  13 o 0 40.8    2.5   ?     ?   164.135   -155.566     115.909    -155.566     18.9549    24.434       
1 1 1 -60 4  12 o 0 74.2    3.8   ?     ?   109.585   -3.43291     239.826    -3.43291     149.3      -3.43291     
1 1 1 -60 4  11 o 0 12.2    2.1   ?     ?   67.4189   -14.7678     27.6114    -14.7678     28.4836    165.232      
1 1 1 -60 4  10 o 0 52.9    2.9   ?     ?   207.375   109.287      115.969    109.287      60.04      -70.7128     
1 1 1 -60 4  9  o 0 80.9    3.2   ?     ?   133.199   54.7719      237.238    54.7719      121.043    54.7719      
1 1 1 -60 4  8  o 0 110.6   3.8   ?     ?   174.703   10.9714      277.806    10.9714      124.498    10.9714      
1 1 1 -60 4  7  o 0 189.8   5.1   ?     ?   291.018   51.5504      321.897    51.5504      56.1524    51.5504      
1 1 1 -60 4  6  o 0 9.5     2.2   ?     ?   79.7322   147.551      6.25631    -32.4487     79.4393    -32.4487     
1 1 1 -60 4  5  o 0 144.4   4.5   ?     ?   326.139   -158.785     216.572    -158.785     84.2033    21.2152      
1 1 1 -60 4  4  o 0 96.5    4     ?     ?   294.971   -144.19      147.033    -144.19      124.153    35.8098      
1 1 1 -60 4  3  o 0 13.3    2.4   ?     ?   33.2293   163.636      8.73555    163.636      21.9361    -16.3641     
1 1 1 -60 4  2  o 0 174     4.9   ?     ?   273.213   9.04194      317.886    9.04194      64.7916    9.04194      
1 1 1 -60 4  1  o 0 21      3.5   ?     ?   169.296   38.6997      11.9281    38.6997      145.409    -141.3       
1 1 1 60  4  0  o 0 107.3   4.3   ?     ?   207.961   -53.8604     248.861    -53.8604     52.8657    -53.8604     
1 1 1 60  4  1  o 0 32.3    4.1   ?     ?   185.182   -142.065     51.925     -142.065     122.974    37.9351      
1 1 1 60  4  2  o 0 41.4    4     ?     ?   100.093   75.702       134.995    75.702       40.2929    75.702       
1 1 1 60  4  3  o 0 29.6    4.5   ?     ?   92.9976   93.8274      88.6708    93.8274      0.556744   93.8274      
1 1 1 60  4  4  o 0 76.5    5     ?     ?   259.857   64.5146      133.114    64.5146      115.207    -115.485     
1 1 1 60  4  5  o 0 63.8    6.5   ?     ?   190.882   59.3957      156.141    59.3957      26.3936    -120.604     
1 1 1 60  4  6  o 0 93.5    7     ?     ?   193.019   -171.238     232.008    -171.238     47.3722    -171.238     
1 1 1 60  4  7  o 0 9.9     7.2   ?     ?   90.058    23.8923      6.11433    -156.108     89.3556    -156.108     
1 1 1 60  4  8  o 0 75.7    10    ?     ?   136.343   78.7313      233.234    78.7313      107.267    78.7313      
1 1 1 60  4  9  o 0 13.1    8.3   ?     ?   73.2554   -156.098     20.5976    -156.098     45.6167    23.9017      
1 1 1 60  4  10 o 0 123.9   11    ?     ?   187.751   154.018      312.215    154.018      142.717    154.018      
1 1 1 60  4  11 o 0 -3.8    10.4  ?     ?   96.1313   52.2638      27.5344    -127.736     113.05     -127.736     
1 1 1 60  4  12 o 0 25.8    14.6  ?     ?   168.478   67.0707      43.102     67.0707      106.807    -112.929     
1 1 1 60  4  13 < 0 60      17.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  4  14 < 0 -1      18.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 6  13 < 0 195.3   5     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 6  12 < 0 7.6     1.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 6  11 o 0 12.7    1.7   ?     ?   151.683   15.1071      4.45631    15.1071      119.144    -164.893     
1 1 1 -60 6  10 o 0 84      3     ?     ?   239.268   -54.8195     177.202    -54.8195     19.1346    125.181      
1 1 1 -60 6  9  o 0 235.2   5.4   ?     ?   335.939   -91.4501     361.953    -91.4501     85.0984    -91.4501     
1 1 1 -60 6  8  o 0 9.4     1.6   ?     ?   84.7809   -91.3412     0.344804   -91.3412     70.8839    88.6588      
1 1 1 -60 6  7  o 0 87.3    3.4   ?     ?   194.995   8.16409      213.56     8.16409      48.7946    8.16409      
1 1 1 -60 6  6  o 0 66.5    2.7   ?     ?   178.23    -27.8706     170.107    -27.8706     15.48      -27.8706     
1 1 1 -60 6  5  o 0 8       2.1   ?     ?   47.876    19.4699      4.65861    -160.53      46.3988    -160.53      
1 1 1 -60 6  4  o 0 115.3   3.9   ?     ?   186.721   -96.311      278.337    -96.311      114.811    -96.311      
1 1 1 -60 6  3  o 0 47.1    2.8   ?     ?   167.62    -89.498      123.015    -89.498      24.3882    90.502       
1 1 1 -60 6  2  o 0 7.8     2.5   ?     ?   81.6692   -133.394     14.7718    46.6058      86.8587    46.6058      
1 1 1 -60 6  1  o 0 197.3   5.6   ?     ?   346.304   -179.432     286.758    -179.432     30.621     0.568002     
1 1 1 60  6  0  f 1 145     4.9   ?     ?   241.589   -85.8974     293.211    -85.8974     66.0933    -85.8974     
1 1 1 60  6  1  o 0 63.9    4     ?     ?   170.743   -7.84769     175.44     -7.84769     20.8165    -7.84769     
1 1 1 60  6  2  o 0 12.1    3.8   ?     ?   131.261   120.655      7.507      -59.3448     126.569    -59.3448     
1 1 1 60  6  3  o 0 3.9     4.5   ?     ?   26.5852   66.8462      11.107     -113.154     35.2518    -113.154     
1 1 1 60  6  4  o 0 49.7    6     ?     ?   111.076   154.811      168.962    154.811      67.9928    154.811      
1 1 1 60  6  5  o 0 23.6    5.9   ?     ?   56.746    150.535      64.7619    150.535      13.1524    150.535      
1 1 1 60  6  6  o 0 240.1   9.3   ?     ?   358.47    96.0316      367.35     96.0316      48.0817    96.0316      
1 1 1 60  6  7  o 0 111.9   8.4   ?     ?   220.438   167.607      259.115    167.607      62.8316    167.607      
1 1 1 60  6  8  o 0 28.4    8.9   ?     ?   78.7295   -171.297     107.428    -171.297     38.2825    -171.297     
1 1 1 60  6  9  o 0 73.7    9.9   ?     ?   191.712   96.7712      194.431    96.7712      26.2296    96.7712      
1 1 1 60  6  10 o 0 187.2   13.5  ?     ?   209.112   97.0552      412.506    97.0552      228.888    97.0552      
1 1 1 60  6  11 < 0 7.7     12.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  6  12 < 0 19.5    13.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 8  9  < 0 80.2    6.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 8  8  < 0 90.3    6     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 8  7  o 0 78.6    6.2   ?     ?   164.188   74.6195      216.415    74.6195      83.275     74.6195      
1 1 1 -60 8  6  o 0 144.1   9.1   ?     ?   254.137   92.8395      281.071    92.8395      73.8569    92.8395      
1 1 1 -60 8  5  o 0 48.8    5.9   ?     ?   97.3873   -161.914     172.029    -161.914     92.3972    -161.914     
1 1 1 -60 8  4  o 0 19.3    6.5   ?     ?   128.06    -163.206     42.0711    -163.206     63.1304    16.7937      
1 1 1 -60 8  3  f 1 37      6     ?     ?   73.9028   140.148      137.468    140.148      76.1846    140.148      
1 1 1 -60 8  2  o 0 13.2    3     ?     ?   104.717   -83.3466     25.3682    -83.3466     61.3565    96.6534      
1 1 1 -60 8  1  o 0 54.8    3.3   ?     ?   150.378   -31.8651     165.508    -31.8651     40.5374    -31.8651     
1 1 1 60  8  0  o 0 38.3    3.2   ?     ?   167.29    106.454      104.765    106.454      38.0998    -73.5455     
1 1 1 60  8  1  o 0 153.4   5.6   ?     ?   315.942   119.141      261.946    119.141      8.35727    -60.8594     
1 1 1 60  8  2  o 0 106.7   5.4   ?     ?   236.256   84.4338      235.62     84.4338      33.2004    84.4338      
1 1 1 60  8  3  f 1 37.4    4.8   ?     ?   103.813   157.616      138.909    157.616      49.4115    157.616      
1 1 1 60  8  4  o 0 7.2     5.8   ?     ?   116.76    -33.1961     21.1462    146.804      121.36     146.804      
1 1 1 60  8  5  o 0 59.5    6.4   ?     ?   185.624   43.2824      162.041    43.2824      2.31378    43.2824      
1 1 1 60  8  6  o 0 45.8    7.5   ?     ?   140.475   152.028      152.076    152.028      31.2084    152.028      
1 1 1 60  8  7  < 0 1.9     8.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  8  8  < 0 49.5    9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  8  9  < 0 16.5    11    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -60 10 1  < 0 20.8    8.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  10 0  < 0 22.5    3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 60  10 1  < 0 24.5    5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 1  15 < 0 26.3    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 1  14 o 0 25.6    2.4   ?     ?   152.932   -105.196     67.7223    -105.196     58.6463    74.8039      
1 1 1 -61 1  13 o 0 46.4    2.7   ?     ?   116.932   -113.88      167.044    -113.88      69.673     -113.88      
1 1 1 -61 1  12 o 0 110.8   3.6   ?     ?   285.343   -158.328     200.953    -158.328     37.8654    21.6718      
1 1 1 -61 1  11 o 0 182.1   4.8   ?     ?   236.541   -73.8024     364.423    -73.8024     162.446    -73.8024     
1 1 1 -61 1  10 o 0 23.9    2.3   ?     ?   119.983   52.7936      63.1683    52.7936      42.1472    -127.206     
1 1 1 -61 1  9  o 0 179.2   4.7   ?     ?   232.162   -141.016     361.852    -141.016     156.825    -141.016     
1 1 1 -61 1  8  o 0 88.2    3.2   ?     ?   226.083   -172.429     185.155    -172.429     22.6435    7.57106      
1 1 1 -61 1  7  o 0 4.2     2.1   ?     ?   141.828   -107.888     82.3798    72.1122      213.434    72.1122      
1 1 1 -61 1  6  o 0 65.9    3     ?     ?   261.105   176.402      100.007    176.402      140.652    -3.59836     
1 1 1 -61 1  5  o 0 191.2   4.8   ?     ?   301.59    173.93       321.986    173.93       42.7399    173.93       
1 1 1 -61 1  4  o 0 300     6.6   ?     ?   392.185   -117.475     400.527    -117.475     35.8672    -117.475     
1 1 1 -61 1  3  o 0 30.2    2.7   ?     ?   167.725   -150.59      55.6901    -150.59      100.863    29.4096      
1 1 1 -61 1  2  o 0 8.5     2.7   ?     ?   87.3996   -32.0997     23.4857    147.9        102.548    147.9        
1 1 1 -61 1  1  o 0 126.1   4.6   ?     ?   228.894   -95.5511     274.876    -95.5511     67.171     -95.5511     
1 1 1 61  1  0  o 0 11.8    3     ?     ?   157.645   -109.905     35.0719    70.095       178.921    70.095       
1 1 1 61  1  1  o 0 130.8   5     ?     ?   280.945   -3.46135     244.227    -3.46135     12.7274    176.539      
1 1 1 61  1  2  o 0 19.9    3.8   ?     ?   89.7356   122.106      43.6464    122.106      41.5013    -57.8942     
1 1 1 61  1  3  o 0 11.2    4.1   ?     ?   46.0018   128.42       0.76564    128.42       42.9549    -51.58       
1 1 1 61  1  4  o 0 1.7     4.6   ?     ?   82.3566   150.338      51.1541    -29.6623     129.525    -29.6623     
1 1 1 61  1  5  o 0 4.1     5.2   ?     ?   77.774    -87.2061     38.2406    92.7939      112.317    92.7939      
1 1 1 61  1  6  o 0 123.9   7.3   ?     ?   191.133   0.509257     302.112    0.509257     118.603    0.509257     
1 1 1 61  1  7  o 0 143.8   8.6   ?     ?   306.541   43.9129      240.905    43.9129      53.4557    -136.087     
1 1 1 61  1  8  o 0 35.9    8.6   ?     ?   145.349   51.6632      100.329    51.6632      34.5154    -128.337     
1 1 1 61  1  9  o 0 73.5    10.1  ?     ?   184.873   40.5406      193.322    40.5406      21.913     40.5406      
1 1 1 61  1  10 o 0 1.5     10.9  ?     ?   36.2964   48.8851      2.84604    -131.115     35.765     -131.115     
1 1 1 61  1  11 o 0 71.1    11.8  ?     ?   165.826   -31.3395     208.563    -31.3395     60.3312    -31.3395     
1 1 1 61  1  12 o 0 161.5   15.1  ?     ?   262.492   47.0005      327.383    47.0005      93.1535    47.0005      
1 1 1 61  1  13 o 0 77.6    15.3  ?     ?   114.777   51.0752      260.924    51.0752      158.494    51.0752      
1 1 1 61  1  14 < 0 22.1    18.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 3  14 < 0 1.8     2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 3  13 f 1 25      2.3   ?     ?   167.426   -125.146     54.24      -125.146     84.2129    54.8539      
1 1 1 -61 3  12 o 0 23.2    2.4   ?     ?   80.0243   -50.627      83.87      -50.627      17.6834    -50.627      
1 1 1 -61 3  11 o 0 300.7   7.3   ?     ?   302.467   45.8096      478.027    45.8096      226.076    45.8096      
1 1 1 -61 3  10 o 0 151.7   5     ?     ?   229.974   54.7104      316.708    54.7104      121.308    54.7104      
1 1 1 -61 3  9  o 0 251.2   6.4   ?     ?   437.139   -5.54104     295.01     -5.54104     86.714     174.459      
1 1 1 -61 3  8  o 0 749.1   14.7  ?     ?   516.418   -2.18404     730.689    -2.18404     277.073    -2.18404     
1 1 1 -61 3  7  o 0 155.5   4.7   ?     ?   230.038   42.6575      316.057    42.6575      105.801    42.6575      
1 1 1 -61 3  6  o 0 95.9    4.2   ?     ?   274.785   108.675      161.81     108.675      90.6284    -71.325      
1 1 1 -61 3  5  o 0 47.4    3     ?     ?   193.025   -167.416     100.967    -167.416     77.1986    12.5839      
1 1 1 -61 3  4  o 0 13.4    2.4   ?     ?   43.9939   -71.4841     10.7719    -71.4841     29.7079    108.516      
1 1 1 -61 3  3  o 0 108.5   3.6   ?     ?   333.15    35.2402      141.298    35.2402      166.458    -144.76      
1 1 1 -61 3  2  f 1 33      3.3   ?     ?   247.571   72.9141      3.70476    72.9141      226.997    -107.086     
1 1 1 -61 3  1  o 0 14.3    2.9   ?     ?   106.845   -124.022     8.26554    -124.022     91.109     55.9779      
1 1 1 61  3  0  o 0 105.6   4.3   ?     ?   274.025   -32.9476     189.235    -32.9476     68.5474    147.052      
1 1 1 61  3  1  o 0 82.4    4.3   ?     ?   281.101   -93.4354     128.665    -93.4354     136.36     86.5646      
1 1 1 61  3  2  f 1 8.1     3.9   ?     ?   59.0566   84.5146      15.5425    -95.4854     71.6123    -95.4854     
1 1 1 61  3  3  o 0 0       3.9   ?     ?   19.7799   -31.1448     13.8916    148.855      32.6032    148.855      
1 1 1 61  3  4  o 0 46.5    4.9   ?     ?   132.968   32.2604      144.66     32.2604      17.7833    32.2604      
1 1 1 61  3  5  o 0 33.3    6     ?     ?   89.0394   15.8144      112.502    15.8144      27.4757    15.8144      
1 1 1 61  3  6  o 0 84.6    7.4   ?     ?   243.619   -71.4685     167.017    -71.4685     65.7195    108.532      
1 1 1 61  3  7  o 0 2.7     7.2   ?     ?   155.777   -27.3064     73.951     152.694      217.763    152.694      
1 1 1 61  3  8  o 0 3.1     8.5   ?     ?   133.49    14.7442      50.1987    -165.256     173.394    -165.256     
1 1 1 61  3  9  o 0 30.7    9.3   ?     ?   165.783   174.297      69.9057    174.297      79.7937    -5.70276     
1 1 1 61  3  10 o 0 74.5    11.1  ?     ?   262.666   170.174      135.499    170.174      101.42     -9.8256      
1 1 1 61  3  11 o 0 7.4     12.6  ?     ?   79.7665   -139.532     16.3345    -139.532     54.5685    40.4677      
1 1 1 61  3  12 o 0 24.4    15    ?     ?   26.8206   30.6959      60.1051    30.6959      36.2563    30.6959      
1 1 1 61  3  13 < 1 -2.5    15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  3  14 < 0 59.8    18.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 5  13 < 0 131.3   4.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 5  12 < 0 83.9    3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 5  11 o 0 46      2.5   ?     ?   141.844   -77.7069     147.436    -77.7069     31.2797    -77.7069     
1 1 1 -61 5  10 o 0 92.3    3.5   ?     ?   209.338   -173.276     216.326    -173.276     44.0958    -173.276     
1 1 1 -61 5  9  o 0 29.7    2.4   ?     ?   116.513   173.307      100.705    173.307      4.22125    173.307      
1 1 1 -61 5  8  o 0 16.7    2.2   ?     ?   100.769   110.231      39.4278    110.231      45.6367    -69.7688     
1 1 1 -61 5  7  o 0 13.1    2     ?     ?   62.2003   68.7908      24.2204    68.7908      28.5851    -111.209     
1 1 1 -61 5  6  o 0 141.6   4.3   ?     ?   261.347   -130.092     269.669    -130.092     41.8742    -130.092     
1 1 1 -61 5  5  o 0 127.2   4.3   ?     ?   269.847   -128.779     237.11     -128.779     0.7575     -128.779     
1 1 1 -61 5  4  o 0 135.1   4.5   ?     ?   293.556   -91.2621     233.595    -91.2621     24.6778    88.7379      
1 1 1 -61 5  3  f 1 164.1   4.8   ?     ?   287.274   -54.4976     281.678    -54.4976     17.7041    -54.4976     
1 1 1 -61 5  2  o 0 132     4.3   ?     ?   333.964   -28.4381     185.352    -28.4381     121.089    151.562      
1 1 1 -61 5  1  o 0 47.4    4.4   ?     ?   206.323   -13.4068     89.7761    -13.4068     100.172    166.593      
1 1 1 61  5  0  o 0 165.5   5.3   ?     ?   269.153   -51.8077     308.214    -51.8077     56.0235    -51.8077     
1 1 1 61  5  1  o 0 117.6   5.6   ?     ?   119.677   -5.19169     333.533    -5.19169     221.164    -5.19169     
1 1 1 61  5  2  o 0 142.4   6.4   ?     ?   228.148   70.3672      301.995    70.3672      87.4089    70.3672      
1 1 1 61  5  3  f 1 12.9    4.8   ?     ?   71.4234   72.1504      14.14      72.1504      51.1987    -107.85      
1 1 1 61  5  4  o 0 2.7     5.6   ?     ?   35.3126   -48.6085     14.798     131.391      46.9692    131.391      
1 1 1 61  5  5  o 0 35.3    6.6   ?     ?   82.8766   -151.553     122.883    -151.553     47.3313    -151.553     
1 1 1 61  5  6  o 0 67.8    7     ?     ?   206.994   143.952      164.117    143.952      20.6937    -36.0481     
1 1 1 61  5  7  o 0 83.1    8.3   ?     ?   126.358   -176.49      260.785    -176.49      147.983    -176.49      
1 1 1 61  5  8  o 0 264     10.7  ?     ?   257.484   151.903      491.659    151.903      264.91     151.903      
1 1 1 61  5  9  o 0 114.7   10.1  ?     ?   175.024   164.261      304.419    164.261      150.424    164.261      
1 1 1 61  5  10 o 0 52.7    10.6  ?     ?   151.752   113.131      166.434    113.131      32.7882    113.131      
1 1 1 61  5  11 < 0 46.2    12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  5  12 < 0 56.3    12.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 7  10 < 0 37      5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 7  9  < 1 18.7    4.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 7  8  o 0 9.5     4.3   ?     ?   91.1181   28.5695      11.632     28.5695      62.4591    -151.43      
1 1 1 -61 7  7  o 0 41.5    5.1   ?     ?   101.018   19.3919      155.774    19.3919      73.1496    19.3919      
1 1 1 -61 7  6  o 0 11      4.3   ?     ?   58.4964   -139.143     16.7444    -139.143     31.2542    40.8574      
1 1 1 -61 7  5  o 0 1.4     4.7   ?     ?   64.3198   -97.7438     26.4955    82.2562      79.5389    82.2562      
1 1 1 -61 7  4  f 1 18.2    2     ?     ?   106.039   -77.1501     53.2343    -77.1501     35.0718    102.85       
1 1 1 -61 7  3  o 0 19.4    2.1   ?     ?   123.683   46.2056      44.6591    46.2056      59.6062    -133.794     
1 1 1 -61 7  2  o 0 10.1    2.4   ?     ?   89.9832   -125.399     3.14137    -125.399     73.0056    54.6006      
1 1 1 -61 7  1  o 0 12.2    2.8   ?     ?   81.3246   127.562      17.9375    127.562      51.1185    -52.4378     
1 1 1 61  7  0  f 1 29.8    3.4   ?     ?   149.434   32.874       78.4111    32.874       52.2786    -147.126     
1 1 1 61  7  1  o 0 8.3     3.6   ?     ?   158.056   82.4243      47.1571    -97.5757     184.946    -97.5757     
1 1 1 61  7  2  o 0 89.2    5     ?     ?   210.218   133.397      213.042    133.397      29.4943    133.397      
1 1 1 61  7  3  o 0 20.8    5.2   ?     ?   127.31    -118.501     56.866     -118.501     52.9741    61.4991      
1 1 1 61  7  4  f 1 -0.1    6.8   ?     ?   122.567   -20.2214     51.6917    159.779      158.071    159.779      
1 1 1 61  7  5  o 0 68.9    7.1   ?     ?   140.582   126.966      216.891    126.966      95.448     126.966      
1 1 1 61  7  6  o 0 78.4    7.9   ?     ?   142.664   165.782      245.383    165.782      121.856    165.782      
1 1 1 61  7  7  o 0 -10.9   8.5   ?     ?   86.665    -98.9428     37.2148    81.0572      112.23     81.0572      
1 1 1 61  7  8  < 0 90.9    9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  7  9  < 1 1.3     11    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  7  10 < 0 16.8    11.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 9  5  < 0 21.7    5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 9  4  < 0 15.2    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 9  3  < 0 121.2   9.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 9  2  < 0 43.7    8.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -61 9  1  < 1 2.8     2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  9  0  < 0 114.4   4.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  9  1  < 1 81.6    5.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  9  2  < 0 -4      4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  9  3  < 0 49.4    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  9  4  < 0 78.3    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 61  9  5  < 0 3.8     7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 0  14 < 0 49.1    4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 0  13 o 0 14.4    3.1   ?     ?   51.9044   180          47.7678    180          4.7305     180          
1 1 1 -62 0  12 o 0 60.3    4     ?     ?   261.373   180          166.054    180          51.7585    2.25113e-14  
1 1 1 -62 0  11 o 0 385.1   13.4  ?     ?   367.027   0            422.676    0            114.713    0            
1 1 1 -62 0  10 f 1 8.6     3.2   ?     ?   163.304   0            47.3258    0            93.1258    180          
1 1 1 -62 0  9  o 0 5.3     5     ?     ?   23.6092   180          4.27558    180          16.4817    1.82023e-15  
1 1 1 -62 0  8  o 0 -2.2    3     ?     ?   12.1332   0            0.407738   0            10.3205    180          
1 1 1 -62 0  7  o 0 89.5    4.5   ?     ?   146.052   0            208.083    0            73.7339    0            
1 1 1 -62 0  6  o 0 196.8   7.5   ?     ?   328.337   180          311.184    180          7.66802    180          
1 1 1 -62 0  5  o 0 592.9   18.9  ?     ?   600.146   180          542.174    180          15.1307    2.51428e-13  
1 1 1 -62 0  4  o 0 25.5    3.2   ?     ?   2.56042   180          2.97995    180          0.610123   180          
1 1 1 -62 0  3  o 0 -3      3.1   ?     ?   17.6762   180          0.491877   180          15.9311    2.16643e-16  
1 1 1 -62 0  2  o 0 4.5     3.8   ?     ?   22.2175   0            3.09727    0            17.6167    180          
1 1 1 -62 0  1  o 0 13.3    4.3   ?     ?   27.7637   180          15.1247    180          10.8407    9.78951e-15  
1 1 1 62  0  0  o 0 120.2   6     ?     ?   154.7     180          248.018    180          102.94     -180         
1 1 1 62  0  1  o 0 62.2    5.7   ?     ?   307.879   0            178.623    0            110.802    180          
1 1 1 62  0  2  o 0 64.6    6.6   ?     ?   150.649   180          179.705    180          37.7959    180          
1 1 1 62  0  3  o 0 -3.9    5.8   ?     ?   18.0529   180          1.0936     180          15.9407    4.81376e-16  
1 1 1 62  0  4  o 0 37.6    7     ?     ?   26.312    180          48.5905    180          23.5437    180          
1 1 1 62  0  5  o 0 -5.8    7.3   ?     ?   6.99108   180          0.563768   180          6.09756    6.48751e-16  
1 1 1 62  0  6  o 0 304.2   19.6  ?     ?   428.391   0            397.358    0            11.0694    180          
1 1 1 62  0  7  o 0 235.6   13    ?     ?   366.437   0            350.214    0            12.5416    0            
1 1 1 62  0  8  o 0 149.3   13.2  ?     ?   204.058   0            278.138    0            90.1264    0            
1 1 1 62  0  9  o 0 119.8   14.7  ?     ?   178.138   0            247.482    0            86.8597    0            
1 1 1 62  0  10 f 1 14.6    14.3  ?     ?   92.1961   0            42.5       0            40.9827    180          
1 1 1 62  0  11 o 0 27.2    18.1  ?     ?   97.2623   0            76.0093    0            10.3564    180          
1 1 1 62  0  12 o 0 -0.7    18    ?     ?   143.592   0            43.6275    0            83.9501    180          
1 1 1 62  0  13 < 0 43.6    22.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 62  0  14 < 0 39.2    23    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 2  14 < 0 37      2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 2  13 o 0 26.2    2.4   ?     ?   121.533   -112.24      90.0364    -112.24      9.88734    67.7603      
1 1 1 -62 2  12 o 0 33      2.5   ?     ?   128.513   21.0276      113.381    21.0276      6.92542    21.0276      
1 1 1 -62 2  11 o 0 150.4   4.3   ?     ?   238.063   16.4715      310.92     16.4715      112.767    16.4715      
1 1 1 -62 2  10 o 0 6.6     2.1   ?     ?   31.5051   18.6743      4.6377     -161.326     31.3847    -161.326     
1 1 1 -62 2  9  o 0 214.9   5.5   ?     ?   249.267   -100.734     405.098    -100.734     192.152    -100.734     
1 1 1 -62 2  8  o 0 253.1   6.1   ?     ?   306.868   -80.4369     409.311    -80.4369     140.006    -80.4369     
1 1 1 -62 2  7  o 0 14.7    2.2   ?     ?   171.773   -114.007     14.4861    65.9926      166.058    65.9926      
1 1 1 -62 2  6  o 0 239.5   6     ?     ?   397.865   145.839      304.783    145.839      60.3679    -34.1613     
1 1 1 -62 2  5  o 0 37.7    2.6   ?     ?   160.237   -135.933     92.0938    -135.933     55.6579    44.0674      
1 1 1 -62 2  4  o 0 144.8   4.2   ?     ?   266.866   -127.016     269.787    -127.016     22.6513    -127.016     
1 1 1 -62 2  3  o 0 99.7    3.6   ?     ?   236.357   103.026      204.184    103.026      13.9254    -76.9737     
1 1 1 -62 2  2  o 0 62      3.3   ?     ?   117.19    55.1545      193.359    55.1545      84.8293    55.1545      
1 1 1 -62 2  1  o 0 213.7   5.9   ?     ?   232.078   1.22369      417.506    1.22369      201.888    1.22369      
1 1 1 62  2  0  f 1 190.4   5.9   ?     ?   289.156   -14.6082     333.927    -14.6082     61.5486    -14.6082     
1 1 1 62  2  1  o 0 3.2     3.3   ?     ?   95.8215   -50.7005     59.3061    129.299      149.313    129.299      
1 1 1 62  2  2  o 0 25.9    3.8   ?     ?   136.415   108.133      56.3625    108.133      72.0238    -71.8673     
1 1 1 62  2  3  o 0 47.4    4.4   ?     ?   184.964   -76.9734     109.9      -76.9734     65.7635    103.027      
1 1 1 62  2  4  o 0 138.5   6.5   ?     ?   299.42    -22.2098     235.455    -22.2098     49.2595    157.79       
1 1 1 62  2  5  o 0 170.3   7.3   ?     ?   257.869   -13.1332     330.925    -13.1332     85.5086    -13.1332     
1 1 1 62  2  6  o 0 43.9    6.1   ?     ?   167.304   -31.2505     116.461    -31.2505     37.4788    148.75       
1 1 1 62  2  7  o 0 58.8    8.7   ?     ?   38.6703   -86.0199     162.351    -86.0199     126.765    -86.0199     
1 1 1 62  2  8  o 0 21.9    8.5   ?     ?   79.8798   121.936      63.3781    121.936      8.57966    -58.0642     
1 1 1 62  2  9  o 0 21.5    9.4   ?     ?   182.52    129.887      10.0802    129.887      154.234    -50.1127     
1 1 1 62  2  10 o 0 55.8    11.2  ?     ?   138.838   178.492      181.5      178.492      58.2657    178.492      
1 1 1 62  2  11 o 0 12.5    12.6  ?     ?   95.7148   -179.231     29.2928    -179.231     55.546     0.769414     
1 1 1 62  2  12 o 0 56.9    12.7  ?     ?   221.312   24.1731      123.354    24.1731      72.8993    -155.827     
1 1 1 62  2  13 < 0 23.4    15.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 4  13 < 0 75.5    3.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 4  12 < 0 10.5    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 4  11 f 1 204.4   5.3   ?     ?   244.884   119.723      388.105    119.723      185.938    119.723      
1 1 1 -62 4  10 o 0 48.3    2.5   ?     ?   111.217   148.318      167.703    148.318      75.9336    148.318      
1 1 1 -62 4  9  f 1 23.4    2.4   ?     ?   118.034   -22.7898     73.1067    -22.7898     25.4206    157.21       
1 1 1 -62 4  8  o 0 48.8    2.8   ?     ?   119.27    -22.6722     160.62     -22.6722     59.6553    -22.6722     
1 1 1 -62 4  7  o 0 113.4   3.9   ?     ?   254.744   129.034      226.096    129.034      9.23173    129.034      
1 1 1 -62 4  6  o 0 -4.6    2.2   ?     ?   17.9182   -86.0487     14.4888    93.9513      30.1491    93.9513      
1 1 1 -62 4  5  f 1 68      3.2   ?     ?   214.23    -80.2675     148.496    -80.2675     40.6142    99.7325      
1 1 1 -62 4  4  o 0 281.5   7.2   ?     ?   324.063   -12.0811     434.61     -12.0811     148.741    -12.0811     
1 1 1 -62 4  3  o 0 258.3   6.1   ?     ?   365.658   23.2319      359.049    23.2319      23.8897    23.2319      
1 1 1 -62 4  2  f 1 64      3.2   ?     ?   202.301   -32.4596     142.004    -32.4596     45.065     147.54       
1 1 1 -62 4  1  o 0 11.5    3.1   ?     ?   126.452   -53.2343     12.6831    126.766      129.402    126.766      
1 1 1 62  4  0  f 1 126.2   5.6   ?     ?   338.383   -75.0601     171.928    -75.0601     146.709    104.94       
1 1 1 62  4  1  o 0 18.7    3.8   ?     ?   155.575   -43.115      12.7815    -43.115      133.284    136.885      
1 1 1 62  4  2  f 1 77.6    4.7   ?     ?   150.59    71.2707      221.392    71.2707      79.0213    71.2707      
1 1 1 62  4  3  o 0 14.5    4.5   ?     ?   56.2071   -9.38797     24.8493    -9.38797     26.3131    170.612      
1 1 1 62  4  4  o 0 23.5    5.5   ?     ?   136.228   -9.41026     53.5994    -9.41026     70.5384    170.59       
1 1 1 62  4  5  f 1 26      5.9   ?     ?   39.8658   -62.4195     62.3807    -62.4195     25.8395    -62.4195     
1 1 1 62  4  6  o 0 45.9    6.5   ?     ?   180.949   -123.69      117.426    -123.69      44.2015    56.3102      
1 1 1 62  4  7  o 0 7.1     7.8   ?     ?   45.6516   130.219      0.794205   -49.7814     41.5708    -49.7814     
1 1 1 62  4  8  o 0 16.2    8.9   ?     ?   114.626   -151.893     32.3484    -151.893     68.6619    28.1074      
1 1 1 62  4  9  f 1 -2.3    9.7   ?     ?   78.4166   89.7611      20.0228    -90.2389     89.4258    -90.2389     
1 1 1 62  4  10 o 0 91.5    11.8  ?     ?   309.29    53.1954      143.63     53.1954      129.001    -126.805     
1 1 1 62  4  11 < 1 86.8    12.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 62  4  12 < 0 33.9    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 6  11 < 0 15.4    1.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 6  10 < 0 13.9    1.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 6  9  o 0 12.8    1.7   ?     ?   59.094    -154.581     42.1327    -154.581     5.93897    25.4188      
1 1 1 -62 6  8  o 0 18.9    2.2   ?     ?   90.557    119.705      71.5137    119.705      2.6125     -60.295      
1 1 1 -62 6  7  o 0 -1      1.8   ?     ?   88.7511   160.181      63.12      -19.8185     136.028    -19.8185     
1 1 1 -62 6  6  o 0 30.3    2.2   ?     ?   120.752   175.133      100.753    175.133      1.02045    175.133      
1 1 1 -62 6  5  o 0 68.9    3.2   ?     ?   209.809   134.366      162.022    134.366      12.1341    -45.6343     
1 1 1 -62 6  4  o 0 44.8    2.8   ?     ?   211.563   -101.881     87.3406    -101.881     91.4106    78.1195      
1 1 1 -62 6  3  f 1 29.6    2.7   ?     ?   146.889   -70.3576     77.5159    -70.3576     47.7544    109.642      
1 1 1 -62 6  2  f 1 9.6     2.7   ?     ?   124.874   9.53766      14.6243    -170.462     121.525    -170.462     
1 1 1 -62 6  1  f 1 42.3    3.2   ?     ?   229.826   44.5817      65.2235    44.5817      132.197    -135.418     
1 1 1 62  6  0  o 0 100.1   4.3   ?     ?   186.982   37.3472      255.866    37.3472      92.5969    37.3472      
1 1 1 62  6  1  f 1 154.7   5.6   ?     ?   266.443   97.2598      301.042    97.2598      66.7167    97.2598      
1 1 1 62  6  2  f 1 95.5    6.5   ?     ?   183.04    128.404      247.811    128.404      86.5661    128.404      
1 1 1 62  6  3  f 1 68.8    6.1   ?     ?   104.667   38.5342      230.899    38.5342      138.574    38.5342      
1 1 1 62  6  4  o 0 172.4   7.2   ?     ?   292.871   -45.2395     311.926    -45.2395     54.6712    -45.2395     
1 1 1 62  6  5  o 0 10.5    5.5   ?     ?   46.2654   141.239      13.4605    141.239      26.6712    -38.7612     
1 1 1 62  6  6  o 0 23.7    7.3   ?     ?   108.718   -51.0163     78.6599    -51.0163     15.662     128.984      
1 1 1 62  6  7  o 0 104.7   9.1   ?     ?   265.909   -71.1727     210.644    -71.1727     20.5266    108.827      
1 1 1 62  6  8  o 0 144.4   10.6  ?     ?   255.105   -55.5114     298.332    -55.5114     76.6827    -55.5114     
1 1 1 62  6  9  < 0 -3.3    9.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 62  6  10 < 0 -1.2    10.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 8  7  < 0 76.2    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 8  6  < 0 44      6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 8  5  < 0 52.2    6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 8  4  < 0 23.7    6.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -62 8  3  o 0 72.7    8     ?     ?   192.587   18.7758      181.49     18.7758      24.6146    18.7758      
1 1 1 -62 8  2  f 1 2.8     3.2   ?     ?   79.7505   -171.12      29.7548    8.88004      95.3083    8.88004      
1 1 1 -62 8  1  o 0 25.1    2.5   ?     ?   136.513   70.6658      75.9746    70.6658      36.0567    -109.334     
1 1 1 62  8  0  o 0 24      3.2   ?     ?   119.945   -162.027     83.3875    -162.027     17.9145    17.9735      
1 1 1 62  8  1  o 0 32.6    3.6   ?     ?   64.1265   -53.9762     138.732    -53.9762     84.4711    -53.9762     
1 1 1 62  8  2  f 1 74.8    4.9   ?     ?   193.663   -58.034      194.531    -58.034      29.5742    -58.034      
1 1 1 62  8  3  < 0 416.4   11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 62  8  4  < 0 60      6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 62  8  5  < 0 70.3    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 62  8  6  < 0 59.8    7.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 1  14 < 0 12      2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 1  13 < 0 71.7    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 1  12 f 1 45.8    2.6   ?     ?   100.962   36.8113      172.256    36.8113      88.4097    36.8113      
1 1 1 -63 1  11 o 0 193.8   5     ?     ?   327.129   30.6426      311.248    30.6426      39.6737    30.6426      
1 1 1 -63 1  10 o 0 28.4    2.4   ?     ?   88.8781   144.046      106.439    144.046      32.1666    144.046      
1 1 1 -63 1  9  o 0 91.6    3.4   ?     ?   236.314   -111.988     194.01     -111.988     7.32332    68.0124      
1 1 1 -63 1  8  f 1 10.7    2.3   ?     ?   112.789   29.8901      1.19097    -150.11      98.34      -150.11      
1 1 1 -63 1  7  o 0 210.3   6     ?     ?   298.054   53.5681      356.073    53.5681      93.806     53.5681      
1 1 1 -63 1  6  o 0 23.6    2.5   ?     ?   133.66    -178.031     55.3235    -178.031     62.8816    1.96881      
1 1 1 -63 1  5  o 0 76.3    3.2   ?     ?   271.06    -91.8299     118.461    -91.8299     130.768    88.1701      
1 1 1 -63 1  4  o 0 160.8   4.8   ?     ?   241.392   -86.969      319.227    -86.969      96.3242    -86.969      
1 1 1 -63 1  3  o 0 20.9    2.6   ?     ?   110.972   112.541      49.2538    112.541      53.6209    -67.4588     
1 1 1 -63 1  2  o 0 -1.2    2.9   ?     ?   57.3582   65.3648      44.0506    -114.635     97.4131    -114.635     
1 1 1 -63 1  1  o 0 220.1   5.6   ?     ?   304.434   -115.624     364.721    -115.624     80.5884    -115.624     
1 1 1 63  1  0  o 0 9.7     3.4   ?     ?   64.4984   59.7592      3.64433    -120.241     64.1932    -120.241     
1 1 1 63  1  1  o 0 -4      3.6   ?     ?   24.901    -164.318     19.6204    15.6821      43.0523    15.6821      
1 1 1 63  1  2  o 0 62      4.2   ?     ?   266.767   155.732      85.8939    155.732      165.644    -24.2676     
1 1 1 63  1  3  o 0 34.6    4.6   ?     ?   122.113   -134.626     105.911    -134.626     9.42267    45.3742      
1 1 1 63  1  4  o 0 128.1   6.9   ?     ?   263.162   -61.8603     245.387    -61.8603     3.49039    118.14       
1 1 1 63  1  5  o 0 132.2   6.9   ?     ?   319.022   -61.0443     214.352    -61.0443     77.4696    118.956      
1 1 1 63  1  6  o 0 26.4    6.6   ?     ?   62.2661   -118.636     81.092     -118.636     24.1022    -118.636     
1 1 1 63  1  7  o 0 8.3     6.9   ?     ?   169.08    -169.856     58.136     10.1441      212.92     10.1441      
1 1 1 63  1  8  f 1 5.9     8.6   ?     ?   79.0085   -98.0053     9.22478    81.9947      80.3968    81.9947      
1 1 1 63  1  9  o 0 49.6    10    ?     ?   130.372   71.8615      167.848    71.8615      52.5947    71.8615      
1 1 1 63  1  10 o 0 35.7    11.5  ?     ?   120.51    136.326      117.015    136.326      10.5783    136.326      
1 1 1 63  1  11 o 0 26.2    12.3  ?     ?   131.075   179.066      73.8081    179.066      42.0668    -0.93443     
1 1 1 63  1  12 < 1 28.7    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 63  1  13 < 0 16.4    13.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 3  13 < 0 7.4     2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 3  12 < 0 9.3     2.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 3  11 o 0 125.8   3.9   ?     ?   194.789   100.263      297.69     100.263      137.534    100.263      
1 1 1 -63 3  10 o 0 189.4   5.1   ?     ?   253.59    -124.489     360.301    -124.489     150.848    -124.489     
1 1 1 -63 3  9  o 0 267.7   7.6   ?     ?   324.203   -120.091     417.7      -120.091     148.209    -120.091     
1 1 1 -63 3  8  o 0 17.2    2.4   ?     ?   67.2827   134.091      45.2908    134.091      11.7162    -45.9089     
1 1 1 -63 3  7  o 0 195.3   5.5   ?     ?   271.273   -130.566     357.089    -130.566     125.959    -130.566     
1 1 1 -63 3  6  o 0 30.7    2.8   ?     ?   217.601   -150.496     27.8235    -150.496     162.51     29.5039      
1 1 1 -63 3  5  o 0 222.4   6.1   ?     ?   279.045   -96.4729     389.245    -96.4729     143.992    -96.4729     
1 1 1 -63 3  4  f 1 106.8   4.9   ?     ?   123.398   -8.41643     303.934    -8.41643     194.439    -8.41643     
1 1 1 -63 3  3  o 0 61.3    3.4   ?     ?   178.506   -3.90373     159.049    -3.90373     0.827123   -3.90373     
1 1 1 -63 3  2  o 0 26.8    2.8   ?     ?   143.383   -74.1123     59.6207    -74.1123     72.3807    105.888      
1 1 1 -63 3  1  o 0 41.7    3.3   ?     ?   157.4     -24.76       108.297    -24.76       37.0871    155.24       
1 1 1 63  3  0  o 0 36.9    3.5   ?     ?   160.452   1.15535      89.9402    1.15535      60.0573    -178.845     
1 1 1 63  3  1  o 0 101.1   4.8   ?     ?   147.832   102.277      279.418    102.277      140.905    102.277      
1 1 1 63  3  2  o 0 117.3   5.2   ?     ?   244.223   60.5951      246.244    60.5951      24.6963    60.5951      
1 1 1 63  3  3  o 0 92.1    5.4   ?     ?   253.582   -45.7522     182.684    -45.7522     47.7121    134.248      
1 1 1 63  3  4  f 1 61.1    8.5   ?     ?   62.8392   -85.9457     203.65     -85.9457     146.194    -85.9457     
1 1 1 63  3  5  o 0 -8.6    5.7   ?     ?   20.8047   -138.091     14.5833    41.9089      33.5239    41.9089      
1 1 1 63  3  6  o 0 21.8    6.4   ?     ?   47.2094   -154.042     58.4307    -154.042     16.3281    -154.042     
1 1 1 63  3  7  o 0 34      7.5   ?     ?   116.769   156.789      114.071    156.789      9.92482    156.789      
1 1 1 63  3  8  o 0 13.6    9.2   ?     ?   105.568   99.4431      23.3388    99.4431      69.5624    -80.5569     
1 1 1 63  3  9  o 0 -4.9    9.6   ?     ?   7.6707    97.564       1.95472    -82.436      8.70046    -82.436      
1 1 1 63  3  10 o 0 13.8    9.9   ?     ?   86.5287   -38.1163     41.7428    -38.1163     34.442     141.884      
1 1 1 63  3  11 < 0 162     13.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 63  3  12 < 0 65.1    14.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 5  11 < 0 18.8    2.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 5  10 < 0 24.2    2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 5  9  o 0 9.2     2     ?     ?   82.5106   -48.7181     16.8426    -48.7181     50.5954    131.282      
1 1 1 -63 5  8  o 0 0.3     2     ?     ?   113.523   -37.1597     70.9769    142.84       164.337    142.84       
1 1 1 -63 5  7  o 0 75.4    3.4   ?     ?   229.644   60.6774      162.521    60.6774      27.0001    -119.323     
1 1 1 -63 5  6  o 0 166.7   4.8   ?     ?   274.846   51.0815      309.105    51.0815      81.0607    51.0815      
1 1 1 -63 5  5  o 0 130.6   4.5   ?     ?   175.793   46.802       316.633    46.802       168.114    46.802       
1 1 1 -63 5  4  o 0 23.3    2.5   ?     ?   150.523   95.1515      48.8472    95.1516      78.9041    -84.8484     
1 1 1 -63 5  3  f 1 120.8   3.8   ?     ?   256.713   80.4311      238.663    80.4311      18.7509    80.4311      
1 1 1 -63 5  2  o 0 293.2   7     ?     ?   383.297   75.5401      403.995    75.5401      76.0862    75.5401      
1 1 1 -63 5  1  o 0 168     5.2   ?     ?   395.826   117.787      213.706    117.787      126.074    -62.2133     
1 1 1 63  5  0  o 0 114.2   4.7   ?     ?   282.744   164.904      210.989    164.904      36.28      -15.0959     
1 1 1 63  5  1  o 0 1       3.8   ?     ?   31.8561   20.4749      17.7263    -159.525     45.6451    -159.525     
1 1 1 63  5  2  o 0 50.6    4.7   ?     ?   99.0776   29.0898      180.173    29.0898      93.1864    29.0898      
1 1 1 63  5  3  f 1 28.5    4.8   ?     ?   29.6511   81.066       62.1524    81.066       35.9491    81.066       
1 1 1 63  5  4  o 0 116     6.7   ?     ?   236.578   -2.23445     252.819    -2.23445     44.6017    -2.23445     
1 1 1 63  5  5  o 0 107.9   6.6   ?     ?   91.3702   163.778      339.176    163.778      259.753    163.778      
1 1 1 63  5  6  o 0 10.1    6.8   ?     ?   38.7542   81.8666      11.5388    81.8666      22.1579    -98.1334     
1 1 1 63  5  7  o 0 141.6   9.1   ?     ?   267.506   -57.0254     282.821    -57.0254     50.2438    -57.0254     
1 1 1 63  5  8  o 0 73.2    9.8   ?     ?   187.297   -85.2577     197.834    -85.2577     34.7027    -85.2577     
1 1 1 63  5  9  < 0 28.8    10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 63  5  10 < 0 103.2   12.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 7  8  < 0 42.1    4.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 7  7  < 1 22.4    3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 7  6  < 0 4.2     4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -63 7  5  o 0 14.2    1.5   ?     ?   26.8611   128.83       32.4056    128.83       10.5397    128.83       
1 1 1 -63 7  4  o 0 48.7    3     ?     ?   166.251   -74.5991     138.647    -74.5992     2.67398    -74.5992     
1 1 1 -63 7  3  o 0 23.8    2.3   ?     ?   109.196   -57.4157     86.5363    -57.4157     3.15867    122.584      
1 1 1 -63 7  2  o 0 28.3    2.6   ?     ?   122.397   -104.47      98.3614    -104.47      2.57026    75.5299      
1 1 1 -63 7  1  o 0 4.4     3     ?     ?   129.415   -33.5214     46.3641    146.479      153.458    146.479      
1 1 1 63  7  0  f 1 77.9    4     ?     ?   211.344   -50.2979     189.361    -50.2979     8.99351    -50.2979     
1 1 1 63  7  1  o 0 25.5    4.1   ?     ?   52.1221   -55.5629     105.068    -55.5629     60.7253    -55.5629     
1 1 1 63  7  2  o 0 2       4     ?     ?   100.818   -131.713     41.3904    48.2869      127.299    48.2869      
1 1 1 63  7  3  o 0 164     7.7   ?     ?   278.272   -35.7864     310.744    -35.7864     73.3281    -35.7864     
1 1 1 63  7  4  o 0 -0.9    5.7   ?     ?   75.559    -105.235     28.1307    74.7647      92.6521    74.7647      
1 1 1 63  7  5  < 0 46.6    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 63  7  6  < 0 33.1    7.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 63  7  7  < 1 26.3    8.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 0  13 < 0 12.5    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 0  12 < 0 4.2     3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 0  11 o 0 51.4    3.9   ?     ?   79.4515   0            147.118    0            81.3065    0            
1 1 1 -64 0  10 o 0 110     5.3   ?     ?   348.964   180          224.082    180          66.222     2.37432e-14  
1 1 1 -64 0  9  f 1 4.8     3.6   ?     ?   146.372   180          24.6595    180          98.4896    1.75682e-15  
1 1 1 -64 0  8  o 0 61.4    4.2   ?     ?   212.36    0            169.186    0            11.9583    180          
1 1 1 -64 0  7  o 0 7.5     2.9   ?     ?   148.497   0            40.0336    0            87.3196    180          
1 1 1 -64 0  6  o 0 61.3    4.3   ?     ?   76.9308   180          151.876    180          84.1558    180          
1 1 1 -64 0  5  o 0 8.6     3.4   ?     ?   13.2783   0            4.87002    0            6.87275    180          
1 1 1 -64 0  4  o 0 -3.4    3.3   ?     ?   96.9401   180          3.06831    180          83.0279    2.59304e-16  
1 1 1 -64 0  3  o 0 24.7    3.8   ?     ?   78.3121   180          78.4132    180          8.58962    180          
1 1 1 -64 0  2  o 0 313.7   10.9  ?     ?   430.347   180          393.416    180          5.06175    5.45361e-13  
1 1 1 -64 0  1  o 0 221.9   8.8   ?     ?   305.562   180          331.931    180          48.0969    180          
1 1 1 64  0  0  o 0 1       4.4   ?     ?   5.32497   180          0.46559    180          4.49469    -2.46935e-12 
1 1 1 64  0  1  o 0 11.7    4.9   ?     ?   35.3385   180          16.8459    180          16.1534    7.3175e-15   
1 1 1 64  0  2  o 0 27.2    5.4   ?     ?   288.705   180          114.678    180          155.484    5.17521e-15  
1 1 1 64  0  3  o 0 -3.1    6.2   ?     ?   23.0985   180          1.82765    180          19.0959    6.71565e-16  
1 1 1 64  0  4  o 0 42.2    7.9   ?     ?   131.68    0            138.439    0            18.9943    0            
1 1 1 64  0  5  o 0 1       7.2   ?     ?   60.0993   180          8.03184    180          46.5387    1.21097e-15  
1 1 1 64  0  6  o 0 330.7   19.2  ?     ?   377.968   180          408.533    180          72.2748    180          
1 1 1 64  0  7  o 0 76.6    11.5  ?     ?   313.964   180          194.705    180          84.6881    1.6132e-14   
1 1 1 64  0  8  o 0 -4.1    13.2  ?     ?   118.793   0            23.5751    0            80.7491    180          
1 1 1 64  0  9  f 1 7.7     13.9  ?     ?   7.17527   0            2.9647     0            3.36602    180          
1 1 1 64  0  10 o 0 43.5    15.2  ?     ?   159.787   180          133.826    180          6.62777    1.41679e-13  
1 1 1 64  0  11 < 0 103.3   19.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  0  12 < 0 48.5    18.8  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 2  12 < 0 27.5    2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 2  11 o 0 29.7    2.5   ?     ?   96.0611   -158.543     117.367    -158.543     38.453     -158.543     
1 1 1 -64 2  10 o 0 109.5   3.6   ?     ?   213.537   -151.515     253.433    -151.515     76.8255    -151.515     
1 1 1 -64 2  9  o 0 35.5    2.6   ?     ?   145.601   -99.8756     106.44     -99.8756     14.474     80.1244      
1 1 1 -64 2  8  o 0 42.2    2.6   ?     ?   175.132   83.5002      105.244    83.5002      42.9932    -96.4998     
1 1 1 -64 2  7  o 0 57.4    2.9   ?     ?   210.149   99.8602      127.368    99.8602      51.4965    -80.1398     
1 1 1 -64 2  6  o 0 33.7    2.5   ?     ?   160.046   -170.253     86.3709    -170.253     50.5543    9.74748      
1 1 1 -64 2  5  o 0 209.8   5.5   ?     ?   280.832   -47.7528     368.494    -47.7528     121.943    -47.7528     
1 1 1 -64 2  4  o 0 211.1   5.8   ?     ?   300.123   -5.83654     356.366    -5.83654     91.7187    -5.83654     
1 1 1 -64 2  3  o 0 13.7    2.6   ?     ?   156.78    -26.5725     10.8555    153.427      149.661    153.427      
1 1 1 -64 2  2  o 0 35.1    3.1   ?     ?   172.784   -47.1443     78.6467    -47.1443     74.8865    132.856      
1 1 1 -64 2  1  o 0 0.3     3.1   ?     ?   66.4827   -64.7682     44.7465    115.232      104.016    115.232      
1 1 1 64  2  0  o 0 15.1    3.5   ?     ?   69.8635   -20.5974     29.4632    -20.5974     33.3917    159.403      
1 1 1 64  2  1  o 0 91.5    4.5   ?     ?   151.001   132.851      259.142    132.851      122.969    132.851      
1 1 1 64  2  2  o 0 56.8    4.3   ?     ?   161.862   178.887      160.602    178.887      14.3422    178.887      
1 1 1 64  2  3  o 0 174.7   7.5   ?     ?   245.888   -132.015     351.699    -132.015     129.147    -132.015     
1 1 1 64  2  4  o 0 1.3     5     ?     ?   121.151   143.858      67.8571    -36.1419     177.65     -36.1419     
1 1 1 64  2  5  o 0 11.2    6     ?     ?   62.3845   54.6824      10.2428    54.6824      45.1649    -125.318     
1 1 1 64  2  6  o 0 38.4    6.5   ?     ?   120.82    -148.815     129.636    -148.815     22.2697    -148.815     
1 1 1 64  2  7  o 0 -0.7    7.5   ?     ?   107.71    -130.169     47.1673    49.8305      142.9      49.8305      
1 1 1 64  2  8  o 0 -2.8    8.6   ?     ?   12.2022   7.08963      3.29479    -172.91      13.9966    -172.91      
1 1 1 64  2  9  o 0 67.9    10    ?     ?   176.263   106.813      194.189    106.813      39.3438    106.813      
1 1 1 64  2  10 o 0 8.9     10.6  ?     ?   43.6386   159.79       25.4256    159.79       12.8735    -20.2102     
1 1 1 64  2  11 < 0 15.1    12.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  2  12 < 0 3.3     12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 4  11 < 0 25.2    2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 4  10 < 0 5.1     2.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 4  9  o 0 2.2     2.1   ?     ?   44.3312   7.83937      20.4314    -172.161     56.7647    -172.161     
1 1 1 -64 4  8  o 0 145.4   4.8   ?     ?   246.483   -6.77289     294.722    -6.77289     91.4678    -6.77289     
1 1 1 -64 4  7  o 0 89.4    3.6   ?     ?   159.93    -37.9461     246.189    -37.9461     113.85     -37.9461     
1 1 1 -64 4  6  o 0 28.5    2.5   ?     ?   157.557   -52.3309     72.1233    -52.3309     58.948     127.669      
1 1 1 -64 4  5  o 0 1.5     2.3   ?     ?   73.6278   -158.658     45.7512    21.3416      108.117    21.3416      
1 1 1 -64 4  4  o 0 54.8    3     ?     ?   199.585   108.651      127.606    108.651      42.2185    -71.3487     
1 1 1 -64 4  3  o 0 10.3    2.9   ?     ?   50.4049   51.0911      9.303      51.0911      33.7643    -128.909     
1 1 1 -64 4  2  o 0 19      2.8   ?     ?   89.8185   83.4874      54.5998    83.4874      22.433     -96.5126     
1 1 1 -64 4  1  o 0 57.6    4.4   ?     ?   164.96    134.353      161.587    134.353      19.63      134.353      
1 1 1 64  4  0  o 0 60.5    3.9   ?     ?   240.222   164.473      115.958    164.473      94.0353    -15.5268     
1 1 1 64  4  1  o 0 8.7     3.7   ?     ?   140.465   85.1677      33.5085    -94.8323     156.572    -94.8323     
1 1 1 64  4  2  o 0 131     5.5   ?     ?   307.147   81.4183      225.353    81.4183      44.2481    -98.5817     
1 1 1 64  4  3  o 0 3.6     4.6   ?     ?   61.5087   121.651      24.1537    -58.3488     78.2252    -58.3488     
1 1 1 64  4  4  o 0 31.9    5     ?     ?   86.0783   -46.8479     115.032    -46.8479     39.2751    -46.8479     
1 1 1 64  4  5  o 0 -6.4    6     ?     ?   54.0912   -109.772     30.4795    70.2281      77.5009    70.2281      
1 1 1 64  4  6  o 0 15.5    7.2   ?     ?   64.7821   -36.423      39.9485    -36.423      16.3893    143.577      
1 1 1 64  4  7  o 0 7.3     8.3   ?     ?   50.4143   51.7662      6.30033    51.7662      37.5439    -128.234     
1 1 1 64  4  8  o 0 -2.3    8.4   ?     ?   68.8633   -6.0539      14.5877    173.946      74.5901    173.946      
1 1 1 64  4  9  < 0 25.3    10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  4  10 < 0 29.1    12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 6  9  < 0 15      1.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 6  8  < 0 0.9     1.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 6  7  < 0 172.8   4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 6  6  f 1 116.5   3.9   ?     ?   252.23    65.3777      233.064    65.3777      26.4068    65.3777      
1 1 1 -64 6  5  o 0 18.8    2.3   ?     ?   34.4856   67.1688      58.3214    67.1688      30.0681    67.1688      
1 1 1 -64 6  4  o 0 7.4     2.4   ?     ?   87.3569   -69.0278     1.7781     -69.0278     70.1269    110.972      
1 1 1 -64 6  3  o 0 77.4    3.5   ?     ?   164.35    66.6999      214.465    66.6999      78.9104    66.6999      
1 1 1 -64 6  2  o 0 88.1    3.8   ?     ?   241.445   146.089      184.044    146.089      15.8736    -33.9108     
1 1 1 -64 6  1  f 1 217.2   5.9   ?     ?   257.705   176.48       399.789    176.48       184.561    176.48       
1 1 1 64  6  0  o 0 241     7.3   ?     ?   305.473   -137.02      405.753    -137.02      146.115    -137.02      
1 1 1 64  6  1  f 1 34.1    4.2   ?     ?   123.21    -38.8243     116.395    -38.8243     10.9125    -38.8243     
1 1 1 64  6  2  o 0 62.6    4.7   ?     ?   165.176   -97.8401     181.795    -97.8401     40.8666    -97.8401     
1 1 1 64  6  3  o 0 0       5     ?     ?   18.4919   106.559      6.3366     -73.4407     22.1708    -73.4407     
1 1 1 64  6  4  o 0 22      5.6   ?     ?   39.6355   -38.3623     78.4849    -38.3623     44.5124    -38.3623     
1 1 1 64  6  5  o 0 386.4   12.9  ?     ?   422.07    130.68       492.937    130.68       130.951    130.68       
1 1 1 64  6  6  < 1 33.1    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  6  7  < 0 8.8     9     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  6  8  < 0 14.2    8.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 8  3  < 0 17.4    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 8  2  < 0 2.6     3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -64 8  1  < 0 167.8   5     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  8  0  < 0 72.5    4.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  8  1  < 0 12.5    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 64  8  2  < 0 137.1   5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 1  12 < 0 40.4    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 1  11 < 1 72.9    3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 1  10 o 0 161     4.5   ?     ?   278.626   -176.214     296.382    -176.214     66.5805    -176.214     
1 1 1 -65 1  9  o 0 28.3    2.4   ?     ?   96.3572   130.54       112.883    130.54       32.9089    130.54       
1 1 1 -65 1  8  f 1 61.6    2.9   ?     ?   208.655   74.9865      143.286    74.9865      31.42      -105.014     
1 1 1 -65 1  7  o 0 68      3.1   ?     ?   191.52    134.606      174.699    134.606      14.2793    134.606      
1 1 1 -65 1  6  o 0 105     3.8   ?     ?   166.056   -125.91      275.373    -125.91      133.721    -125.91      
1 1 1 -65 1  5  o 0 176.1   4.7   ?     ?   202.594   -56.5602     382.01     -56.5602     208.368    -56.5602     
1 1 1 -65 1  4  o 0 48.5    2.9   ?     ?   193.352   111.364      108.928    111.364      61.0634    -68.6364     
1 1 1 -65 1  3  f 1 -1.1    2.5   ?     ?   86.0198   -99.1623     64.5939    80.8377      140.914    80.8377      
1 1 1 -65 1  2  o 0 20.5    2.9   ?     ?   161.985   -112.145     23.3905    -112.145     120.113    67.8554      
1 1 1 -65 1  1  o 0 18.6    3.2   ?     ?   133.915   -58.0065     30.538     -58.0065     88.4864    121.993      
1 1 1 65  1  0  o 0 192.1   5.9   ?     ?   289.195   -14.4392     340.722    -14.4392     82.1136    -14.4392     
1 1 1 65  1  1  o 0 66.4    4.2   ?     ?   72.1527   -41.5906     222.406    -41.5906     157.726    -41.5906     
1 1 1 65  1  2  o 0 75      4.9   ?     ?   133.162   131.878      228.744    131.878      109.126    131.878      
1 1 1 65  1  3  f 1 40.7    4.6   ?     ?   142.948   -9.07706     119.115    -9.07706     10.1761    170.923      
1 1 1 65  1  4  o 0 141.7   6.6   ?     ?   210.871   1.97864      324.871    1.97864      138.826    1.97864      
1 1 1 65  1  5  o 0 21.5    6     ?     ?   98.964    153.391      64.9558    153.391      22.4438    -26.609      
1 1 1 65  1  6  o 0 290.7   10.6  ?     ?   375.181   155.691      419.457    155.691      87.911     155.691      
1 1 1 65  1  7  o 0 15.5    7.7   ?     ?   53.7825   135.215      37.6619    135.215      9.25774    -44.7851     
1 1 1 65  1  8  f 1 188.4   10.8  ?     ?   369.894   10.7449      278.379    10.7449      45.9349    -169.255     
1 1 1 65  1  9  o 0 68.2    9.8   ?     ?   187.776   60.7327      184.602    60.7327      20.5214    60.7327      
1 1 1 65  1  10 < 0 26.1    11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  1  11 < 1 94      16.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 3  11 < 0 3.6     2.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 3  10 < 0 26.6    2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 3  9  o 0 106.5   4     ?     ?   219.225   32.1209      240.82     32.1209      60.9943    32.1209      
1 1 1 -65 3  8  o 0 131.1   4.1   ?     ?   251.179   25.8963      265.624    25.8963      58.3323    25.8963      
1 1 1 -65 3  7  o 0 18.8    2.7   ?     ?   117.472   -119.537     51.2734    -119.537     46.0063    60.4626      
1 1 1 -65 3  6  o 0 169.7   4.9   ?     ?   193.529   140.41       376.952    140.41       215.841    140.41       
1 1 1 -65 3  5  o 0 33.2    2.6   ?     ?   163.07    56.5627      81.6526    56.5627      56.5692    -123.437     
1 1 1 -65 3  4  o 0 28.6    2.6   ?     ?   210.426   6.79853      30.3818    6.79853      148.785    -173.201     
1 1 1 -65 3  3  o 0 57.3    3.1   ?     ?   91.1768   -79.2954     198.313    -79.2954     120.36     -79.2954     
1 1 1 -65 3  2  o 0 23.9    2.9   ?     ?   139.692   178.091      58.5099    178.091      61.3702    -1.90912     
1 1 1 -65 3  1  o 0 8.9     3.1   ?     ?   138.234   126.192      29.1801    -53.8076     148.209    -53.8076     
1 1 1 65  3  0  o 0 149.2   5.1   ?     ?   240.75    -160.215     312.013    -160.215     102.064    -160.215     
1 1 1 65  3  1  o 0 29.6    3.9   ?     ?   80.2317   153.043      105.483    153.043      35.3533    153.043      
1 1 1 65  3  2  o 0 6.4     4.2   ?     ?   33.6916   109.171      6.51697    -70.8289     36.0246    -70.8289     
1 1 1 65  3  3  o 0 47.9    5.1   ?     ?   200.639   -113.648     108.332    -113.648     67.6725    66.3516      
1 1 1 65  3  4  o 0 29.7    5.2   ?     ?   179.265   -179.921     57.7583    -179.921     99.6921    0.0787191    
1 1 1 65  3  5  o 0 22      6.1   ?     ?   136.758   -30.3028     56.731     -30.3028     61.9226    149.697      
1 1 1 65  3  6  o 0 29.6    7.2   ?     ?   110.032   -13.4849     104.87     -13.4849     9.35668    -13.4849     
1 1 1 65  3  7  o 0 8.3     8     ?     ?   57.804    -70.6609     18.8619    -70.6609     31.4344    109.339      
1 1 1 65  3  8  o 0 32.3    7.8   ?     ?   58.0662   -48.9629     136.137    -48.9629     85.6255    -48.9629     
1 1 1 65  3  9  < 0 12.9    10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  3  10 < 0 42.7    15.1  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 5  9  < 0 12      2.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 5  8  < 0 33.2    2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 5  7  < 0 48.3    2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 5  6  o 0 14.3    2.3   ?     ?   67.4017   20.115       51.1791    20.115       4.00842    -159.885     
1 1 1 -65 5  5  o 0 8.7     2.5   ?     ?   46.9657   -54.237      16.6546    -54.237      21.9946    125.763      
1 1 1 -65 5  4  o 0 1.5     2.5   ?     ?   40.6659   63.1533      22.3888    -116.847     55.9342    -116.847     
1 1 1 -65 5  3  o 0 2.7     2.6   ?     ?   18.8605   -26.6603     8.70538    153.34       24.3297    153.34       
1 1 1 -65 5  2  o 0 25      2.8   ?     ?   18.006    -36.3331     38.9717    -36.3331     23.9975    -36.3331     
1 1 1 -65 5  1  o 0 165.1   5.4   ?     ?   266.081   -131.273     314.887    -131.273     92.8378    -131.273     
1 1 1 65  5  0  o 0 230.5   6.9   ?     ?   329.004   -66.0303     372.22     -66.0303     92.2202    -66.0303     
1 1 1 65  5  1  o 0 60.8    4.9   ?     ?   227.098   2.38678      130.34     2.38678      63.3563    -177.613     
1 1 1 65  5  2  o 0 105.2   5.4   ?     ?   166.699   158.913      284.257    158.913      141.815    158.913      
1 1 1 65  5  3  o 0 55.1    5.3   ?     ?   164.902   -159.936     160.56     -159.936     19.4483    -159.936     
1 1 1 65  5  4  o 0 56.1    6.2   ?     ?   63.3657   -51.1801     220.35     -51.1801     165.945    -51.1801     
1 1 1 65  5  5  o 0 66.3    7     ?     ?   173.187   155.509      189.911    155.509      41.1063    155.509      
1 1 1 65  5  6  o 0 35.4    6.7   ?     ?   47.7592   161.398      141.762    161.398      100.713    161.398      
1 1 1 65  5  7  < 0 4.6     7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  5  8  < 0 41.7    9.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 7  5  < 0 24      3.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 7  4  < 1 2.4     2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 7  3  < 0 6.9     2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 7  2  < 0 9.2     3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -65 7  1  < 0 25      3.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  7  0  < 0 1.2     3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  7  1  < 0 3       4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  7  2  < 0 77.2    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  7  3  < 0 19.1    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 65  7  4  < 1 33.1    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 0  11 < 0 2.1     2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 0  10 < 0 -1.2    2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 0  9  o 0 138.5   6.3   ?     ?   308.986   0            249.075    0            6.18134    180          
1 1 1 -66 0  8  o 0 143.1   6.2   ?     ?   232.694   0            254.725    0            61.3633    0            
1 1 1 -66 0  7  o 0 85.3    4.5   ?     ?   115.054   180          196.891    180          100.975    180          
1 1 1 -66 0  6  o 0 75.1    4.2   ?     ?   148.69    180          186.23     180          61.6397    180          
1 1 1 -66 0  5  o 0 11.2    3.2   ?     ?   100.885   0            46.9201    0            39.1354    180          
1 1 1 -66 0  4  o 0 20.5    3.8   ?     ?   185.07    180          93.9863    180          64.5665    1.02139e-14  
1 1 1 -66 0  3  f 1 148.8   6.7   ?     ?   177.482   0            265.952    0            112.51     0            
1 1 1 -66 0  2  o 0 54.7    4.8   ?     ?   202.784   0            161.255    0            13.7962    180          
1 1 1 -66 0  1  o 0 56      5.4   ?     ?   231.912   0            163.646    0            37.2012    180          
1 1 1 66  0  0  o 0 395.9   13.6  ?     ?   413.366   5.85924e-15  437.96     0            78.9309    -2.66517e-14 
1 1 1 66  0  1  o 0 9.3     5.9   ?     ?   81.8048   0            26.4399    0            44.7911    180          
1 1 1 66  0  2  o 0 329.5   12.7  ?     ?   398.851   0            401.323    0            53.2753    0            
1 1 1 66  0  3  f 1 569.9   18    ?     ?   374.836   0            528.648    0            199.283    0            
1 1 1 66  0  4  o 0 14.4    7.3   ?     ?   59.2777   180          32.1149    180          19.7797    1.13925e-14  
1 1 1 66  0  5  o 0 181.8   14    ?     ?   207.106   180          298.017    180          118.879    180          
1 1 1 66  0  6  o 0 42.3    9.7   ?     ?   146.601   180          138.838    180          11.9455    180          
1 1 1 66  0  7  o 0 147.2   12.8  ?     ?   299.728   0            268.235    0            8.13537    0            
1 1 1 66  0  8  o 0 143.3   14    ?     ?   344.256   0            263.962    0            34.7649    180          
1 1 1 66  0  9  < 0 9       14.9  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  0  10 < 0 12.2    16.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 2  11 < 0 73.7    3.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 2  10 < 0 18.3    2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 2  9  < 1 35.2    2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 2  8  o 0 45      2.8   ?     ?   133.178   118.207      150.847    118.207      41.0581    118.207      
1 1 1 -66 2  7  o 0 156.3   4.6   ?     ?   196.967   150.057      353.262    150.057      189.971    150.057      
1 1 1 -66 2  6  o 0 9.4     2.3   ?     ?   47.2244   -177.151     11.1641    -177.151     28.1039    2.84871      
1 1 1 -66 2  5  o 0 25.9    2.6   ?     ?   75.6317   24.2743      96.8259    24.2743      33.6303    24.2743      
1 1 1 -66 2  4  o 0 38.6    2.8   ?     ?   143.73    167.396      113.9      167.396      8.32809    -12.6045     
1 1 1 -66 2  3  o 0 81.4    3.6   ?     ?   189.467   -159.26      205.793    -159.26      44.0073    -159.26      
1 1 1 -66 2  2  o 0 2.7     2.8   ?     ?   32.0829   31.5176      16.6844    -148.482     44.1821    -148.482     
1 1 1 -66 2  1  o 0 13      3     ?     ?   30.2268   -98.6634     15.6452    -98.6634     10.3488    81.3366      
1 1 1 66  2  0  o 0 194.7   6     ?     ?   177.504   -112.5       435.434    -112.5       281.317    -112.5       
1 1 1 66  2  1  o 0 97.8    4.7   ?     ?   186.424   -175.025     250.164    -175.025     87.9105    -175.025     
1 1 1 66  2  2  o 0 25.6    4.4   ?     ?   157.204   177.071      55.4696    177.071      81.6345    -2.92858     
1 1 1 66  2  3  o 0 71.7    5.3   ?     ?   159.798   14.3786      206.439    14.3786      66.8371    14.3786      
1 1 1 66  2  4  o 0 139     6.8   ?     ?   231.73    26.9321      305.53     26.9321      105.461    26.9321      
1 1 1 66  2  5  o 0 35.7    6.1   ?     ?   200.772   -42.3133     69.9429    -42.3133     103.566    137.687      
1 1 1 66  2  6  o 0 26.4    6.8   ?     ?   133.486   -88.1872     78.7158    -88.1872     36.7116    91.8128      
1 1 1 66  2  7  o 0 12      7.8   ?     ?   112.16    119.263      18.8161    119.263      78.4097    -60.7375     
1 1 1 66  2  8  o 0 65.4    9.4   ?     ?   150.152   44.8613      204.074    44.8613      73.9351    44.8613      
1 1 1 66  2  9  < 1 18.5    10.7  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  2  10 < 0 76.8    11.5  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 4  9  < 0 32.9    2.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 4  8  < 0 24.8    2.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 4  7  < 0 19.6    2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 4  6  o 0 56      3.1   ?     ?   180.535   95.3274      150.221    95.3274      2.02678    95.3274      
1 1 1 -66 4  5  o 0 57.6    3.2   ?     ?   204.002   40.6999      138.035    40.6999      30.2628    -139.3       
1 1 1 -66 4  4  o 0 75.3    4.1   ?     ?   139.676   -0.90761     225.846    -0.90761     110.343    -0.90761     
1 1 1 -66 4  3  o 0 58.3    3.5   ?     ?   131.699   -32.8365     187.02     -32.8365     77.6515    -32.8365     
1 1 1 -66 4  2  o 0 5       3.1   ?     ?   33.8952   101.37       8.42681    -78.6301     36.6832    -78.6301     
1 1 1 -66 4  1  f 1 77.4    4     ?     ?   190.741   -129.597     197.844    -129.597     37.4631    -129.597     
1 1 1 66  4  0  o 0 6.2     3.4   ?     ?   64.3912   -100.13      11.2144    79.8696      65.9766    79.8696      
1 1 1 66  4  1  f 1 12.8    3.9   ?     ?   69.2426   69.2281      30.6756    69.2281      28.6511    -110.772     
1 1 1 66  4  2  o 0 14.7    4.1   ?     ?   82.1076   -152.204     40.8497    -152.204     29.2748    27.7955      
1 1 1 66  4  3  o 0 285     8.7   ?     ?   337.174   -90.8554     441.89     -90.8554     153.474    -90.8554     
1 1 1 66  4  4  o 0 49.6    5.9   ?     ?   220.165   -70.1069     105.272    -70.1069     83.7039    109.893      
1 1 1 66  4  5  o 0 64.3    6.7   ?     ?   164.262   114.585      191.244    114.585      50.1348    114.585      
1 1 1 66  4  6  o 0 5.4     7.2   ?     ?   79.5105   114.994      0.433581   -65.0064     68.768     -65.0064     
1 1 1 66  4  7  < 0 10.1    7.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  4  8  < 0 -3.4    9.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 6  6  < 0 9.3     2     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 6  5  < 0 20.5    2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 6  4  < 0 29.2    2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 6  3  < 0 70.8    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 6  2  < 0 85.4    3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -66 6  1  < 0 34      3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  6  0  < 0 53      4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  6  1  < 0 25.3    4.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  6  2  < 0 59.1    5.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  6  3  < 0 6.5     5     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  6  4  < 0 30.7    6.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 66  6  5  < 0 64.4    7.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 1  10 < 0 59.4    2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 1  9  < 0 93.5    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 1  8  < 0 81.8    3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 1  7  o 0 12.2    2.2   ?     ?   98.4852   89.9231      31.4879    89.9231      49.9152    -90.0769     
1 1 1 -67 1  6  o 0 24.2    2.5   ?     ?   83.3386   33.2065      100.031    33.2065      30.7875    33.2065      
1 1 1 -67 1  5  o 0 10      2.4   ?     ?   104.975   -172.381     4.93218    -172.381     82.5144    7.61926      
1 1 1 -67 1  4  o 0 101.2   3.8   ?     ?   187.136   154.91       255.804    154.91       99.2199    154.91       
1 1 1 -67 1  3  o 0 26.5    2.8   ?     ?   99.2658   67.9945      95.8705    67.9945      12.4718    67.9945      
1 1 1 -67 1  2  o 0 4.9     3     ?     ?   72.5975   -80.1964     22.1237    99.8036      83.3432    99.8036      
1 1 1 -67 1  1  o 0 112.5   4.6   ?     ?   142.158   164.094      313.667    164.094      193.389    164.094      
1 1 1 67  1  0  o 0 143.1   5     ?     ?   236.513   -151.226     305.872    -151.226     104.484    -151.226     
1 1 1 67  1  1  o 0 138     5.4   ?     ?   284.839   137.692      258.567    137.692      15.4243    137.692      
1 1 1 67  1  2  o 0 155.2   6.4   ?     ?   265.136   87.2586      305.926    87.2586      79.1169    87.2586      
1 1 1 67  1  3  o 0 97.7    5.6   ?     ?   133.267   28.4519      290.984    28.4519      176.779    28.4519      
1 1 1 67  1  4  o 0 8.7     5     ?     ?   78.2317   -174.606     1.11058    -174.606     66.0259    5.39404      
1 1 1 67  1  5  o 0 150.3   7.7   ?     ?   224.005   -135.532     333.605    -135.532     140.737    -135.532     
1 1 1 67  1  6  o 0 13.4    7     ?     ?   104.632   -108.368     29.9603    -108.368     60.1884    71.632       
1 1 1 67  1  7  o 0 1.9     7.6   ?     ?   47.5614   -177.898     2.54287    2.10215      43.5333    2.10215      
1 1 1 67  1  8  < 0 17.7    9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  1  9  < 0 12      10.3  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 3  9  < 0 46.7    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 3  8  < 1 199     6.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 3  7  < 0 7.5     2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 3  6  o 0 23.7    2.6   ?     ?   82.1498   29.5002      96.8737    29.5002      29.3981    29.5002      
1 1 1 -67 3  5  o 0 6.5     2.5   ?     ?   68.7464   82.576       1.58326    -97.424      58.3311    -97.424      
1 1 1 -67 3  4  o 0 0.4     2.4   ?     ?   95.6856   141.085      56.0996    -38.915      135.448    -38.915      
1 1 1 -67 3  3  o 0 6.2     2.7   ?     ?   145.127   133.417      47.72      -46.5828     168.304    -46.5828     
1 1 1 -67 3  2  o 0 12.3    2.9   ?     ?   81.3951   23.9442      26.6571    23.9442      41.232     -156.056     
1 1 1 -67 3  1  o 0 19.1    3.1   ?     ?   120.295   56.9359      51.7927    56.9359      48.8878    -123.064     
1 1 1 67  3  0  o 0 11.4    3.5   ?     ?   11.1522   10.398       6.30812    10.398       3.151      -169.602     
1 1 1 67  3  1  o 0 6.9     4     ?     ?   65.2912   4.80289      6.87358    -175.197     62.3846    -175.197     
1 1 1 67  3  2  o 0 45.1    4.6   ?     ?   166.352   -144.255     127.924    -144.255     13.796     35.7446      
1 1 1 67  3  3  o 0 50      5     ?     ?   163.569   -130.452     150.188    -130.452     10.2944    -130.452     
1 1 1 67  3  4  o 0 26      5.4   ?     ?   115.9     26.1871      94.2598    26.1871      4.99259    -153.813     
1 1 1 67  3  5  o 0 76      6.7   ?     ?   190.016   61.9999      202.395    61.9999      39.522     61.9999      
1 1 1 67  3  6  < 0 22.1    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  3  7  < 0 145.5   9.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  3  8  < 1 19.6    9.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 5  6  < 0 10.8    2.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 5  5  < 0 74.3    3.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 5  4  < 0 51.2    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 5  3  < 0 29.4    2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 5  2  < 0 -0.6    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -67 5  1  < 0 48      4.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  5  0  < 0 41.2    4.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  5  1  < 0 30.2    4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  5  2  < 0 46.2    4.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  5  3  < 0 17.2    5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  5  4  < 0 115.2   6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 67  5  5  < 0 86.3    6.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 0  9  < 0 9.4     3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 0  8  < 0 2.8     3.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 0  7  < 0 10      3.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 0  6  o 0 -0.6    3.1   ?     ?   10.0473   180          0.699777   180          7.60761    6.45423e-16  
1 1 1 -68 0  5  o 0 82.6    5.3   ?     ?   226.892   180          193.238    180          4.73413    180          
1 1 1 -68 0  4  o 0 3.5     3.2   ?     ?   5.0594    180          0.920444   180          3.30161    1.95616e-15  
1 1 1 -68 0  3  o 0 38.9    4.3   ?     ?   48.5111   180          93.8012    180          53.2456    180          
1 1 1 -68 0  2  o 0 179.8   8     ?     ?   284.301   180          288.884    180          50.3289    180          
1 1 1 -68 0  1  < 0 915.2   28.7  ?     ?   ?         ?            584.134    180          ?          ?            
1 1 1 68  0  0  o 0 211.3   8.4   ?     ?   323.897   180          315.203    180          41.7142    -180         
1 1 1 68  0  1  o 0 128.5   7.5   ?     ?   356.279   180          246.172    180          55.4378    3.11578e-14  
1 1 1 68  0  2  o 0 70.3    6.2   ?     ?   276.795   180          182.109    180          52.7348    2.42308e-14  
1 1 1 68  0  3  o 0 178     10.2  ?     ?   365.251   180          290.683    180          20.4823    9.95806e-14  
1 1 1 68  0  4  o 0 134.9   9.7   ?     ?   220.327   180          253.05     180          65.0697    180          
1 1 1 68  0  5  o 0 15      8.5   ?     ?   14.8229   0            11.8631    0            0.797805   180          
1 1 1 68  0  6  < 0 29.8    10    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  0  7  < 0 157.1   13.4  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  0  8  < 0 9       10.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 2  8  < 0 58.2    2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 2  7  < 0 74.8    3.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 2  6  < 0 4.9     2.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 2  5  f 1 2.1     2.3   ?     ?   103.974   57.9117      52.2931    -122.088     138.45     -122.088     
1 1 1 -68 2  4  o 0 23.5    2.7   ?     ?   147.949   120.212      62.032     120.212      60.4938    -59.7876     
1 1 1 -68 2  3  o 0 15.8    2.8   ?     ?   151.957   85.3354      21.6869    85.3354      104.685    -94.6646     
1 1 1 -68 2  2  o 0 25.6    2.9   ?     ?   35.0149   -150.041     87.2358    -150.041     58.0054    -150.041     
1 1 1 -68 2  1  o 0 39.7    3.4   ?     ?   99.5964   -161.173     155        -161.173     71.5716    -161.173     
1 1 1 68  2  0  o 0 22.7    3.5   ?     ?   63.567    -137.338     96.0597    -137.338     42.2743    -137.338     
1 1 1 68  2  1  o 0 103.1   4.7   ?     ?   193.631   140.118      261.409    140.118      97.1679    140.118      
1 1 1 68  2  2  o 0 121.3   6     ?     ?   270.932   127.039      237.803    127.039      7.50741    127.039      
1 1 1 68  2  3  o 0 63.3    5.6   ?     ?   200.253   94.869       160.332    94.869       10.1834    -85.131      
1 1 1 68  2  4  o 0 12.5    5.6   ?     ?   25.3057   107.108      22.4672    107.108      0.889698   107.108      
1 1 1 68  2  5  < 1 92.9    6.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  2  6  < 0 42.9    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  2  7  < 0 349.3   12    ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 4  6  < 1 22.2    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 4  5  < 0 95.5    4.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 4  4  < 0 47      3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 4  3  < 0 26.5    3.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 4  2  < 0 6.7     2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -68 4  1  < 0 60      3.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  4  0  < 0 89.3    4.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  4  1  < 0 22.1    4     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  4  2  < 0 20      4.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  4  3  < 0 47.7    5.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  4  4  < 0 200.4   7.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 68  4  5  < 0 218.9   9.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 1  7  < 0 37.8    2.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 1  6  < 0 53      2.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 1  5  < 0 11.3    2.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 1  4  < 0 41.5    3     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 1  3  o 0 10.1    2.7   ?     ?   117.29    123.852      8.18371    123.852      89.0455    -56.1482     
1 1 1 -69 1  2  f 1 150.4   5     ?     ?   201.961   -125.74      339.587    -125.74      170.671    -125.74      
1 1 1 -69 1  1  o 0 66.8    4     ?     ?   121.023   -176.077     223.232    -176.077     122.184    -176.077     
1 1 1 69  1  0  o 0 15.1    3.9   ?     ?   43.0651   -114.992     49.3153    -114.992     13.1198    -114.992     
1 1 1 69  1  1  o 0 102.3   5.1   ?     ?   224.21    127.567      234.177    127.567      45.2487    127.567      
1 1 1 69  1  2  f 1 45.2    4.9   ?     ?   218.981   136.224      90.2989    136.224      95.5807    -43.7759     
1 1 1 69  1  3  < 0 16.7    4.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  1  4  < 0 8.2     4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  1  5  < 0 60.5    6.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  1  6  < 0 15.8    6.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 3  6  < 0 38.8    2.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 3  5  < 0 73.5    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 3  4  < 0 87.8    3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 3  3  < 0 63.6    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 3  2  < 0 90.5    3.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -69 3  1  < 0 23.9    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  3  0  < 0 17.3    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  3  1  < 0 52.6    4.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  3  2  < 0 16.5    4.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  3  3  < 0 81.5    5.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  3  4  < 0 36.8    5.8   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 69  3  5  < 0 2       6     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 0  5  < 0 32.5    4.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 0  4  < 0 462.9   16.6  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 0  3  < 0 30.3    4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 0  2  < 0 27.8    4.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 0  1  < 1 12.9    4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  0  0  < 0 107.2   7.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  0  1  < 1 93.8    6.6   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  0  2  < 0 90.3    7.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  0  3  < 0 399.4   15.2  ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  0  4  < 0 32.4    8     ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  0  5  < 0 0.3     8.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 2  4  < 0 207.3   5.7   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 2  3  < 0 119.5   4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 2  2  < 0 144.8   4.9   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -70 2  1  < 0 18.2    3.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  2  0  < 0 65.7    4.2   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  2  1  < 0 57.1    4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  2  2  < 0 38.3    4.5   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  2  3  < 0 21.1    5.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 70  2  4  < 0 74.1    6.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -71 1  2  < 0 10.8    3.1   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -71 1  1  < 0 33.4    3.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 71  1  0  < 0 2.2     3.3   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 71  1  1  < 0 51.8    4.4   ?     ?   ?         ?            ?          ?            ?          ?            
1 1 1 -52 8  2  x 0 ?       ?     ?     ?   ?         ?            178.647    -48.9054     ?          ?            
1 1 1 -32 0  2  x 0 ?       ?     ?     ?   ?         ?            151.948    0            ?          ?            
1 1 1 -30 0  11 x 0 ?       ?     ?     ?   ?         ?            749.895    0            ?          ?            
1 1 1 -28 0  6  x 0 ?       ?     ?     ?   ?         ?            610.459    180          ?          ?            
1 1 1 -26 0  9  x 0 ?       ?     ?     ?   ?         ?            416.076    180          ?          ?            
1 1 1 -19 5  1  x 0 ?       ?     ?     ?   ?         ?            686.603    -65.8649     ?          ?            
1 1 1 -16 0  12 x 0 ?       ?     ?     ?   ?         ?            467.296    180          ?          ?            
1 1 1 -14 0  3  x 0 ?       ?     ?     ?   ?         ?            1934.69    180          ?          ?            
1 1 1 -11 3  1  x 0 ?       ?     ?     ?   ?         ?            1239.61    90.0301      ?          ?            
1 1 1 -10 0  28 x 0 ?       ?     ?     ?   ?         ?            111.504    180          ?          ?            
1 1 1 -8  2  1  x 0 ?       ?     ?     ?   ?         ?            1463.98    -39.3932     ?          ?            
1 1 1 -6  0  1  x 0 ?       ?     ?     ?   ?         ?            1300.33    180          ?          ?            
1 1 1 -6  2  2  x 0 ?       ?     ?     ?   ?         ?            1770.51    140          ?          ?            
1 1 1 -4  0  1  x 0 ?       ?     ?     ?   ?         ?            808.104    0            ?          ?            
1 1 1 -2  0  1  x 0 ?       ?     ?     ?   ?         ?            409.59     0            ?          ?            
1 1 1 -1  1  1  x 0 ?       ?     ?     ?   ?         ?            1366.62    67.063       ?          ?            
1 1 1 0   0  1  x 0 ?       ?     ?     ?   ?         ?            412.458    0            ?          ?            
1 1 1 0   0  2  x 0 ?       ?     ?     ?   ?         ?            41.7641    0            ?          ?            
1 1 1 1   1  0  x 0 ?       ?     ?     ?   ?         ?            949.306    54.3797      ?          ?            
1 1 1 1   1  1  x 0 ?       ?     ?     ?   ?         ?            595.099    -29.3261     ?          ?            
1 1 1 2   0  0  x 0 ?       ?     ?     ?   ?         ?            692.144    -2.05157e-13 ?          ?            
1 1 1 2   0  1  x 0 ?       ?     ?     ?   ?         ?            747.972    180          ?          ?            
1 1 1 2   0  28 x 0 ?       ?     ?     ?   ?         ?            138.654    0            ?          ?            
1 1 1 3   1  0  x 0 ?       ?     ?     ?   ?         ?            545.196    56.2848      ?          ?            
1 1 1 4   0  0  x 0 ?       ?     ?     ?   ?         ?            101.76     180          ?          ?            
1 1 1 4   0  2  x 0 ?       ?     ?     ?   ?         ?            327.387    180          ?          ?            
1 1 1 4   0  10 x 0 ?       ?     ?     ?   ?         ?            463.627    0            ?          ?            
1 1 1 4   0  28 x 0 ?       ?     ?     ?   ?         ?            155.42     0            ?          ?            
1 1 1 6   0  0  x 0 ?       ?     ?     ?   ?         ?            939.733    180          ?          ?            
1 1 1 6   0  13 x 0 ?       ?     ?     ?   ?         ?            343.621    0            ?          ?            
1 1 1 6   0  28 x 0 ?       ?     ?     ?   ?         ?            219.423    0            ?          ?            
1 1 1 7   1  13 x 0 ?       ?     ?     ?   ?         ?            553.402    -22.1567     ?          ?            
1 1 1 8   0  13 x 0 ?       ?     ?     ?   ?         ?            1503.29    0            ?          ?            
1 1 1 8   0  26 x 0 ?       ?     ?     ?   ?         ?            295.223    0            ?          ?            
1 1 1 8   0  28 x 0 ?       ?     ?     ?   ?         ?            205.707    180          ?          ?            
1 1 1 9   1  1  x 0 ?       ?     ?     ?   ?         ?            1504.95    -62.6825     ?          ?            
1 1 1 9   7  26 x 0 ?       ?     ?     ?   ?         ?            201.816    67.7038      ?          ?            
1 1 1 10  0  26 x 0 ?       ?     ?     ?   ?         ?            8.99976    0            ?          ?            
1 1 1 10  0  28 x 0 ?       ?     ?     ?   ?         ?            325.173    180          ?          ?            
1 1 1 11  1  0  x 0 ?       ?     ?     ?   ?         ?            1676.05    30.9728      ?          ?            
1 1 1 12  0  28 x 0 ?       ?     ?     ?   ?         ?            70.4593    0            ?          ?            
1 1 1 13  9  24 x 0 ?       ?     ?     ?   ?         ?            94.6689    146.18       ?          ?            
1 1 1 14  0  26 x 0 ?       ?     ?     ?   ?         ?            225.057    0            ?          ?            
1 1 1 14  0  28 x 0 ?       ?     ?     ?   ?         ?            28.4152    0            ?          ?            
1 1 1 14  6  26 x 0 ?       ?     ?     ?   ?         ?            250.029    -174.809     ?          ?            
1 1 1 14  8  25 x 0 ?       ?     ?     ?   ?         ?            133.454    1.63597      ?          ?            
1 1 1 15  9  24 x 0 ?       ?     ?     ?   ?         ?            172.345    -89.8002     ?          ?            
1 1 1 16  0  26 x 0 ?       ?     ?     ?   ?         ?            119.451    180          ?          ?            
1 1 1 16  0  27 x 0 ?       ?     ?     ?   ?         ?            117.028    180          ?          ?            
1 1 1 16  6  26 x 0 ?       ?     ?     ?   ?         ?            138.064    -71.5957     ?          ?            
1 1 1 17  7  25 x 0 ?       ?     ?     ?   ?         ?            25.3477    -64.5108     ?          ?            
1 1 1 18  0  27 x 0 ?       ?     ?     ?   ?         ?            63.4325    180          ?          ?            
1 1 1 18  2  27 x 0 ?       ?     ?     ?   ?         ?            115.793    156.451      ?          ?            
1 1 1 18  16 5  x 0 ?       ?     ?     ?   ?         ?            79.1707    -98.979      ?          ?            
1 1 1 19  3  27 x 0 ?       ?     ?     ?   ?         ?            145.749    -22.9751     ?          ?            
1 1 1 19  5  26 x 0 ?       ?     ?     ?   ?         ?            175.558    83.9191      ?          ?            
1 1 1 19  7  25 x 0 ?       ?     ?     ?   ?         ?            131.045    -19.078      ?          ?            
1 1 1 20  0  27 x 0 ?       ?     ?     ?   ?         ?            110.779    0            ?          ?            
1 1 1 20  2  26 x 0 ?       ?     ?     ?   ?         ?            104.312    114.96       ?          ?            
1 1 1 20  2  27 x 0 ?       ?     ?     ?   ?         ?            235.199    -21.0219     ?          ?            
1 1 1 20  8  24 x 0 ?       ?     ?     ?   ?         ?            115.718    177.968      ?          ?            
1 1 1 21  9  23 x 0 ?       ?     ?     ?   ?         ?            114.534    156.784      ?          ?            
1 1 1 22  0  25 x 0 ?       ?     ?     ?   ?         ?            11.3011    180          ?          ?            
1 1 1 22  10 22 x 0 ?       ?     ?     ?   ?         ?            173.157    -59.2308     ?          ?            
1 1 1 24  0  26 x 0 ?       ?     ?     ?   ?         ?            11.2195    180          ?          ?            
1 1 1 24  8  23 x 0 ?       ?     ?     ?   ?         ?            128.751    -125.367     ?          ?            
1 1 1 25  3  26 x 0 ?       ?     ?     ?   ?         ?            299.933    -139.791     ?          ?            
1 1 1 25  7  24 x 0 ?       ?     ?     ?   ?         ?            109.718    -165.087     ?          ?            
1 1 1 26  0  25 x 0 ?       ?     ?     ?   ?         ?            104.753    180          ?          ?            
1 1 1 26  0  26 x 0 ?       ?     ?     ?   ?         ?            21.2196    180          ?          ?            
1 1 1 27  7  23 x 0 ?       ?     ?     ?   ?         ?            184.572    -114.508     ?          ?            
1 1 1 28  0  24 x 0 ?       ?     ?     ?   ?         ?            245.816    0            ?          ?            
1 1 1 28  0  25 x 0 ?       ?     ?     ?   ?         ?            240.21     0            ?          ?            
1 1 1 28  0  26 x 0 ?       ?     ?     ?   ?         ?            54.3555    0            ?          ?            
1 1 1 30  0  23 x 0 ?       ?     ?     ?   ?         ?            7.87507    0            ?          ?            
1 1 1 30  0  24 x 0 ?       ?     ?     ?   ?         ?            10.5999    180          ?          ?            
1 1 1 30  0  25 x 0 ?       ?     ?     ?   ?         ?            140.626    180          ?          ?            
1 1 1 31  1  25 x 0 ?       ?     ?     ?   ?         ?            98.5568    -171.731     ?          ?            
1 1 1 31  3  25 x 0 ?       ?     ?     ?   ?         ?            78.0599    108.063      ?          ?            
1 1 1 31  5  24 x 0 ?       ?     ?     ?   ?         ?            105.459    175.316      ?          ?            
1 1 1 31  9  21 x 0 ?       ?     ?     ?   ?         ?            39.1986    -22.3342     ?          ?            
1 1 1 31  13 15 x 0 ?       ?     ?     ?   ?         ?            312.606    145.067      ?          ?            
1 1 1 32  0  24 x 0 ?       ?     ?     ?   ?         ?            290.102    180          ?          ?            
1 1 1 32  0  25 x 0 ?       ?     ?     ?   ?         ?            33.7673    0            ?          ?            
1 1 1 32  4  24 x 0 ?       ?     ?     ?   ?         ?            144.937    120.287      ?          ?            
1 1 1 34  0  24 x 0 ?       ?     ?     ?   ?         ?            71.8721    0            ?          ?            
1 1 1 34  4  24 x 0 ?       ?     ?     ?   ?         ?            59.0171    -43.7841     ?          ?            
1 1 1 36  0  22 x 0 ?       ?     ?     ?   ?         ?            202.349    0            ?          ?            
1 1 1 36  0  23 x 0 ?       ?     ?     ?   ?         ?            140.553    0            ?          ?            
1 1 1 36  0  24 x 0 ?       ?     ?     ?   ?         ?            33.4037    0            ?          ?            
1 1 1 36  4  23 x 0 ?       ?     ?     ?   ?         ?            304.429    -111.143     ?          ?            
1 1 1 38  0  23 x 0 ?       ?     ?     ?   ?         ?            200.789    0            ?          ?            
1 1 1 40  0  21 x 0 ?       ?     ?     ?   ?         ?            312.705    0            ?          ?            
1 1 1 40  0  22 x 0 ?       ?     ?     ?   ?         ?            148.334    0            ?          ?            
1 1 1 40  0  23 x 0 ?       ?     ?     ?   ?         ?            14.9067    180          ?          ?            
1 1 1 40  2  23 x 0 ?       ?     ?     ?   ?         ?            231.186    169.28       ?          ?            
1 1 1 41  7  20 x 0 ?       ?     ?     ?   ?         ?            219.546    5.05779      ?          ?            
1 1 1 42  0  22 x 0 ?       ?     ?     ?   ?         ?            85.7098    180          ?          ?            
1 1 1 43  1  22 x 0 ?       ?     ?     ?   ?         ?            70.4857    -6.03717     ?          ?            
1 1 1 44  0  21 x 0 ?       ?     ?     ?   ?         ?            81.7365    0            ?          ?            
1 1 1 50  0  19 x 0 ?       ?     ?     ?   ?         ?            296.626    0            ?          ?            
1 1 1 54  0  17 x 0 ?       ?     ?     ?   ?         ?            11.2892    0            ?          ?            
# 
#END OF REFLECTIONS
