data_r5jq4sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2016-06-29 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5jq4 
_cell.length_a      129.4530 
_cell.length_b      33.8390 
_cell.length_c      67.5290 
_cell.angle_alpha   90.0000 
_cell.angle_beta    109.5080 
_cell.angle_gamma   90.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97923 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.800 
_diffrn_reflns.pdbx_d_res_low    63.652 
_diffrn_reflns.limit_h_max       67 
_diffrn_reflns.limit_h_min       -71 
_diffrn_reflns.limit_k_max       18 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       37 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            26037 
_diffrn_reflns.pdbx_number_obs   25665 
# 
_entry.id   5jq4 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5jq4 
_symmetry.space_group_name_H-M   "C 1 2 1" 
_symmetry.Int_Tables_number      5 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"           
2 "-X,  Y,  -Z"         
3 "X+1/2,  Y+1/2,  Z"   
4 "-X+1/2,  Y+1/2,  -Z" 
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.F_calc 
_refln.phase_calc 
_refln.pdbx_anom_difference 
_refln.pdbx_anom_difference_sigma 
_refln.fom 
1 1 1 -71 1  8  x ?        ?        53.45649  241.0 ?              ?        0.00 
1 1 1 -71 1  9  o 48.17131 11.92332 32.42230  66.9  ?              ?        0.68 
1 1 1 -71 1  10 o 87.75336 10.37245 92.60999  87.3  ?              ?        0.95 
1 1 1 -71 1  11 o 44.33714 11.67428 58.67379  123.9 ?              ?        0.82 
1 1 1 -71 1  12 o 39.52763 11.80986 50.19368  254.2 ?              ?        0.75 
1 1 1 -71 1  13 o 94.06700 8.961998 95.03938  266.4 ?              ?        0.96 
1 1 1 -71 1  14 o 58.48400 13.35457 42.27617  304.6 ?              ?        0.80 
1 1 1 -71 1  15 o 29.54001 9.852252 4.518833  78.9  ?              ?        0.09 
1 1 1 -71 1  16 o 34.22754 11.18769 42.18747  186.9 ?              ?        0.68 
1 1 1 -71 1  17 x ?        ?        95.57670  103.8 ?              ?        0.00 
1 1 1 -70 0  5  x ?        ?        63.81841  180.0 ?              ?        0.00 
1 1 1 -70 0  6  o 37.10313 18.82191 30.61583  180.0 ?              ?        0.56 
1 1 1 -70 0  7  o 26.76244 17.72879 2.064688  180.0 ?              ?        0.03 
1 1 1 -70 0  8  o 20.59148 14.09527 10.94569  180.0 ?              ?        0.14 
1 1 1 -70 0  9  o 21.35679 14.68547 38.51062  0.0   -0.000000      0.000000 0.45 
1 1 1 -70 0  10 o 119.1232 11.70532 136.8112  180.0 -0.000000      0.000000 1.00 
1 1 1 -70 0  11 o 93.78272 12.58883 100.0816  180.0 -0.000000      0.000000 1.00 
1 1 1 -70 0  12 o 27.99081 17.83154 66.25327  360.0 -0.000000      0.000000 0.77 
1 1 1 -70 0  13 o 33.84788 20.12118 4.184007  360.0 -0.000000      0.000000 0.07 
1 1 1 -70 0  14 o 46.41790 20.34837 28.81155  0.0   -0.000000      0.000000 0.59 
1 1 1 -70 0  15 o 32.53473 20.27154 1.552501  180.0 -0.000000      0.000000 0.03 
1 1 1 -70 0  16 o 25.15871 16.68178 81.25951  360.0 ?              ?        0.83 
1 1 1 -70 0  17 o 73.44685 19.38902 87.61642  360.0 ?              ?        1.00 
1 1 1 -70 0  18 o 28.50372 18.38017 52.21951  0.0   ?              ?        0.70 
1 1 1 -70 0  19 o 35.61142 20.62734 9.601162  180.0 ?              ?        0.19 
1 1 1 -70 0  20 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -70 2  6  x ?        ?        14.01286  142.8 ?              ?        0.00 
1 1 1 -70 2  7  o 50.01105 10.92199 39.77960  147.1 ?              ?        0.76 
1 1 1 -70 2  8  o 49.05707 11.87479 75.54575  227.0 ?              ?        0.88 
1 1 1 -70 2  9  o 36.76891 11.30852 28.91115  48.9  ?              ?        0.53 
1 1 1 -70 2  10 o 68.73094 10.69833 92.78626  47.2  ?              ?        0.93 
1 1 1 -70 2  11 o 44.12984 12.06350 58.02995  104.7 ?              ?        0.80 
1 1 1 -70 2  12 o 36.83266 11.37902 48.76440  6.3   ?              ?        0.72 
1 1 1 -70 2  13 o 31.27015 10.03603 25.83534  150.6 ?              ?        0.45 
1 1 1 -70 2  14 o 54.02478 13.17619 97.11868  160.1 ?              ?        0.91 
1 1 1 -70 2  15 o 63.16069 12.04591 112.7481  184.2 ?              ?        0.94 
1 1 1 -70 2  16 f 31.97623 10.37438 16.52435  95.6  ?              ?        0.00 
1 1 1 -70 2  17 o 38.63609 11.81702 89.14710  83.6  ?              ?        0.87 
1 1 1 -70 2  18 o 50.82996 11.94132 67.79818  78.4  ?              ?        0.88 
1 1 1 -70 2  19 x ?        ?        65.13475  309.0 ?              ?        0.00 
1 1 1 -70 4  10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -70 4  11 x ?        ?        74.95107  221.3 ?              ?        0.00 
1 1 1 -70 4  12 x ?        ?        52.94933  34.2  ?              ?        0.00 
1 1 1 -70 4  13 x ?        ?        119.8978  328.2 ?              ?        0.00 
1 1 1 -70 4  14 x ?        ?        55.81706  255.9 ?              ?        0.00 
1 1 1 -70 4  15 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -69 1  3  x ?        ?        95.44276  279.2 ?              ?        0.00 
1 1 1 -69 1  4  o 88.38580 7.978533 140.9447  240.5 ?              ?        0.97 
1 1 1 -69 1  5  o 42.66206 11.22976 43.50602  275.8 ?              ?        0.72 
1 1 1 -69 1  6  o 92.08243 8.465484 113.6590  40.9  35.66158       16.93097 0.96 
1 1 1 -69 1  7  o 49.79426 11.22736 51.97460  147.0 23.32013       22.45473 0.80 
1 1 1 -69 1  8  o 49.03081 11.98870 29.93815  206.2 17.17505       23.97741 0.61 
1 1 1 -69 1  9  o 70.79274 10.76635 107.1242  326.2 14.52033       21.53270 0.94 
1 1 1 -69 1  10 o 49.20467 11.73488 63.51865  303.7 -13.94102      23.46976 0.83 
1 1 1 -69 1  11 o 110.2887 7.890912 144.8998  84.2  0.6579819      15.78182 0.97 
1 1 1 -69 1  12 o 46.13857 11.43393 58.40940  120.3 22.60843       22.86787 0.80 
1 1 1 -69 1  13 o 26.44096 9.183828 54.37901  216.3 9.478403       18.36766 0.64 
1 1 1 -69 1  14 f 53.92813 12.40563 46.40435  85.4  17.56686       24.81125 0.00 
1 1 1 -69 1  15 o 38.31692 11.32873 53.17970  144.7 -7.756035      22.65746 0.74 
1 1 1 -69 1  16 o 54.49722 12.27146 69.58024  297.4 -21.66841      24.54292 0.87 
1 1 1 -69 1  17 o 41.59456 11.07118 64.56763  10.7  -26.08987      22.14237 0.82 
1 1 1 -69 1  18 o 62.18160 11.10680 45.01306  81.2  30.59676       22.21361 0.83 
1 1 1 -69 1  19 o 48.46739 12.58099 43.75234  2.0   ?              ?        0.76 
1 1 1 -69 1  20 o 76.14233 9.650427 85.69129  42.7  ?              ?        0.94 
1 1 1 -69 1  21 f 89.49977 9.659069 129.5176  67.9  ?              ?        0.00 
1 1 1 -69 3  4  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -69 3  5  o 71.61037 10.86002 90.04391  171.1 ?              ?        0.94 
1 1 1 -69 3  6  o 46.75689 11.26990 71.07371  153.8 ?              ?        0.86 
1 1 1 -69 3  7  o 26.35993 8.879338 27.63053  75.3  ?              ?        0.43 
1 1 1 -69 3  8  f 41.14847 11.91019 3.176292  137.9 ?              ?        0.00 
1 1 1 -69 3  9  o 66.38215 10.55709 35.48134  82.0  46.34190       21.11419 0.79 
1 1 1 -69 3  10 o 42.14452 12.13801 82.54390  75.5  1.732147       24.27601 0.86 
1 1 1 -69 3  11 o 46.05275 10.51406 28.03650  263.4 -33.31351      21.02811 0.60 
1 1 1 -69 3  12 o 56.72581 11.88665 64.66302  326.6 -23.53794      23.77331 0.87 
1 1 1 -69 3  13 o 33.35526 10.56993 20.95678  154.2 -1.915180      21.13986 0.38 
1 1 1 -69 3  14 o 41.03991 12.26068 23.54187  90.4  -6.241478      24.52135 0.48 
1 1 1 -69 3  15 o 39.86095 11.63478 37.61478  315.8 -6.867500      23.26956 0.65 
1 1 1 -69 3  16 o 51.61750 10.94833 64.41898  39.2  ?              ?        0.87 
1 1 1 -69 3  17 o 75.19604 11.72171 109.3461  70.8  ?              ?        0.95 
1 1 1 -69 3  18 o 53.03867 11.83459 81.11909  121.9 ?              ?        0.90 
1 1 1 -69 3  19 o 53.38380 13.53043 53.60406  164.7 ?              ?        0.83 
1 1 1 -69 3  20 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -69 5  9  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -69 5  10 x ?        ?        51.09450  297.6 ?              ?        0.00 
1 1 1 -69 5  11 x ?        ?        55.15178  136.2 ?              ?        0.00 
1 1 1 -69 5  12 x ?        ?        94.28449  126.5 ?              ?        0.00 
1 1 1 -69 5  13 x ?        ?        83.88087  57.9  ?              ?        0.00 
1 1 1 -69 5  14 x ?        ?        36.92925  283.7 ?              ?        0.00 
1 1 1 -69 5  15 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -68 0  1  x ?        ?        59.77137  360.0 ?              ?        0.00 
1 1 1 -68 0  2  o 39.74744 18.47948 53.85300  360.0 ?              ?        0.83 
1 1 1 -68 0  3  o 15.28478 11.06500 14.45181  180.0 -0.000000      0.000000 0.14 
1 1 1 -68 0  4  o 27.04362 17.19078 64.72247  180.0 -0.000000      0.000000 0.73 
1 1 1 -68 0  5  o 22.14809 14.96301 27.05408  0.0   -0.000000      0.000000 0.32 
1 1 1 -68 0  6  o 29.67105 17.96124 70.04919  0.0   -0.000000      0.000000 0.78 
1 1 1 -68 0  7  o 101.9784 9.576753 92.15509  180.0 -0.000000      0.000000 1.00 
1 1 1 -68 0  8  f 25.01913 16.64470 25.03873  180.0 -0.000000      0.000000 0.00 
1 1 1 -68 0  9  o 43.17284 18.91015 8.807482  0.0   -0.000000      0.000000 0.18 
1 1 1 -68 0  10 o 69.83018 20.94154 43.03133  180.0 -0.000000      0.000000 0.88 
1 1 1 -68 0  11 o 23.64772 16.16618 34.72557  360.0 -0.000000      0.000000 0.40 
1 1 1 -68 0  12 o 81.35438 16.99481 90.46355  180.0 -0.000000      0.000000 1.00 
1 1 1 -68 0  13 f 33.99713 20.36947 69.00653  0.0   -0.000000      0.000000 0.00 
1 1 1 -68 0  14 o 22.18859 15.41125 16.57663  180.0 -0.000000      0.000000 0.19 
1 1 1 -68 0  15 o 160.8606 8.453854 222.6497  180.0 -0.000000      0.000000 1.00 
1 1 1 -68 0  16 o 111.1044 9.916197 183.1622  180.0 -0.000000      0.000000 1.00 
1 1 1 -68 0  17 o 19.29666 13.70838 70.98045  360.0 -0.000000      0.000000 0.66 
1 1 1 -68 0  18 f 55.19215 23.37821 45.39294  180.0 -0.000000      0.000000 0.00 
1 1 1 -68 0  19 o 93.07204 12.07917 72.02503  180.0 -0.000000      0.000000 1.00 
1 1 1 -68 0  20 o 97.38480 11.21356 126.4796  180.0 -0.000000      0.000000 1.00 
1 1 1 -68 0  21 o 78.63377 16.11596 149.1683  180.0 ?              ?        1.00 
1 1 1 -68 0  22 o 27.39566 17.59135 5.795748  360.0 ?              ?        0.10 
1 1 1 -68 0  23 x ?        ?        7.421385  360.0 ?              ?        0.00 
1 1 1 -68 2  1  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -68 2  2  o 30.98622 9.880017 54.36176  226.2 ?              ?        0.72 
1 1 1 -68 2  3  o 29.46384 9.602208 9.830607  268.0 ?              ?        0.18 
1 1 1 -68 2  4  o 39.04453 9.804193 53.94859  107.4 -26.56682      19.60839 0.77 
1 1 1 -68 2  5  o 52.50569 10.08175 9.894462  162.9 40.03228       20.16351 0.29 
1 1 1 -68 2  6  o 58.53368 9.882179 78.00040  286.2 -30.73962      19.76436 0.90 
1 1 1 -68 2  7  o 26.68096 9.152687 27.89405  323.7 -1.749626      18.30537 0.39 
1 1 1 -68 2  8  o 74.33368 9.259812 112.3146  80.4  29.24852       18.51962 0.94 
1 1 1 -68 2  9  o 58.87095 11.69975 11.14945  194.2 18.50670       23.39951 0.32 
1 1 1 -68 2  10 o 45.21093 12.07299 71.03571  235.2 8.032761       24.14598 0.83 
1 1 1 -68 2  11 o 31.02152 10.10070 18.80420  120.8 1.389816       20.20140 0.30 
1 1 1 -68 2  12 o 68.98660 11.44683 75.35896  305.8 -29.45495      22.89367 0.90 
1 1 1 -68 2  13 o 43.07713 12.25909 51.24289  299.5 0.4368896      24.51818 0.73 
1 1 1 -68 2  14 f 40.94820 12.16086 57.94931  210.4 -11.17971      24.32171 0.00 
1 1 1 -68 2  15 o 46.84459 12.15318 45.94550  228.9 -15.39947      24.30635 0.73 
1 1 1 -68 2  16 o 77.71504 11.38043 108.8839  309.6 -1.503937      22.76086 0.94 
1 1 1 -68 2  17 o 79.01381 10.96951 78.40231  352.9 10.46574       21.93903 0.93 
1 1 1 -68 2  18 o 33.33213 10.70802 30.82957  191.0 12.28560       21.41604 0.51 
1 1 1 -68 2  19 o 80.59855 8.550148 96.94953  156.5 -3.862686      17.10030 0.95 
1 1 1 -68 2  20 o 29.56828 9.750176 71.74580  184.4 ?              ?        0.79 
1 1 1 -68 2  21 o 47.60612 11.96045 65.23559  307.4 ?              ?        0.86 
1 1 1 -68 2  22 o 61.13165 11.80982 103.9043  323.5 ?              ?        0.94 
1 1 1 -68 4  4  x ?        ?        86.42571  254.9 ?              ?        0.00 
1 1 1 -68 4  5  o 35.25163 10.91686 46.31000  50.0  ?              ?        0.70 
1 1 1 -68 4  6  o 61.60586 10.51645 90.99091  71.5  ?              ?        0.92 
1 1 1 -68 4  7  o 37.23160 11.24805 36.16134  139.0 ?              ?        0.61 
1 1 1 -68 4  8  o 60.51078 11.49165 63.08564  176.0 -6.423779      22.98330 0.88 
1 1 1 -68 4  9  o 81.22650 9.669156 92.52747  152.8 18.82621       19.33831 0.94 
1 1 1 -68 4  10 o 89.44513 9.510829 152.6771  97.1  -27.66714      19.02166 0.97 
1 1 1 -68 4  11 o 88.11470 8.170481 85.07113  90.8  -32.92836      16.34096 0.95 
1 1 1 -68 4  12 o 66.55862 11.57133 98.54176  113.5 10.32382       23.14266 0.93 
1 1 1 -68 4  13 o 40.40618 11.83982 71.95080  100.3 -2.493649      23.67965 0.83 
1 1 1 -68 4  14 o 47.40650 11.79817 33.27912  331.0 -1.183708      23.59635 0.66 
1 1 1 -68 4  15 o 39.57023 11.85041 45.25396  151.8 -6.587673      23.70082 0.71 
1 1 1 -68 4  16 f 70.48431 13.48200 130.6983  111.3 2.249924       26.96400 0.00 
1 1 1 -68 4  17 o 56.42158 12.57558 71.92979  75.9  ?              ?        0.89 
1 1 1 -68 4  18 o 73.68800 10.97407 105.7521  269.8 ?              ?        0.95 
1 1 1 -68 4  19 o 38.40115 11.50506 86.41519  135.0 ?              ?        0.87 
1 1 1 -68 4  20 x ?        ?        60.31601  183.5 ?              ?        0.00 
1 1 1 -68 6  10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -68 6  11 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -68 6  12 x ?        ?        32.44490  33.9  ?              ?        0.00 
1 1 1 -68 6  13 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -68 6  14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -67 1  1  o 51.96196 10.29393 82.05122  147.7 ?              ?        0.89 
1 1 1 -67 1  2  o 62.71254 10.56464 87.85153  65.7  23.92789       21.12929 0.91 
1 1 1 -67 1  3  o 72.06966 8.514154 111.8989  19.2  -11.61510      17.02831 0.94 
1 1 1 -67 1  4  o 53.29557 10.37627 29.89499  277.1 26.01955       20.75253 0.64 
1 1 1 -67 1  5  o 69.22333 10.23332 106.7477  198.7 0.6639633      20.46664 0.93 
1 1 1 -67 1  6  o 42.10887 10.92157 62.28698  170.3 -14.00980      21.84314 0.79 
1 1 1 -67 1  7  o 58.15495 11.15500 38.57975  180.3 -26.61453      22.31000 0.74 
1 1 1 -67 1  8  o 41.31678 11.67218 80.24439  150.7 -0.9538956     23.34437 0.83 
1 1 1 -67 1  9  o 90.98479 8.519600 98.03088  208.6 3.515953       17.03920 0.95 
1 1 1 -67 1  10 o 38.08896 11.42799 41.84499  317.8 -5.141350      22.85598 0.63 
1 1 1 -67 1  11 o 51.14740 12.23510 62.31585  318.3 26.55311       24.47021 0.83 
1 1 1 -67 1  12 o 34.34986 11.04533 48.19823  215.8 4.067753       22.09067 0.65 
1 1 1 -67 1  13 o 41.83583 11.97373 55.77075  7.0   -8.649689      23.94746 0.76 
1 1 1 -67 1  14 o 50.11246 12.51491 82.03423  218.8 -20.36023      25.02982 0.87 
1 1 1 -67 1  15 o 66.57780 12.06608 94.37931  246.8 22.67197       24.13217 0.92 
1 1 1 -67 1  16 o 44.81600 12.25492 55.48495  254.7 -9.712143      24.50985 0.77 
1 1 1 -67 1  17 o 50.48337 12.92154 80.66673  335.5 1.423355       25.84307 0.87 
1 1 1 -67 1  18 o 84.86945 8.584069 91.56766  193.4 -9.094666      17.16814 0.94 
1 1 1 -67 1  19 o 105.5315 6.813031 125.7894  105.0 5.602234       13.62606 0.97 
1 1 1 -67 1  20 o 26.16654 8.902904 51.23595  108.8 0.5686111      17.80581 0.63 
1 1 1 -67 1  21 o 55.13330 11.28196 45.70493  250.8 17.71931       22.56393 0.81 
1 1 1 -67 1  22 o 39.27890 10.90351 66.43659  247.6 -17.40340      21.80703 0.83 
1 1 1 -67 1  23 o 59.26473 11.45354 77.33546  329.0 ?              ?        0.91 
1 1 1 -67 1  24 o 39.49477 9.505516 66.98247  357.0 ?              ?        0.86 
1 1 1 -67 3  1  o 64.28612 10.50949 132.0264  272.9 ?              ?        0.95 
1 1 1 -67 3  2  o 57.12341 11.04756 95.63379  154.9 ?              ?        0.92 
1 1 1 -67 3  3  o 86.96584 7.691765 86.28795  205.7 6.138779       15.38353 0.95 
1 1 1 -67 3  4  o 32.13689 10.13516 62.19526  236.2 -3.100748      20.27032 0.74 
1 1 1 -67 3  5  o 118.1968 6.235786 144.7953  355.8 11.48999       12.47157 0.98 
1 1 1 -67 3  6  o 71.42219 10.15182 81.12239  358.1 22.97614       20.30363 0.92 
1 1 1 -67 3  7  f 98.60673 7.606888 103.3120  194.7 27.06004       15.21378 0.00 
1 1 1 -67 3  8  o 36.65000 10.99682 51.03898  133.4 4.807999       21.99364 0.69 
1 1 1 -67 3  9  o 92.56798 8.383679 77.30072  64.2  -13.16373      16.76736 0.94 
1 1 1 -67 3  10 o 32.35981 10.28211 19.48799  153.4 0.8518066      20.56422 0.32 
1 1 1 -67 3  11 o 34.04400 10.74308 17.21408  161.4 -6.758337      21.48615 0.30 
1 1 1 -67 3  12 o 34.80974 10.59111 50.75039  300.3 -8.860329      21.18222 0.68 
1 1 1 -67 3  13 o 60.94835 11.33261 85.90238  252.9 22.70738       22.66523 0.90 
1 1 1 -67 3  14 o 63.05338 11.60713 119.6754  208.1 39.00828       23.21426 0.93 
1 1 1 -67 3  15 o 100.7142 8.289186 131.9910  142.7 -19.71128      16.57837 0.97 
1 1 1 -67 3  16 o 47.02883 12.09035 44.98534  228.3 -29.28865      24.18069 0.73 
1 1 1 -67 3  17 o 49.63402 12.81150 103.0399  223.8 -1.531368      25.62300 0.90 
1 1 1 -67 3  18 o 45.54121 11.40969 49.77267  287.1 25.50089       22.81938 0.77 
1 1 1 -67 3  19 o 56.04222 12.45074 136.6136  67.5  -15.88477      24.90148 0.94 
1 1 1 -67 3  20 o 47.68021 12.09843 86.09206  77.1  -30.94379      24.19687 0.89 
1 1 1 -67 3  21 f 48.32550 12.04925 55.56358  356.7 ?              ?        0.00 
1 1 1 -67 3  22 o 46.08588 10.85224 67.23547  209.9 ?              ?        0.87 
1 1 1 -67 3  23 x ?        ?        44.17487  209.0 ?              ?        0.00 
1 1 1 -67 5  3  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -67 5  4  o 35.12903 10.82404 32.11755  54.8  ?              ?        0.58 
1 1 1 -67 5  5  o 32.07389 9.977219 26.77970  217.0 ?              ?        0.48 
1 1 1 -67 5  6  o 51.19495 12.00463 75.53773  344.9 ?              ?        0.88 
1 1 1 -67 5  7  o 37.63678 11.48581 43.02514  67.3  0.4892273      22.97162 0.68 
1 1 1 -67 5  8  o 25.05700 8.553900 34.24331  163.5 0.4353218      17.10780 0.48 
1 1 1 -67 5  9  f 99.62117 8.453327 140.8657  254.4 -5.575996      16.90665 0.00 
1 1 1 -67 5  10 o 35.79815 10.70271 74.76444  346.4 18.43372       21.40542 0.82 
1 1 1 -67 5  11 o 123.0984 6.169456 164.5993  2.0   2.446327       12.33891 0.98 
1 1 1 -67 5  12 o 68.91884 11.12296 82.79813  343.5 -26.11883      22.24592 0.92 
1 1 1 -67 5  13 o 42.77876 12.27481 53.27644  323.3 -8.245678      24.54961 0.77 
1 1 1 -67 5  14 o 65.05511 10.38799 109.8581  32.8  -2.593967      20.77598 0.94 
1 1 1 -67 5  15 o 38.98655 11.43093 48.11526  334.9 3.216377       22.86187 0.73 
1 1 1 -67 5  16 o 32.86239 10.36104 33.12137  250.8 -5.187969      20.72209 0.56 
1 1 1 -67 5  17 o 90.89306 13.10132 111.8330  27.0  ?              ?        0.96 
1 1 1 -67 5  18 o 38.48311 11.16829 74.96192  333.1 ?              ?        0.85 
1 1 1 -67 5  19 o 110.0865 8.311434 148.0925  169.1 ?              ?        0.98 
1 1 1 -67 5  20 x ?        ?        37.96147  256.0 ?              ?        0.00 
1 1 1 -66 0  1  o 183.5744 5.875844 215.3527  180.0 -0.000000      0.000000 1.00 
1 1 1 -66 0  2  o 21.89489 14.97289 17.55995  180.0 -0.000000      0.000000 0.20 
1 1 1 -66 0  3  o 31.07295 17.45139 8.616242  360.0 -0.000000      0.000000 0.13 
1 1 1 -66 0  4  o 31.17850 18.48162 23.58807  180.0 -0.000000      0.000000 0.34 
1 1 1 -66 0  5  o 39.33999 18.56112 30.53816  0.0   -0.000000      0.000000 0.52 
1 1 1 -66 0  6  o 85.25348 13.71183 114.1315  0.0   -0.000000      0.000000 1.00 
1 1 1 -66 0  7  o 121.5943 7.670249 128.6481  0.0   -0.000000      0.000000 1.00 
1 1 1 -66 0  8  o 49.27354 21.23184 53.11056  0.0   -0.000000      0.000000 0.83 
1 1 1 -66 0  9  o 29.66639 18.07651 57.28217  180.0 -0.000000      0.000000 0.68 
1 1 1 -66 0  10 o 133.3877 10.18636 144.9859  0.0   -0.000000      0.000000 1.00 
1 1 1 -66 0  11 o 31.38690 18.80920 42.58636  360.0 -0.000000      0.000000 0.56 
1 1 1 -66 0  12 o 89.13888 16.16572 87.71796  0.0   -0.000000      0.000000 1.00 
1 1 1 -66 0  13 o 227.1981 6.628519 250.2183  360.0 -0.000000      0.000000 1.00 
1 1 1 -66 0  14 o 122.5188 10.15331 108.8403  0.0   -0.000000      0.000000 1.00 
1 1 1 -66 0  15 o 67.96722 18.78702 125.2379  180.0 -0.000000      0.000000 1.00 
1 1 1 -66 0  16 o 38.31551 21.17194 9.951602  360.0 -0.000000      0.000000 0.18 
1 1 1 -66 0  17 o 36.45697 19.94381 77.64384  0.0   -0.000000      0.000000 0.88 
1 1 1 -66 0  18 o 74.70094 16.01064 137.4686  360.0 -0.000000      0.000000 1.00 
1 1 1 -66 0  19 o 158.2654 8.538477 219.5827  0.0   -0.000000      0.000000 1.00 
1 1 1 -66 0  20 o 32.90339 19.30403 84.57010  0.0   -0.000000      0.000000 0.88 
1 1 1 -66 0  21 o 41.44177 19.71429 61.94825  180.0 -0.000000      0.000000 0.86 
1 1 1 -66 0  22 o 126.9607 8.915783 196.7420  180.0 -0.000000      0.000000 1.00 
1 1 1 -66 0  23 o 17.31470 12.17757 17.33075  0.0   -0.000000      0.000000 0.20 
1 1 1 -66 0  24 o 59.76024 19.13704 103.4757  360.0 ?              ?        1.00 
1 1 1 -66 0  25 o 61.68163 15.87770 76.98680  0.0   ?              ?        1.00 
1 1 1 -66 2  1  o 69.70659 9.404473 83.82567  246.0 -31.72812      18.80895 0.92 
1 1 1 -66 2  2  o 29.10759 9.501028 46.01677  55.1  1.206192       19.00206 0.59 
1 1 1 -66 2  3  o 76.73606 7.784878 48.96027  331.8 -5.692444      15.56976 0.87 
1 1 1 -66 2  4  o 37.15162 10.93000 14.01664  99.1  5.434303       21.86000 0.26 
1 1 1 -66 2  5  o 64.78174 9.297829 42.06386  205.7 -12.88520      18.59566 0.81 
1 1 1 -66 2  6  f 39.13219 11.25138 74.91841  232.4 1.350327       22.50276 0.00 
1 1 1 -66 2  7  o 48.24587 11.71171 50.69409  221.8 -23.39988      23.42341 0.77 
1 1 1 -66 2  8  o 62.98009 11.36491 46.58757  91.9  -9.978710      22.72982 0.81 
1 1 1 -66 2  9  o 69.56684 10.40417 98.46533  32.7  -23.80441      20.80833 0.93 
1 1 1 -66 2  10 o 41.53926 11.48320 38.24017  137.0 14.06347       22.96641 0.63 
1 1 1 -66 2  11 o 68.93654 10.76511 49.27698  170.1 -32.21213      21.53023 0.85 
1 1 1 -66 2  12 o 64.18215 12.15602 108.1772  84.6  -11.57389      24.31204 0.93 
1 1 1 -66 2  13 f 34.31038 10.97967 37.11097  98.1  0.7192535      21.95933 0.00 
1 1 1 -66 2  14 o 45.50800 12.23383 36.57041  150.5 -1.550137      24.46766 0.65 
1 1 1 -66 2  15 o 64.92616 12.30278 87.87516  91.6  -21.97432      24.60556 0.91 
1 1 1 -66 2  16 o 133.4754 6.421237 183.5801  188.4 7.683319       12.84247 0.98 
1 1 1 -66 2  17 o 88.16512 9.263687 110.6447  207.1 -22.16582      18.52737 0.95 
1 1 1 -66 2  18 o 99.54334 8.175506 142.7088  239.2 10.68808       16.35101 0.97 
1 1 1 -66 2  19 o 59.57578 11.76406 67.78872  154.1 18.53770       23.52813 0.87 
1 1 1 -66 2  20 o 49.68853 11.41904 56.85666  98.1  -27.84342      22.83809 0.82 
1 1 1 -66 2  21 o 47.36863 10.00543 53.02356  359.1 37.88706       20.01087 0.81 
1 1 1 -66 2  22 o 45.12914 11.56963 66.78033  192.4 -0.5283165     23.13926 0.84 
1 1 1 -66 2  23 o 92.23673 8.055247 140.1736  231.1 ?              ?        0.97 
1 1 1 -66 2  24 o 84.26024 8.962947 136.0733  285.6 ?              ?        0.97 
1 1 1 -66 2  25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -66 4  1  o 56.41861 9.705237 81.52518  310.3 ?              ?        0.91 
1 1 1 -66 4  2  o 29.60184 9.355418 37.83657  100.9 ?              ?        0.56 
1 1 1 -66 4  3  f 39.56135 11.08742 64.79620  89.0  2.470142       22.17484 0.00 
1 1 1 -66 4  4  o 56.29712 11.31177 59.52917  229.0 -5.982891      22.62354 0.85 
1 1 1 -66 4  5  o 52.89744 11.00730 73.45939  307.7 7.186954       22.01459 0.87 
1 1 1 -66 4  6  o 45.15666 12.05598 63.65044  359.3 -4.350292      24.11196 0.80 
1 1 1 -66 4  7  o 44.86655 11.75424 60.86438  300.0 -6.866531      23.50848 0.79 
1 1 1 -66 4  8  o 64.96026 11.11697 53.49304  246.0 16.38401       22.23393 0.85 
1 1 1 -66 4  9  o 35.89482 11.04387 36.22237  267.6 1.652390       22.08774 0.56 
1 1 1 -66 4  10 o 97.10646 7.709779 124.5531  340.9 -4.131966      15.41956 0.96 
1 1 1 -66 4  11 o 42.32809 11.78306 103.8481  35.0  5.295052       23.56612 0.88 
1 1 1 -66 4  12 o 39.19402 11.08025 22.38361  54.5  12.86016       22.16049 0.43 
1 1 1 -66 4  13 o 55.37505 11.86857 67.54544  255.9 8.176464       23.73714 0.86 
1 1 1 -66 4  14 o 49.70000 12.22000 25.99336  258.0 7.835915       24.44000 0.56 
1 1 1 -66 4  15 f 49.87625 11.97674 74.86679  194.5 2.551373       23.95347 0.00 
1 1 1 -66 4  16 o 55.37460 14.08204 83.00160  200.9 -3.801426      28.16407 0.88 
1 1 1 -66 4  17 o 42.24435 11.85794 66.93301  211.6 -3.577930      23.71588 0.81 
1 1 1 -66 4  18 o 52.16109 12.06872 75.47013  356.3 -27.36051      24.13745 0.87 
1 1 1 -66 4  19 o 33.15183 10.48533 32.84548  355.8 -8.573353      20.97066 0.54 
1 1 1 -66 4  20 o 68.19251 11.73212 114.8371  286.2 40.34011       23.46423 0.94 
1 1 1 -66 4  21 o 50.46257 11.58743 91.72298  256.1 ?              ?        0.91 
1 1 1 -66 4  22 o 72.19726 9.416529 112.6955  245.5 ?              ?        0.96 
1 1 1 -66 4  23 x ?        ?        81.76572  73.2  ?              ?        0.00 
1 1 1 -66 6  4  x ?        ?        48.11930  47.3  ?              ?        0.00 
1 1 1 -66 6  5  o 36.87509 10.50534 7.608862  162.1 ?              ?        0.18 
1 1 1 -66 6  6  o 81.46549 9.147820 135.6384  350.1 ?              ?        0.97 
1 1 1 -66 6  7  o 32.42747 9.828279 12.12083  249.5 ?              ?        0.24 
1 1 1 -66 6  8  o 35.09448 10.52948 44.47098  110.6 0.1058655      21.05896 0.68 
1 1 1 -66 6  9  o 35.39716 10.72458 44.37475  291.8 8.772974       21.44915 0.68 
1 1 1 -66 6  10 o 38.42662 11.58242 45.54315  48.8  -10.20187      23.16484 0.70 
1 1 1 -66 6  11 o 54.26945 10.68783 40.53322  104.6 -22.78709      21.37567 0.78 
1 1 1 -66 6  12 o 54.46568 13.23028 67.02439  191.0 -17.94739      26.46057 0.86 
1 1 1 -66 6  13 o 43.91753 11.17285 36.44442  151.5 17.39270       22.34570 0.68 
1 1 1 -66 6  14 o 107.9282 8.617482 178.3150  84.8  -0.9777298     17.23496 0.98 
1 1 1 -66 6  15 o 46.21336 11.89218 94.57672  36.8  16.60825       23.78437 0.90 
1 1 1 -66 6  16 o 29.28058 9.705178 25.57389  317.4 ?              ?        0.44 
1 1 1 -66 6  17 o 42.50555 11.47413 91.56887  78.3  ?              ?        0.89 
1 1 1 -66 6  18 o 48.08650 12.12012 63.87960  291.9 ?              ?        0.86 
1 1 1 -66 6  19 o 107.5874 8.133163 171.1637  223.4 ?              ?        0.98 
1 1 1 -65 1  1  o 112.7218 6.122197 140.2585  199.8 0.5701294      12.24439 0.97 
1 1 1 -65 1  2  o 40.39242 10.79731 32.26924  75.8  -3.061638      21.59462 0.55 
1 1 1 -65 1  3  o 73.75629 9.386384 63.83683  354.4 -6.834824      18.77277 0.89 
1 1 1 -65 1  4  o 74.92607 8.094388 98.02527  19.3  -7.461723      16.18878 0.94 
1 1 1 -65 1  5  o 100.4994 6.494146 111.3892  30.6  -9.066887      12.98829 0.96 
1 1 1 -65 1  6  o 108.1112 6.521618 125.5900  312.1 11.40994       13.04324 0.97 
1 1 1 -65 1  7  o 40.57225 11.06777 84.10392  340.4 -4.229725      22.13553 0.83 
1 1 1 -65 1  8  o 61.49483 10.89788 56.93856  223.8 20.28668       21.79576 0.83 
1 1 1 -65 1  9  o 97.47038 7.381370 68.45355  220.4 9.471558       14.76274 0.92 
1 1 1 -65 1  10 o 100.7174 9.592851 141.0399  74.9  45.10956       19.18570 0.96 
1 1 1 -65 1  11 o 134.3692 6.673659 160.9977  44.9  3.217972       13.34732 0.98 
1 1 1 -65 1  12 o 123.4198 6.808175 132.7688  39.7  15.02197       13.61635 0.97 
1 1 1 -65 1  13 o 63.26336 12.72723 73.26235  181.7 -3.221539      25.45446 0.87 
1 1 1 -65 1  14 o 86.85503 8.672835 97.05956  306.7 5.792648       17.34567 0.94 
1 1 1 -65 1  15 o 159.4245 5.811656 177.8119  185.9 7.937454       11.62331 0.98 
1 1 1 -65 1  16 o 115.9879 7.584378 139.5661  142.4 21.84390       15.16876 0.97 
1 1 1 -65 1  17 o 75.29775 9.942608 97.68496  251.6 31.62120       19.88522 0.94 
1 1 1 -65 1  18 o 39.31987 11.77245 67.42998  260.6 8.004257       23.54490 0.80 
1 1 1 -65 1  19 o 39.30281 11.38942 29.81573  290.3 -7.244781      22.77884 0.54 
1 1 1 -65 1  20 o 75.75660 9.821371 96.83145  348.2 4.425888       19.64274 0.94 
1 1 1 -65 1  21 o 58.02780 11.84801 105.3814  343.5 -3.923492      23.69602 0.92 
1 1 1 -65 1  22 o 76.31934 8.604218 107.2448  237.5 -7.332275      17.20844 0.95 
1 1 1 -65 1  23 o 53.14564 10.10086 70.74503  192.2 36.87810       20.20173 0.88 
1 1 1 -65 1  24 o 38.55081 10.80496 84.28008  13.7  10.08622       21.60992 0.86 
1 1 1 -65 1  25 o 123.3378 6.401476 164.3238  10.8  ?              ?        0.98 
1 1 1 -65 1  26 o 52.58785 9.799397 94.40653  13.4  ?              ?        0.93 
1 1 1 -65 3  1  o 32.13092 9.594191 30.98125  31.8  16.43698       19.18838 0.48 
1 1 1 -65 3  2  o 89.00046 7.574811 114.4464  170.0 -8.460487      15.14962 0.96 
1 1 1 -65 3  3  f 71.69946 9.401655 82.22538  131.8 17.68950       18.80331 0.00 
1 1 1 -65 3  4  o 35.25534 10.40023 22.13354  51.2  4.975544       20.80045 0.38 
1 1 1 -65 3  5  o 35.11761 10.19675 29.09229  48.1  -9.342953      20.39351 0.48 
1 1 1 -65 3  6  o 85.14830 8.654119 87.02773  44.8  -25.15710      17.30824 0.94 
1 1 1 -65 3  7  o 100.0421 8.363230 126.9346  246.5 -25.90374      16.72646 0.96 
1 1 1 -65 3  8  o 137.9941 5.435394 185.0838  220.2 23.19309       10.87079 0.98 
1 1 1 -65 3  9  o 39.60115 11.42737 29.19224  312.2 -2.771111      22.85474 0.51 
1 1 1 -65 3  10 o 74.14618 9.991078 71.46974  339.1 -14.76955      19.98216 0.91 
1 1 1 -65 3  11 o 52.40915 12.11462 38.29761  146.9 -6.516701      24.22925 0.70 
1 1 1 -65 3  12 o 77.95594 9.347832 116.6233  102.1 2.973892       18.69566 0.95 
1 1 1 -65 3  13 o 65.53732 11.24214 79.61962  286.4 7.102459       22.48428 0.90 
1 1 1 -65 3  14 o 37.36536 11.48483 43.32141  196.7 -4.093502      22.96967 0.65 
1 1 1 -65 3  15 o 94.28959 8.826382 143.3206  94.3  -10.81635      17.65276 0.97 
1 1 1 -65 3  16 o 40.68296 11.87223 9.959068  254.2 -3.582138      23.74446 0.21 
1 1 1 -65 3  17 o 70.06207 10.30935 79.58229  245.1 50.22778       20.61871 0.92 
1 1 1 -65 3  18 o 108.0854 7.759446 125.1023  224.4 12.82793       15.51889 0.97 
1 1 1 -65 3  19 o 48.40943 13.14311 80.17958  227.9 7.380589       26.28621 0.86 
1 1 1 -65 3  20 o 58.02600 11.10555 79.90092  271.7 9.916275       22.21109 0.90 
1 1 1 -65 3  21 o 48.04341 11.34672 37.36090  94.3  -17.14961      22.69344 0.70 
1 1 1 -65 3  22 o 49.44908 11.46057 50.78067  151.7 8.861282       22.92114 0.80 
1 1 1 -65 3  23 o 78.00644 10.03666 87.79803  214.9 -16.29156      20.07333 0.94 
1 1 1 -65 3  24 o 127.4144 5.775177 192.2208  186.2 ?              ?        0.99 
1 1 1 -65 3  25 o 66.52718 9.390264 139.2369  174.9 ?              ?        0.96 
1 1 1 -65 5  1  o 80.64342 8.355680 119.4888  164.5 ?              ?        0.96 
1 1 1 -65 5  2  o 50.77275 10.92648 63.51513  242.2 ?              ?        0.85 
1 1 1 -65 5  3  o 42.94218 11.18698 36.01457  43.7  14.74327       22.37396 0.65 
1 1 1 -65 5  4  o 43.67408 11.11275 62.63063  20.6  -8.895462      22.22550 0.81 
1 1 1 -65 5  5  o 54.82098 10.37735 76.80456  40.8  -34.31725      20.75471 0.88 
1 1 1 -65 5  6  o 68.75991 10.67411 82.87601  23.8  28.24768       21.34823 0.91 
1 1 1 -65 5  7  o 54.61452 11.45438 72.28633  82.9  -7.792713      22.90877 0.87 
1 1 1 -65 5  8  o 100.7648 7.222808 115.0081  140.8 -5.501518      14.44562 0.96 
1 1 1 -65 5  9  o 89.52163 7.949645 119.5585  182.1 8.798264       15.89929 0.96 
1 1 1 -65 5  10 o 69.76741 10.71254 84.57299  186.8 6.420120       21.42507 0.92 
1 1 1 -65 5  11 o 113.1742 7.260347 123.1349  135.5 -1.537956      14.52069 0.97 
1 1 1 -65 5  12 o 30.48178 9.783749 35.84435  1.3   -11.92985      19.56750 0.52 
1 1 1 -65 5  13 o 59.35728 12.91238 98.53458  235.1 -19.18574      25.82477 0.91 
1 1 1 -65 5  14 o 119.1485 6.367601 134.0245  195.0 8.481216       12.73520 0.97 
1 1 1 -65 5  15 o 50.46449 11.77395 91.33170  149.0 -0.1972237     23.54790 0.89 
1 1 1 -65 5  16 o 46.53499 12.42955 84.55510  167.6 4.154720       24.85910 0.87 
1 1 1 -65 5  17 o 43.55188 12.88560 65.22240  137.3 -8.936905      25.77120 0.81 
1 1 1 -65 5  18 o 36.34806 10.93289 64.79757  38.9  -10.87756      21.86579 0.79 
1 1 1 -65 5  19 o 65.12236 10.79321 108.8978  339.2 34.05744       21.58642 0.94 
1 1 1 -65 5  20 o 47.17138 11.89312 60.67139  346.7 -5.286652      23.78625 0.83 
1 1 1 -65 5  21 o 52.87792 10.46480 71.15736  171.4 ?              ?        0.89 
1 1 1 -65 5  22 o 59.10876 11.14892 75.41009  234.4 ?              ?        0.91 
1 1 1 -65 5  23 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -65 7  4  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -65 7  5  o 34.44522 10.42935 16.81161  60.2  ?              ?        0.36 
1 1 1 -65 7  6  o 79.11499 7.687693 111.0718  102.0 ?              ?        0.96 
1 1 1 -65 7  7  o 66.10784 12.84132 100.0698  202.5 ?              ?        0.93 
1 1 1 -65 7  8  o 35.66418 10.82289 60.10674  246.5 ?              ?        0.78 
1 1 1 -65 7  9  o 46.54827 11.65739 20.27139  326.0 ?              ?        0.49 
1 1 1 -65 7  10 o 106.8388 6.990752 144.7901  120.5 11.11595       13.98150 0.98 
1 1 1 -65 7  11 o 85.55647 11.98645 138.2483  115.8 29.47935       23.97289 0.96 
1 1 1 -65 7  12 f 34.86182 10.48789 37.22990  304.5 0.8144951      20.97577 0.00 
1 1 1 -65 7  13 o 46.62106 11.94315 44.32106  91.3  ?              ?        0.76 
1 1 1 -65 7  14 o 161.5953 5.215296 194.1014  114.1 ?              ?        0.99 
1 1 1 -65 7  15 o 39.14056 10.91981 77.28344  75.7  ?              ?        0.86 
1 1 1 -65 7  16 o 33.49526 10.08231 54.27727  321.0 ?              ?        0.76 
1 1 1 -65 7  17 o 42.17637 11.60682 13.92462  16.9  ?              ?        0.36 
1 1 1 -65 7  18 o 31.10899 9.977968 46.87014  44.9  ?              ?        0.72 
1 1 1 -64 0  1  o 38.29858 18.84781 63.84071  180.0 -0.000000      0.000000 0.82 
1 1 1 -64 0  2  o 43.08466 18.25316 6.282560  360.0 -0.000000      0.000000 0.13 
1 1 1 -64 0  3  o 59.87174 19.39250 110.6763  360.0 -0.000000      0.000000 1.00 
1 1 1 -64 0  4  o 17.06987 12.14428 41.02250  360.0 -0.000000      0.000000 0.34 
1 1 1 -64 0  5  o 18.97722 13.34108 7.968848  180.0 -0.000000      0.000000 0.07 
1 1 1 -64 0  6  o 63.44517 15.20461 100.9209  180.0 -0.000000      0.000000 0.99 
1 1 1 -64 0  7  f 81.12718 13.14856 90.59200  180.0 -0.000000      0.000000 0.00 
1 1 1 -64 0  8  o 30.11176 17.31042 45.32725  180.0 -0.000000      0.000000 0.49 
1 1 1 -64 0  9  o 26.27662 17.21689 21.79829  360.0 -0.000000      0.000000 0.22 
1 1 1 -64 0  10 o 62.26446 19.98345 58.12595  180.0 -0.000000      0.000000 0.87 
1 1 1 -64 0  11 o 45.81614 21.22502 27.60104  180.0 -0.000000      0.000000 0.43 
1 1 1 -64 0  12 o 106.6841 12.99156 108.5423  180.0 -0.000000      0.000000 1.00 
1 1 1 -64 0  13 o 240.0449 6.345916 261.1265  180.0 -0.000000      0.000000 1.00 
1 1 1 -64 0  14 o 57.44360 20.43747 49.78941  0.0   -0.000000      0.000000 0.80 
1 1 1 -64 0  15 o 27.88838 17.32548 60.06094  180.0 -0.000000      0.000000 0.60 
1 1 1 -64 0  16 o 35.92951 19.79255 76.40704  180.0 -0.000000      0.000000 0.81 
1 1 1 -64 0  17 o 53.84335 22.14807 80.84071  180.0 -0.000000      0.000000 0.94 
1 1 1 -64 0  18 o 114.6897 8.707733 65.18684  0.0   -0.000000      0.000000 1.00 
1 1 1 -64 0  19 o 21.83663 14.82880 72.95071  0.0   -0.000000      0.000000 0.70 
1 1 1 -64 0  20 o 42.22586 20.00663 92.19511  360.0 -0.000000      0.000000 0.96 
1 1 1 -64 0  21 o 43.47602 18.79800 25.51410  180.0 -0.000000      0.000000 0.51 
1 1 1 -64 0  22 o 143.3298 7.679330 205.2181  180.0 -0.000000      0.000000 1.00 
1 1 1 -64 0  23 o 28.89134 17.29975 64.08372  180.0 -0.000000      0.000000 0.75 
1 1 1 -64 0  24 o 53.86202 20.91137 0.3533193 180.0 -0.000000      0.000000 0.01 
1 1 1 -64 0  25 o 21.66576 14.51213 69.16083  180.0 -0.000000      0.000000 0.74 
1 1 1 -64 0  26 o 27.02838 16.09190 18.41179  180.0 ?              ?        0.31 
1 1 1 -64 0  27 o 57.67502 19.26099 118.4229  0.0   ?              ?        1.00 
1 1 1 -64 2  1  o 95.61910 6.785715 111.5624  169.3 -1.792542      13.57143 0.96 
1 1 1 -64 2  2  o 40.90124 10.66291 82.06773  127.6 -6.628880      21.32582 0.84 
1 1 1 -64 2  3  o 87.31450 7.132746 110.9045  356.8 2.199074       14.26549 0.95 
1 1 1 -64 2  4  o 118.6424 6.079319 154.2047  332.0 -47.02929      12.15864 0.98 
1 1 1 -64 2  5  o 70.92733 8.415817 68.87368  97.7  19.12866       16.83163 0.89 
1 1 1 -64 2  6  o 37.93654 11.03729 52.05042  305.3 -11.14170      22.07458 0.66 
1 1 1 -64 2  7  o 189.0356 4.644988 252.3187  250.0 -2.993729      9.289976 0.99 
1 1 1 -64 2  8  o 78.64713 9.048853 146.4765  247.6 -61.32926      18.09771 0.95 
1 1 1 -64 2  9  o 99.17868 7.616580 101.5243  80.9  2.962074       15.23316 0.94 
1 1 1 -64 2  10 o 46.62666 10.44722 78.59812  228.3 -31.27585      20.89444 0.82 
1 1 1 -64 2  11 o 63.93044 12.08159 96.80522  279.3 -26.59176      24.16318 0.90 
1 1 1 -64 2  12 o 121.2956 6.520195 125.1929  44.4  31.83985       13.04039 0.96 
1 1 1 -64 2  13 o 94.16638 9.289079 139.7075  131.0 -8.842453      18.57816 0.96 
1 1 1 -64 2  14 o 80.76833 9.407008 104.1604  82.8  -9.161995      18.81402 0.93 
1 1 1 -64 2  15 o 38.91264 11.48953 42.41045  225.8 9.076397       22.97907 0.59 
1 1 1 -64 2  16 o 44.75533 12.15874 90.96238  51.5  7.410629       24.31748 0.85 
1 1 1 -64 2  17 o 44.11119 11.53112 36.78737  91.1  19.83025       23.06223 0.62 
1 1 1 -64 2  18 f 61.10291 11.99695 62.11245  121.2 4.483829       23.99389 0.00 
1 1 1 -64 2  19 o 65.13126 10.29597 95.11777  24.1  -0.6383591     20.59194 0.93 
1 1 1 -64 2  20 o 110.6850 6.251368 174.0541  312.3 -18.51974      12.50274 0.98 
1 1 1 -64 2  21 o 49.01319 11.03122 119.2888  352.4 18.13276       22.06244 0.92 
1 1 1 -64 2  22 o 31.17430 9.718394 59.14197  312.5 -11.59921      19.43679 0.72 
1 1 1 -64 2  23 o 95.67062 7.191795 112.2248  199.4 20.07022       14.38359 0.96 
1 1 1 -64 2  24 o 75.92352 8.832216 113.9361  177.6 -20.63060      17.66443 0.95 
1 1 1 -64 2  25 o 100.4245 6.629221 120.6575  265.6 -0.5675507     13.25844 0.97 
1 1 1 -64 2  26 o 105.8037 5.854609 160.2866  310.3 ?              ?        0.98 
1 1 1 -64 4  1  o 99.03868 6.412761 145.3376  256.0 -4.546494      12.82552 0.97 
1 1 1 -64 4  2  o 61.34956 11.18595 93.16141  291.1 7.009842       22.37191 0.91 
1 1 1 -64 4  3  o 102.8512 6.708976 146.1910  88.1  -4.459282      13.41795 0.97 
1 1 1 -64 4  4  o 68.67264 9.924260 103.0821  55.5  -38.99503      19.84852 0.93 
1 1 1 -64 4  5  o 36.93293 10.97893 43.28017  126.4 4.205746       21.95786 0.64 
1 1 1 -64 4  6  o 33.43565 10.16657 48.71149  71.5  10.38229       20.33314 0.66 
1 1 1 -64 4  7  o 35.31366 10.97373 32.30939  276.7 3.055954       21.94747 0.52 
1 1 1 -64 4  8  o 118.6041 5.743634 142.1290  197.9 -11.91485      11.48727 0.97 
1 1 1 -64 4  9  o 103.0398 7.950661 151.6899  184.0 -32.15726      15.90132 0.97 
1 1 1 -64 4  10 o 67.02597 9.825192 91.23457  215.0 21.33857       19.65038 0.92 
1 1 1 -64 4  11 o 107.6385 7.836230 131.0755  281.1 20.46598       15.67246 0.97 
1 1 1 -64 4  12 f 54.39758 11.59147 84.78068  0.0   1.785976       23.18294 0.00 
1 1 1 -64 4  13 o 118.0861 6.619324 157.3990  81.6  -20.63374      13.23865 0.98 
1 1 1 -64 4  14 o 118.7696 7.089432 148.8838  155.4 -5.339478      14.17886 0.98 
1 1 1 -64 4  15 o 105.7842 7.635538 121.6741  109.5 -9.585648      15.27108 0.97 
1 1 1 -64 4  16 o 97.40244 8.184052 120.6656  44.2  -27.07777      16.36810 0.96 
1 1 1 -64 4  17 o 49.05421 12.63372 35.99355  336.8 6.243553       25.26744 0.67 
1 1 1 -64 4  18 o 86.56670 9.754523 116.7851  171.9 -22.34542      19.50905 0.96 
1 1 1 -64 4  19 o 49.36516 11.97608 85.67088  89.9  -14.53581      23.95216 0.88 
1 1 1 -64 4  20 o 54.93000 13.40737 98.40856  62.6  -1.217278      26.81475 0.90 
1 1 1 -64 4  21 o 80.79724 9.782414 109.8183  125.3 18.34805       19.56483 0.95 
1 1 1 -64 4  22 o 36.27934 10.64145 67.66776  108.3 3.966988       21.28289 0.81 
1 1 1 -64 4  23 o 36.64639 10.65308 60.70678  42.9  -20.88540      21.30616 0.79 
1 1 1 -64 4  24 o 79.35800 8.773087 113.1792  115.8 ?              ?        0.96 
1 1 1 -64 4  25 o 41.29741 10.28366 87.21537  172.3 ?              ?        0.90 
1 1 1 -64 6  1  o 60.13397 10.03095 76.13864  18.0  ?              ?        0.91 
1 1 1 -64 6  2  o 41.05786 10.64579 61.20626  88.4  ?              ?        0.81 
1 1 1 -64 6  3  o 57.93125 11.14483 86.88322  164.4 -2.292809      22.28966 0.91 
1 1 1 -64 6  4  f 72.18686 10.07217 96.37483  244.6 14.96470       20.14433 0.00 
1 1 1 -64 6  5  o 35.20798 10.22266 81.89592  60.6  -18.22079      20.44533 0.83 
1 1 1 -64 6  6  o 38.10601 11.27904 46.57714  150.6 -3.312485      22.55809 0.68 
1 1 1 -64 6  7  o 106.2946 6.514849 150.3656  239.1 -0.1557846     13.02970 0.97 
1 1 1 -64 6  8  o 46.73375 11.53003 42.61596  207.2 -21.37077      23.06006 0.71 
1 1 1 -64 6  9  f 69.62476 11.63531 154.4845  70.1  4.943726       23.27063 0.00 
1 1 1 -64 6  10 o 34.07392 10.48001 13.61242  100.5 -6.258711      20.96001 0.25 
1 1 1 -64 6  11 o 51.67153 12.58084 65.03883  199.6 -10.19423      25.16168 0.84 
1 1 1 -64 6  12 o 31.03808 9.792617 9.179435  209.3 -14.60074      19.58523 0.16 
1 1 1 -64 6  13 o 68.06577 10.90833 129.4082  231.4 25.10412       21.81666 0.95 
1 1 1 -64 6  14 o 94.77119 10.00615 135.7407  229.4 24.05972       20.01230 0.97 
1 1 1 -64 6  15 o 56.93012 11.49306 110.9416  180.5 -16.50071      22.98612 0.92 
1 1 1 -64 6  16 o 40.12116 11.71482 84.84261  216.6 -10.98555      23.42964 0.85 
1 1 1 -64 6  17 o 32.29844 10.25137 77.38865  139.0 -6.033760      20.50274 0.81 
1 1 1 -64 6  18 o 94.56361 8.040837 136.4681  99.9  -4.191414      16.08167 0.97 
1 1 1 -64 6  19 o 37.45331 10.19673 42.88614  65.7  17.57057       20.39346 0.70 
1 1 1 -64 6  20 o 48.51257 12.79608 69.58809  212.3 2.260876       25.59216 0.86 
1 1 1 -64 6  21 o 50.10387 10.94865 94.29284  131.1 ?              ?        0.92 
1 1 1 -64 6  22 o 78.56482 10.57816 111.7620  133.3 ?              ?        0.96 
1 1 1 -64 8  6  x ?        ?        8.214767  249.0 ?              ?        0.00 
1 1 1 -64 8  7  o 32.11643 9.973193 25.42439  21.6  ?              ?        0.50 
1 1 1 -64 8  8  o 53.80085 10.96409 64.51408  201.3 ?              ?        0.88 
1 1 1 -64 8  9  o 47.45908 11.88397 63.99713  241.4 ?              ?        0.86 
1 1 1 -64 8  10 o 25.11234 8.591945 40.94843  99.5  ?              ?        0.59 
1 1 1 -64 8  11 o 72.67509 11.15781 102.4732  72.9  ?              ?        0.95 
1 1 1 -64 8  12 o 51.18716 11.78436 54.86832  324.0 ?              ?        0.84 
1 1 1 -64 8  13 o 37.61912 11.03705 29.13454  267.7 ?              ?        0.58 
1 1 1 -64 8  14 o 78.07581 10.02730 89.08896  107.8 ?              ?        0.95 
1 1 1 -64 8  15 o 65.51389 11.36732 67.19326  46.7  ?              ?        0.91 
1 1 1 -64 8  16 x ?        ?        95.74903  326.1 ?              ?        0.00 
1 1 1 -63 1  1  o 54.50837 10.45661 41.53125  3.7   3.714508       20.91322 0.75 
1 1 1 -63 1  2  o 40.46980 10.67952 54.63182  101.8 12.93752       21.35904 0.71 
1 1 1 -63 1  3  o 38.93136 10.76762 42.07045  36.2  -8.641079      21.53524 0.59 
1 1 1 -63 1  4  o 55.03476 10.75358 61.60859  331.1 9.060604       21.50715 0.80 
1 1 1 -63 1  5  o 62.25160 9.513824 118.1301  97.5  5.302048       19.02765 0.91 
1 1 1 -63 1  6  o 127.3794 5.501885 171.7144  91.3  -8.972984      11.00377 0.97 
1 1 1 -63 1  7  o 103.3623 6.440644 146.8339  153.6 11.36259       12.88129 0.96 
1 1 1 -63 1  8  o 78.83226 9.773578 98.79832  350.8 25.70020       19.54716 0.91 
1 1 1 -63 1  9  o 57.23396 10.95282 25.08202  171.1 10.23434       21.90565 0.45 
1 1 1 -63 1  10 o 318.9795 4.849883 339.3166  181.4 11.40103       9.699766 0.99 
1 1 1 -63 1  11 o 37.70198 11.09454 66.27824  182.7 -3.810368      22.18909 0.65 
1 1 1 -63 1  12 o 54.87444 12.02206 109.4261  13.4  5.178131       24.04412 0.87 
1 1 1 -63 1  13 o 69.07578 11.43440 104.8478  84.0  -45.36409      22.86880 0.90 
1 1 1 -63 1  14 o 130.9759 6.184640 127.6328  252.9 26.72540       12.36928 0.96 
1 1 1 -63 1  15 o 39.84462 11.34173 98.56544  238.5 -2.251709      22.68347 0.81 
1 1 1 -63 1  16 o 123.8710 6.987947 180.5705  66.4  18.53866       13.97589 0.97 
1 1 1 -63 1  17 o 112.5220 6.824417 191.0703  96.0  23.85297       13.64883 0.98 
1 1 1 -63 1  18 o 39.04346 11.19400 21.39509  100.7 6.368130       22.38799 0.35 
1 1 1 -63 1  19 o 89.21001 7.697781 114.2372  318.3 2.998962       15.39556 0.95 
1 1 1 -63 1  20 o 147.9538 5.921566 223.1325  231.8 -17.65535      11.84313 0.99 
1 1 1 -63 1  21 o 96.70413 7.241061 139.1358  175.9 16.20312       14.48212 0.97 
1 1 1 -63 1  22 f 79.95261 7.839898 142.3399  138.7 2.928291       15.67980 0.00 
1 1 1 -63 1  23 o 83.15248 8.134851 105.1292  116.5 20.74316       16.26970 0.95 
1 1 1 -63 1  24 o 66.15526 9.304561 94.03645  188.8 7.038475       18.60912 0.93 
1 1 1 -63 1  25 o 134.8219 5.567766 178.5079  221.8 0.9069824      11.13553 0.99 
1 1 1 -63 1  26 o 62.09470 10.32513 74.16377  257.6 -15.27517      20.65025 0.91 
1 1 1 -63 1  27 o 69.80682 9.765947 69.25288  0.4   ?              ?        0.92 
1 1 1 -63 3  1  o 47.38680 11.14598 71.05175  295.5 -16.75222      22.29196 0.84 
1 1 1 -63 3  2  o 68.15134 8.835322 119.4289  338.7 44.95306       17.67064 0.94 
1 1 1 -63 3  3  o 35.92545 9.393615 21.03961  164.1 17.92074       18.78723 0.37 
1 1 1 -63 3  4  o 101.0516 6.944211 99.46027  270.1 3.656563       13.88842 0.95 
1 1 1 -63 3  5  o 50.27355 10.24946 41.47300  239.9 23.06378       20.49892 0.68 
1 1 1 -63 3  6  o 94.03059 8.026983 109.2056  31.2  18.59634       16.05397 0.95 
1 1 1 -63 3  7  o 132.4174 5.726703 148.3882  19.1  -1.931702      11.45341 0.97 
1 1 1 -63 3  8  o 62.65269 9.895228 88.03109  207.4 -36.06258      19.79046 0.89 
1 1 1 -63 3  9  o 91.28053 7.544771 135.7220  182.9 -2.692284      15.08954 0.95 
1 1 1 -63 3  10 o 161.5229 5.255372 189.5511  285.7 7.903473       10.51074 0.98 
1 1 1 -63 3  11 o 104.9380 6.473769 79.07076  293.8 -1.050743      12.94754 0.93 
1 1 1 -63 3  12 o 90.89905 8.968541 114.4401  97.4  5.529015       17.93708 0.94 
1 1 1 -63 3  13 o 153.7007 5.358029 180.8826  83.0  -5.329422      10.71606 0.98 
1 1 1 -63 3  14 o 143.1370 5.530294 181.3352  97.5  -1.460693      11.06059 0.98 
1 1 1 -63 3  15 o 29.00253 9.814949 13.39990  35.8  -1.989466      19.62990 0.17 
1 1 1 -63 3  16 o 63.31945 12.18926 103.2027  21.1  -1.925991      24.37852 0.91 
1 1 1 -63 3  17 o 75.36719 9.977828 78.63591  63.3  25.80865       19.95566 0.91 
1 1 1 -63 3  18 o 59.21596 10.29296 81.84936  83.6  36.96377       20.58592 0.89 
1 1 1 -63 3  19 o 88.43825 8.655828 150.2294  72.6  26.58910       17.31166 0.97 
1 1 1 -63 3  20 o 39.74193 11.33823 61.39332  328.3 -1.797161      22.67645 0.79 
1 1 1 -63 3  21 o 60.32276 11.45897 53.65084  203.6 -22.09207      22.91794 0.84 
1 1 1 -63 3  22 o 45.17836 10.78854 18.36260  171.6 -17.32306      21.57709 0.42 
1 1 1 -63 3  23 o 42.25733 10.78120 32.94019  44.8  -22.26009      21.56241 0.61 
1 1 1 -63 3  24 o 34.48233 10.07943 59.79988  84.0  9.091194       20.15885 0.77 
1 1 1 -63 3  25 o 53.22855 11.17191 85.04065  124.3 3.035416       22.34381 0.91 
1 1 1 -63 3  26 o 78.99778 8.588128 71.38899  116.4 ?              ?        0.94 
1 1 1 -63 3  27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -63 5  1  f 89.00859 7.256882 145.9505  338.2 -19.45857      14.51376 0.00 
1 1 1 -63 5  2  o 30.06022 9.557957 75.54240  86.0  -1.757851      19.11591 0.76 
1 1 1 -63 5  3  o 48.22382 9.873262 75.35630  232.1 -30.98037      19.74652 0.86 
1 1 1 -63 5  4  o 70.45372 9.058477 125.4978  276.2 -21.24258      18.11695 0.95 
1 1 1 -63 5  5  o 36.83110 10.78913 39.68008  22.6  1.960468       21.57827 0.61 
1 1 1 -63 5  6  o 36.61072 10.65512 37.11724  221.3 3.311481       21.31025 0.59 
1 1 1 -63 5  7  o 123.3184 6.325104 190.6453  299.7 14.41931       12.65021 0.98 
1 1 1 -63 5  8  o 68.77802 9.587745 88.19623  334.2 -16.03542      19.17549 0.92 
1 1 1 -63 5  9  o 117.2330 6.797141 126.1479  101.2 1.524582       13.59428 0.97 
1 1 1 -63 5  10 o 126.8131 5.889082 138.0167  135.0 -8.668907      11.77816 0.98 
1 1 1 -63 5  11 o 62.09197 10.37787 45.06309  276.1 -3.836536      20.75574 0.81 
1 1 1 -63 5  12 o 72.74820 10.34762 90.76588  50.7  -2.611427      20.69523 0.93 
1 1 1 -63 5  13 o 82.70134 9.802115 104.1504  59.3  -3.909500      19.60423 0.95 
1 1 1 -63 5  14 o 129.9613 5.751719 194.5402  316.2 28.71788       11.50344 0.98 
1 1 1 -63 5  15 o 61.71342 10.45656 31.04784  279.2 22.92161       20.91313 0.73 
1 1 1 -63 5  16 o 36.08581 11.01633 53.86832  135.0 -18.12134      22.03266 0.72 
1 1 1 -63 5  17 o 66.08831 13.84910 70.92079  307.0 -6.641476      27.69820 0.89 
1 1 1 -63 5  18 o 27.39686 9.288637 57.75452  156.0 -1.164181      18.57727 0.68 
1 1 1 -63 5  19 o 118.6194 5.992857 159.3584  80.4  -0.6147614     11.98571 0.98 
1 1 1 -63 5  20 o 27.21306 9.083958 31.54224  41.1  -10.38950      18.16792 0.46 
1 1 1 -63 5  21 o 52.60789 11.24210 48.55420  283.4 15.84647       22.48420 0.80 
1 1 1 -63 5  22 o 58.24097 11.07227 98.11084  134.3 -18.52622      22.14454 0.92 
1 1 1 -63 5  23 o 55.56684 10.49978 81.16569  206.2 21.48265       20.99957 0.91 
1 1 1 -63 5  24 o 76.14078 8.587316 122.1875  186.9 ?              ?        0.96 
1 1 1 -63 5  25 x ?        ?        58.42487  303.3 ?              ?        0.00 
1 1 1 -63 7  1  o 37.27110 10.70932 24.46013  165.2 ?              ?        0.51 
1 1 1 -63 7  2  o 35.42166 10.34111 15.38507  142.3 ?              ?        0.33 
1 1 1 -63 7  3  o 47.60048 11.49764 37.11417  145.7 14.89470       22.99528 0.71 
1 1 1 -63 7  4  o 33.92133 10.37342 41.22994  302.3 -0.1380463     20.74683 0.64 
1 1 1 -63 7  5  o 34.31679 10.11197 61.38609  349.8 -2.214272      20.22394 0.76 
1 1 1 -63 7  6  o 65.65625 10.72567 36.77415  2.3   -30.48071      21.45134 0.79 
1 1 1 -63 7  7  o 46.81376 13.28888 19.04078  328.3 5.290489       26.57777 0.41 
1 1 1 -63 7  8  o 65.96039 9.718984 95.53272  142.2 -45.01909      19.43797 0.93 
1 1 1 -63 7  9  o 73.81451 10.06576 101.7423  22.9  -31.87675      20.13153 0.94 
1 1 1 -63 7  10 o 142.1655 5.649156 184.2670  324.5 15.56470       11.29831 0.99 
1 1 1 -63 7  11 o 65.51879 11.07921 111.2252  200.7 22.74950       22.15842 0.94 
1 1 1 -63 7  12 o 88.91603 9.097834 158.2541  187.5 34.95232       18.19567 0.97 
1 1 1 -63 7  13 o 86.46716 8.248942 149.7004  262.3 -6.964058      16.49788 0.97 
1 1 1 -63 7  14 o 50.75822 11.97164 94.88569  296.1 4.379414       23.94327 0.90 
1 1 1 -63 7  15 f 38.12212 10.48079 116.5450  201.9 16.23686       20.96157 0.00 
1 1 1 -63 7  16 o 47.95586 11.26350 89.82380  202.4 4.338406       22.52701 0.89 
1 1 1 -63 7  17 o 53.78609 11.07541 94.79482  152.9 20.17688       22.15083 0.91 
1 1 1 -63 7  18 o 46.37091 11.87443 67.27731  61.3  2.545471       23.74885 0.85 
1 1 1 -63 7  19 o 105.2036 6.538446 193.1934  356.1 ?              ?        0.98 
1 1 1 -63 7  20 o 36.07417 11.07641 10.93411  295.5 ?              ?        0.25 
1 1 1 -63 7  21 o 44.92497 12.10864 65.32619  29.7  ?              ?        0.86 
1 1 1 -63 9  9  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -63 9  10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -63 9  11 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -63 9  12 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -63 9  13 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -62 0  1  o 18.35679 12.70968 26.67174  360.0 -0.000000      0.000000 0.22 
1 1 1 -62 0  2  o 103.0177 9.655176 167.6065  180.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  3  o 92.04560 8.544411 95.34890  180.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  4  o 139.3703 6.864052 183.1071  360.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  5  o 80.89568 11.57434 45.99104  360.0 -0.000000      0.000000 0.87 
1 1 1 -62 0  6  o 25.90742 15.75711 49.38760  180.0 -0.000000      0.000000 0.40 
1 1 1 -62 0  7  o 58.65759 18.37194 140.2519  180.0 -0.000000      0.000000 0.99 
1 1 1 -62 0  8  o 21.11923 14.66190 46.73503  360.0 -0.000000      0.000000 0.30 
1 1 1 -62 0  9  o 45.59792 20.79677 4.629604  0.0   -0.000000      0.000000 0.06 
1 1 1 -62 0  10 o 25.08358 16.25042 31.33488  180.0 -0.000000      0.000000 0.23 
1 1 1 -62 0  11 f 150.8875 8.185456 93.39537  180.0 -0.000000      0.000000 0.00 
1 1 1 -62 0  12 o 52.86946 23.20072 108.4010  180.0 -0.000000      0.000000 0.92 
1 1 1 -62 0  13 o 109.2900 9.580685 94.52020  0.0   -0.000000      0.000000 1.00 
1 1 1 -62 0  14 o 24.08547 16.07318 25.32855  180.0 -0.000000      0.000000 0.19 
1 1 1 -62 0  15 f 240.0304 5.936926 239.5019  360.0 -0.000000      0.000000 0.00 
1 1 1 -62 0  16 o 158.9570 8.557416 246.5228  0.0   -0.000000      0.000000 1.00 
1 1 1 -62 0  17 o 93.55755 10.19427 95.50579  180.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  18 o 208.4259 6.457461 254.0680  180.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  19 o 38.57058 20.88061 25.16841  0.0   -0.000000      0.000000 0.36 
1 1 1 -62 0  20 o 54.26425 17.80992 73.26368  180.0 -0.000000      0.000000 0.94 
1 1 1 -62 0  21 o 25.63279 16.53564 87.17707  360.0 -0.000000      0.000000 0.80 
1 1 1 -62 0  22 o 25.12166 16.26646 66.99570  180.0 -0.000000      0.000000 0.72 
1 1 1 -62 0  23 o 124.7640 9.152202 100.1578  180.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  24 o 66.83141 13.32391 49.65135  180.0 -0.000000      0.000000 0.96 
1 1 1 -62 0  25 o 36.34843 17.84722 69.12138  180.0 -0.000000      0.000000 0.87 
1 1 1 -62 0  26 o 81.03880 11.53523 99.55624  180.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  27 o 86.38611 10.33774 104.4557  360.0 -0.000000      0.000000 1.00 
1 1 1 -62 0  28 o 13.60999 10.04949 19.24309  360.0 ?              ?        0.21 
1 1 1 -62 2  1  o 29.28621 9.255945 31.60436  313.9 -0.2901478     18.51189 0.41 
1 1 1 -62 2  2  o 77.30996 7.917021 79.44978  257.6 26.23825       15.83404 0.91 
1 1 1 -62 2  3  f 72.41139 8.075798 90.87288  140.3 -5.993065      16.15160 0.00 
1 1 1 -62 2  4  o 60.08832 10.01134 49.02441  339.7 16.58722       20.02269 0.75 
1 1 1 -62 2  5  o 81.41170 8.104827 91.05868  343.7 -24.23841      16.20965 0.91 
1 1 1 -62 2  6  f 67.02873 9.683108 120.1042  68.4  -22.95325      19.36622 0.00 
1 1 1 -62 2  7  o 34.87381 10.06193 8.074626  277.3 -16.17429      20.12386 0.10 
1 1 1 -62 2  8  o 87.14226 6.712016 101.9822  49.1  9.337700       13.42403 0.92 
1 1 1 -62 2  9  o 44.54829 10.75566 5.707861  82.5  -24.93385      21.51133 0.08 
1 1 1 -62 2  10 o 81.92375 7.880923 131.7207  161.6 -1.811287      15.76185 0.93 
1 1 1 -62 2  11 o 76.91864 11.19840 73.39918  89.6  -31.52330      22.39681 0.85 
1 1 1 -62 2  12 o 89.32787 8.596710 54.89164  324.2 -27.12997      17.19342 0.83 
1 1 1 -62 2  13 o 71.33051 11.03825 122.5215  42.5  17.71593       22.07649 0.91 
1 1 1 -62 2  14 o 78.46961 10.78366 65.06178  305.4 12.21329       21.56733 0.84 
1 1 1 -62 2  15 o 159.6085 5.593524 190.2283  242.7 3.201462       11.18705 0.98 
1 1 1 -62 2  16 o 47.27157 11.76150 28.53657  66.1  -7.373882      23.52300 0.45 
1 1 1 -62 2  17 o 65.79935 10.97345 113.7480  60.1  11.60981       21.94689 0.91 
1 1 1 -62 2  18 o 52.36898 11.93539 58.03531  145.5 -11.67145      23.87078 0.77 
1 1 1 -62 2  19 f 63.33049 10.39264 43.24525  160.6 34.80661       20.78529 0.00 
1 1 1 -62 2  20 o 123.9369 5.819912 194.9700  222.3 -0.5048294     11.63982 0.98 
1 1 1 -62 2  21 o 39.05271 9.861118 35.76709  193.0 24.84966       19.72224 0.60 
1 1 1 -62 2  22 o 63.73543 10.52483 125.8313  68.4  -16.14815      21.04966 0.94 
1 1 1 -62 2  23 o 101.0326 6.435437 142.3517  122.9 11.33391       12.87087 0.97 
1 1 1 -62 2  24 o 87.76961 7.989834 130.4693  177.7 -3.385231      15.97967 0.96 
1 1 1 -62 2  25 o 30.69522 9.875523 2.505828  74.8  -0.7377243     19.75105 0.05 
1 1 1 -62 2  26 o 78.89676 8.343616 107.0779  132.6 19.40179       16.68723 0.96 
1 1 1 -62 2  27 o 29.76274 9.403024 16.22193  81.9  ?              ?        0.32 
1 1 1 -62 2  28 o 28.81017 9.291789 31.22447  328.2 ?              ?        0.56 
1 1 1 -62 4  1  o 33.85331 9.755193 75.54443  36.5  -5.086405      19.51039 0.79 
1 1 1 -62 4  2  o 50.92314 10.56938 88.11764  321.5 5.188316       21.13877 0.89 
1 1 1 -62 4  3  o 116.2641 5.529143 169.4809  256.3 19.47123       11.05829 0.98 
1 1 1 -62 4  4  o 40.19123 11.37525 53.85298  329.1 3.891754       22.75050 0.70 
1 1 1 -62 4  5  o 122.6410 5.180646 147.8669  342.0 1.026581       10.36129 0.97 
1 1 1 -62 4  6  o 41.65259 11.65656 93.58192  340.7 5.038593       23.31311 0.83 
1 1 1 -62 4  7  o 130.9254 5.475272 175.3162  14.6  10.19171       10.95054 0.98 
1 1 1 -62 4  8  o 87.05481 8.483438 96.13867  332.6 8.352943       16.96688 0.93 
1 1 1 -62 4  9  o 46.28080 11.45635 48.48307  68.2  -7.191860      22.91269 0.66 
1 1 1 -62 4  10 o 64.01006 10.78352 71.34206  31.9  7.064049       21.56704 0.85 
1 1 1 -62 4  11 o 125.5321 5.792822 124.5220  233.4 -44.14330      11.58564 0.96 
1 1 1 -62 4  12 o 93.96757 7.601591 95.19061  243.6 -34.40404      15.20318 0.93 
1 1 1 -62 4  13 o 79.46110 9.132990 105.3696  44.7  14.11938       18.26598 0.93 
1 1 1 -62 4  14 o 49.51112 12.45357 13.65816  11.4  5.802429       24.90714 0.27 
1 1 1 -62 4  15 o 38.00001 11.04127 79.64628  286.1 3.235855       22.08253 0.78 
1 1 1 -62 4  16 o 34.03863 10.45936 58.36302  266.7 -11.11752      20.91871 0.67 
1 1 1 -62 4  17 o 41.24957 11.48623 66.18679  20.5  -10.54271      22.97246 0.77 
1 1 1 -62 4  18 o 118.0406 6.877527 168.9039  347.9 12.90437       13.75505 0.98 
1 1 1 -62 4  19 o 49.38977 12.42287 68.97209  279.7 -8.174652      24.84574 0.84 
1 1 1 -62 4  20 o 42.50217 12.84326 75.07233  142.6 -11.48774      25.68652 0.83 
1 1 1 -62 4  21 o 48.59834 11.99574 89.38333  284.9 -13.30507      23.99148 0.89 
1 1 1 -62 4  22 o 42.29935 10.00969 59.74872  300.2 20.70464       20.01938 0.81 
1 1 1 -62 4  23 o 53.83829 10.62163 98.77760  160.9 -3.290295      21.24325 0.91 
1 1 1 -62 4  24 o 67.80175 9.967765 57.79652  350.5 8.098415       19.93553 0.89 
1 1 1 -62 4  25 o 85.60934 7.768527 161.1751  346.6 1.811562       15.53705 0.97 
1 1 1 -62 4  26 o 66.10195 9.013795 64.00332  65.4  ?              ?        0.92 
1 1 1 -62 4  27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -62 6  1  f 50.53816 9.741671 81.22627  3.1   2.866817       19.48334 0.00 
1 1 1 -62 6  2  o 48.07529 10.49310 4.912743  91.4  -24.69440      20.98621 0.13 
1 1 1 -62 6  3  o 41.46919 10.49553 58.30494  290.4 28.56858       20.99106 0.78 
1 1 1 -62 6  4  o 49.43033 10.86965 75.10501  87.6  14.16121       21.73930 0.86 
1 1 1 -62 6  5  o 102.5419 7.181907 161.5115  94.3  -7.502121      14.36381 0.97 
1 1 1 -62 6  6  o 33.59502 10.14781 38.01093  141.8 -14.82260      20.29563 0.58 
1 1 1 -62 6  7  o 50.81866 12.06343 46.12698  233.3 -2.104168      24.12686 0.76 
1 1 1 -62 6  8  o 54.18960 11.43478 77.64648  208.9 19.89653       22.86957 0.88 
1 1 1 -62 6  9  o 48.10380 10.55094 36.92329  284.4 21.84927       21.10188 0.69 
1 1 1 -62 6  10 o 59.66351 12.10045 114.1341  53.7  -20.43689      24.20090 0.93 
1 1 1 -62 6  11 o 116.4928 6.285239 127.6030  50.2  -0.1508408     12.57048 0.97 
1 1 1 -62 6  12 f 52.84241 10.68396 38.72970  73.0  -32.26380      21.36792 0.00 
1 1 1 -62 6  13 o 44.79185 11.10468 77.58132  356.5 -22.79724      22.20935 0.86 
1 1 1 -62 6  14 o 148.7464 5.769697 199.1694  19.8  -1.972916      11.53939 0.99 
1 1 1 -62 6  15 o 54.17304 12.01588 65.21342  165.4 6.058037       24.03175 0.86 
1 1 1 -62 6  16 o 83.21149 8.084208 81.43510  81.9  -23.98661      16.16842 0.94 
1 1 1 -62 6  17 o 139.3737 6.263100 201.0537  352.1 -0.7740631     12.52620 0.99 
1 1 1 -62 6  18 o 33.12004 10.52679 59.38219  296.9 -10.50613      21.05358 0.74 
1 1 1 -62 6  19 o 46.34811 12.09430 66.12162  19.6  -9.741497      24.18859 0.83 
1 1 1 -62 6  20 o 70.84267 10.17318 130.5684  347.7 5.172874       20.34636 0.95 
1 1 1 -62 6  21 o 78.36243 9.478905 109.5743  315.0 -24.73275      18.95781 0.95 
1 1 1 -62 6  22 o 38.75224 11.39425 73.41639  23.8  -8.431789      22.78851 0.84 
1 1 1 -62 6  23 o 76.17772 8.600691 116.8226  43.9  ?              ?        0.96 
1 1 1 -62 6  24 f 32.30839 9.912438 66.94462  147.7 ?              ?        0.00 
1 1 1 -62 8  2  o 73.76246 9.296092 75.98714  25.7  ?              ?        0.93 
1 1 1 -62 8  3  o 26.37258 8.658520 66.42328  246.4 ?              ?        0.76 
1 1 1 -62 8  4  o 37.00916 11.30693 19.85683  341.8 ?              ?        0.41 
1 1 1 -62 8  5  o 55.79359 11.88260 97.50325  58.1  -27.20375      23.76521 0.92 
1 1 1 -62 8  6  o 45.37788 10.91921 45.17419  48.9  17.16187       21.83842 0.76 
1 1 1 -62 8  7  o 58.06169 11.71386 82.26215  314.9 -3.205997      23.42773 0.90 
1 1 1 -62 8  8  o 28.94795 9.701935 66.87390  6.6   -2.355595      19.40387 0.75 
1 1 1 -62 8  9  f 65.15611 9.725780 79.84533  334.7 -30.63689      19.45156 0.00 
1 1 1 -62 8  10 o 72.83311 9.891076 77.28020  348.0 -32.19729      19.78215 0.92 
1 1 1 -62 8  11 o 43.36864 11.78930 13.98799  207.5 -12.26947      23.57859 0.32 
1 1 1 -62 8  12 o 43.26517 11.25923 80.23053  194.1 4.369202       22.51847 0.86 
1 1 1 -62 8  13 o 102.6377 7.910302 167.1542  236.6 24.48641       15.82060 0.98 
1 1 1 -62 8  14 o 47.38545 9.618002 77.05580  241.2 36.65990       19.23600 0.88 
1 1 1 -62 8  15 o 54.49185 10.29425 12.75242  146.3 23.08878       20.58850 0.40 
1 1 1 -62 8  16 o 41.62283 10.85587 99.58722  78.9  14.74514       21.71174 0.90 
1 1 1 -62 8  17 o 36.93400 11.04113 83.67574  135.8 0.4007645      22.08226 0.86 
1 1 1 -62 8  18 o 44.42193 11.68463 77.67608  74.5  ?              ?        0.88 
1 1 1 -62 8  19 o 72.30119 10.66165 103.6707  10.1  ?              ?        0.95 
1 1 1 -62 8  20 o 37.43246 11.00290 40.81057  5.0   ?              ?        0.72 
1 1 1 -61 1  1  o 81.19125 7.555397 122.8774  168.2 0.1142349      15.11079 0.94 
1 1 1 -61 1  2  o 115.3536 5.646575 51.95744  20.9  -6.493347      11.29315 0.89 
1 1 1 -61 1  3  o 28.62810 9.214531 43.99031  168.3 -1.227541      18.42906 0.40 
1 1 1 -61 1  4  o 59.02507 8.916749 27.29293  300.0 38.24480       17.83350 0.47 
1 1 1 -61 1  5  o 159.7321 4.738226 206.3768  282.0 -14.27635      9.476452 0.98 
1 1 1 -61 1  6  o 51.85105 10.14118 84.44818  267.4 -27.31635      20.28236 0.78 
1 1 1 -61 1  7  o 124.9012 5.599082 150.4130  22.3  -2.190880      11.19816 0.96 
1 1 1 -61 1  8  o 310.0346 4.098294 389.6495  348.8 -9.898926      8.196589 0.99 
1 1 1 -61 1  9  o 118.1079 6.260266 152.2713  306.4 -18.60922      12.52053 0.95 
1 1 1 -61 1  10 f 80.47655 10.98396 93.72145  80.8  16.50052       21.96792 0.00 
1 1 1 -61 1  11 o 38.10357 10.92314 51.24540  2.8   4.627995       21.84628 0.48 
1 1 1 -61 1  12 o 90.21126 7.269368 78.01827  226.2 -12.45185      14.53874 0.87 
1 1 1 -61 1  13 o 133.6225 6.257583 176.4607  3.1   22.50517       12.51517 0.97 
1 1 1 -61 1  14 o 85.23075 9.086126 148.0753  62.0  1.998764       18.17225 0.93 
1 1 1 -61 1  15 o 68.89825 11.28440 64.03671  302.9 -15.69960      22.56880 0.78 
1 1 1 -61 1  16 o 186.0396 4.356789 240.2748  289.7 -0.9697418     8.713577 0.98 
1 1 1 -61 1  17 o 40.16433 9.637498 62.29564  140.8 32.95537       19.27500 0.65 
1 1 1 -61 1  18 o 112.2889 6.185341 98.01654  140.1 7.269363       12.37068 0.94 
1 1 1 -61 1  19 o 47.55128 11.59689 93.68537  8.3   -13.91467      23.19378 0.84 
1 1 1 -61 1  20 o 29.67483 9.529028 18.70214  102.0 3.132320       19.05806 0.24 
1 1 1 -61 1  21 o 119.9584 5.705483 141.3447  290.1 -7.156494      11.41097 0.97 
1 1 1 -61 1  22 o 27.23283 8.965638 48.34194  293.4 -9.499434      17.93128 0.57 
1 1 1 -61 1  23 o 68.68851 10.00735 129.5153  131.8 29.66465       20.01470 0.95 
1 1 1 -61 1  24 o 91.14157 7.374012 129.1627  132.0 23.34397       14.74802 0.97 
1 1 1 -61 1  25 o 35.39561 9.966275 24.92719  233.5 11.47830       19.93255 0.46 
1 1 1 -61 1  26 o 64.70517 9.642200 110.0034  208.8 -2.887234      19.28440 0.94 
1 1 1 -61 1  27 o 44.20785 10.67070 80.88277  89.7  -16.50396      21.34139 0.88 
1 1 1 -61 1  28 o 51.04292 11.89707 91.50972  124.9 ?              ?        0.91 
1 1 1 -61 1  29 f 35.07399 10.08900 45.37783  354.5 ?              ?        0.00 
1 1 1 -61 3  1  o 36.31950 10.39452 43.15620  143.5 9.139589       20.78904 0.57 
1 1 1 -61 3  2  o 72.08447 8.268217 91.46043  22.3  -19.44108      16.53643 0.91 
1 1 1 -61 3  3  o 48.38524 10.88879 66.88242  38.5  15.40075       21.77758 0.77 
1 1 1 -61 3  4  o 36.29240 9.898341 61.14281  335.4 16.78839       19.79668 0.63 
1 1 1 -61 3  5  o 136.9856 5.214453 163.0051  280.0 -8.375839      10.42891 0.97 
1 1 1 -61 3  6  o 84.00528 8.560645 130.2352  12.7  -35.99493      17.12129 0.93 
1 1 1 -61 3  7  o 82.74094 9.391717 112.6748  40.4  0.5192642      18.78343 0.92 
1 1 1 -61 3  8  f 204.6210 4.252572 213.7363  107.9 19.20717       8.505143 0.00 
1 1 1 -61 3  9  o 109.3964 6.896496 114.4041  32.9  -10.43925      13.79299 0.94 
1 1 1 -61 3  10 o 37.71746 10.47785 57.81247  256.2 0.9100647      20.95571 0.56 
1 1 1 -61 3  11 o 62.23560 10.49606 99.41602  200.7 -12.08773      20.99212 0.86 
1 1 1 -61 3  12 o 81.86836 10.43468 61.16442  294.3 9.679573       20.86937 0.82 
1 1 1 -61 3  13 o 69.75911 9.192721 59.75963  292.0 -73.81145      18.38544 0.79 
1 1 1 -61 3  14 f 100.2253 7.609104 138.0724  301.6 -1.690117      15.21821 0.00 
1 1 1 -61 3  15 f 182.0741 4.980976 264.8135  309.5 18.10118       9.961951 0.00 
1 1 1 -61 3  16 o 98.69500 8.509043 108.1662  326.1 7.925446       17.01809 0.94 
1 1 1 -61 3  17 o 112.7587 7.033013 160.4326  342.4 27.06247       14.06603 0.97 
1 1 1 -61 3  18 o 36.06216 10.46009 71.18043  294.4 7.222599       20.92019 0.72 
1 1 1 -61 3  19 o 63.14057 10.42143 89.44984  296.4 33.16367       20.84286 0.89 
1 1 1 -61 3  20 o 103.0499 6.856218 170.7518  35.5  25.20708       13.71244 0.97 
1 1 1 -61 3  21 o 67.66957 9.366642 95.35664  358.4 23.61837       18.73328 0.93 
1 1 1 -61 3  22 o 66.74210 10.09188 94.46436  311.1 17.47017       20.18377 0.93 
1 1 1 -61 3  23 f 28.76549 9.262853 26.83596  85.6  -1.633245      18.52571 0.00 
1 1 1 -61 3  24 o 33.55107 10.10195 9.687389  268.7 -1.353653      20.20390 0.19 
1 1 1 -61 3  25 o 95.80534 7.046680 140.0279  11.1  11.30141       14.09336 0.97 
1 1 1 -61 3  26 o 65.94176 10.09094 75.24928  120.9 17.70766       20.18188 0.92 
1 1 1 -61 3  27 o 108.4737 6.048187 148.0680  122.4 ?              ?        0.98 
1 1 1 -61 3  28 f 41.00505 10.63253 44.35833  100.4 ?              ?        0.00 
1 1 1 -61 5  1  o 59.98608 9.279058 98.36435  152.2 20.46861       18.55812 0.92 
1 1 1 -61 5  2  o 85.41666 6.847742 83.34064  109.1 -0.4165192     13.69548 0.94 
1 1 1 -61 5  3  o 30.70361 9.701230 53.45486  148.3 -4.321404      19.40246 0.64 
1 1 1 -61 5  4  o 36.42783 10.58319 75.20328  102.7 12.08869       21.16637 0.77 
1 1 1 -61 5  5  o 66.97849 8.915504 71.56100  115.2 -44.47751      17.83101 0.88 
1 1 1 -61 5  6  o 86.50864 8.314879 145.3382  187.2 20.47349       16.62976 0.96 
1 1 1 -61 5  7  f 42.38685 10.68267 100.2090  131.6 -23.19320      21.36534 0.00 
1 1 1 -61 5  8  o 70.49440 11.11034 102.4527  288.7 4.568375       22.22068 0.91 
1 1 1 -61 5  9  f 158.5271 4.738704 176.9967  283.2 -12.50066      9.477408 0.00 
1 1 1 -61 5  10 o 49.09926 11.94474 63.44831  56.5  14.62853       23.88947 0.76 
1 1 1 -61 5  11 o 39.67941 10.82736 37.66980  59.8  10.43906       21.65472 0.52 
1 1 1 -61 5  12 o 90.77696 8.340423 124.4740  173.1 -16.10269      16.68085 0.95 
1 1 1 -61 5  13 o 84.40714 8.940962 101.2227  152.7 9.705132       17.88192 0.93 
1 1 1 -61 5  14 o 109.2891 6.894071 159.0063  60.9  0.8760834      13.78814 0.97 
1 1 1 -61 5  15 o 50.92487 11.39303 45.48711  97.8  14.42979       22.78606 0.71 
1 1 1 -61 5  16 o 31.29907 10.02819 35.65375  329.4 7.981380       20.05639 0.47 
1 1 1 -61 5  17 o 39.23139 11.98665 43.44433  44.6  -10.11369      23.97329 0.62 
1 1 1 -61 5  18 o 90.66477 7.860460 119.5629  47.5  -28.83366      15.72092 0.96 
1 1 1 -61 5  19 o 35.41558 10.90929 16.98250  305.2 2.912071       21.81859 0.32 
1 1 1 -61 5  20 o 65.51380 10.55934 108.3444  100.8 21.80759       21.11868 0.94 
1 1 1 -61 5  21 o 124.2793 6.103701 152.3377  62.8  -5.788040      12.20740 0.98 
1 1 1 -61 5  22 o 57.23841 9.367923 109.0072  41.5  44.51418       18.73585 0.93 
1 1 1 -61 5  23 o 32.45129 10.07886 35.36800  142.4 5.300961       20.15772 0.56 
1 1 1 -61 5  24 o 38.13739 10.84552 63.68588  30.9  -11.78049      21.69104 0.81 
1 1 1 -61 5  25 o 66.27497 10.99575 73.90747  49.5  -1.078690      21.99150 0.92 
1 1 1 -61 5  26 o 39.04803 11.18971 35.63820  106.9 ?              ?        0.68 
1 1 1 -61 7  1  o 51.38511 9.954610 61.35645  266.3 -33.51860      19.90922 0.85 
1 1 1 -61 7  2  o 37.56063 10.92895 29.75457  82.2  5.653915       21.85789 0.52 
1 1 1 -61 7  3  o 76.27338 8.834922 93.84657  87.2  -9.494194      17.66984 0.94 
1 1 1 -61 7  4  o 109.5623 6.730625 125.1187  101.8 26.09782       13.46125 0.97 
1 1 1 -61 7  5  o 37.22723 10.85374 20.28322  90.0  2.765110       21.70749 0.38 
1 1 1 -61 7  6  o 93.84082 7.827738 104.3376  282.5 -7.176567      15.65548 0.96 
1 1 1 -61 7  7  o 38.32508 11.60295 30.54256  243.2 7.759300       23.20589 0.53 
1 1 1 -61 7  8  f 82.23251 7.907267 109.4961  114.6 -8.210770      15.81453 0.00 
1 1 1 -61 7  9  o 52.03262 12.13122 56.60849  62.8  -7.913700      24.26243 0.82 
1 1 1 -61 7  10 o 57.99768 10.78224 105.0414  15.7  -0.1974335     21.56448 0.92 
1 1 1 -61 7  11 o 110.7670 7.612989 125.9653  1.7   -18.11221      15.22598 0.97 
1 1 1 -61 7  12 o 80.21831 8.816768 114.1428  77.8  -5.110977      17.63354 0.95 
1 1 1 -61 7  13 o 121.4906 6.001495 166.4403  143.0 6.696777       12.00299 0.98 
1 1 1 -61 7  14 o 87.55365 7.546464 109.0019  82.6  -22.27859      15.09293 0.96 
1 1 1 -61 7  15 f 124.4584 6.323612 149.0485  356.5 -22.13606      12.64722 0.00 
1 1 1 -61 7  16 o 83.22722 9.198768 121.6382  53.9  15.44037       18.39754 0.96 
1 1 1 -61 7  17 o 34.64365 9.987002 6.868837  160.8 12.24916       19.97400 0.14 
1 1 1 -61 7  18 o 74.01387 9.993191 142.4478  262.8 29.96484       19.98638 0.96 
1 1 1 -61 7  19 o 31.13527 10.07390 38.74337  239.3 -10.37766      20.14780 0.58 
1 1 1 -61 7  20 o 33.44154 10.34024 32.27304  154.0 10.65475       20.68047 0.55 
1 1 1 -61 7  21 f 30.88380 10.01315 47.77397  248.0 -5.700003      20.02629 0.00 
1 1 1 -61 7  22 o 30.36510 10.04694 62.36769  42.1  ?              ?        0.77 
1 1 1 -61 7  23 o 38.22638 11.13269 88.54800  67.4  ?              ?        0.88 
1 1 1 -61 9  3  x ?        ?        82.85511  355.2 ?              ?        0.00 
1 1 1 -61 9  4  o 64.07228 10.96866 101.5275  48.8  ?              ?        0.94 
1 1 1 -61 9  5  o 63.19745 10.99551 83.67931  113.1 ?              ?        0.92 
1 1 1 -61 9  6  o 55.83831 10.78419 72.71930  239.5 ?              ?        0.90 
1 1 1 -61 9  7  o 48.64496 11.64095 65.60200  251.7 ?              ?        0.86 
1 1 1 -61 9  8  o 30.79423 10.07250 54.89594  61.2  -0.5582237E-01 20.14500 0.73 
1 1 1 -61 9  9  o 37.08781 11.09204 56.19024  49.0  -4.777321      22.18409 0.77 
1 1 1 -61 9  10 o 88.12953 7.535893 125.7231  116.9 0.8891830      15.07179 0.97 
1 1 1 -61 9  11 o 33.90714 10.34394 21.34554  311.9 2.145611       20.68788 0.42 
1 1 1 -61 9  12 o 43.18818 11.44563 58.01174  296.1 9.097317       22.89127 0.82 
1 1 1 -61 9  13 o 44.92710 11.74705 82.05420  192.4 -6.709423      23.49410 0.88 
1 1 1 -61 9  14 o 42.44800 11.60561 78.24837  201.9 ?              ?        0.87 
1 1 1 -61 9  15 o 29.26766 9.699561 20.79021  265.7 ?              ?        0.39 
1 1 1 -61 9  16 o 54.91205 10.85210 69.00312  47.4  ?              ?        0.90 
1 1 1 -61 9  17 o 36.44925 10.82768 75.28952  77.9  ?              ?        0.86 
1 1 1 -61 9  18 x ?        ?        28.11208  38.9  ?              ?        0.00 
1 1 1 -60 0  1  o 83.06262 11.01295 85.64268  360.0 -0.000000      0.000000 0.99 
1 1 1 -60 0  2  o 234.9915 5.760884 279.3077  360.0 -0.000000      0.000000 1.00 
1 1 1 -60 0  3  o 141.2787 6.897314 143.7643  180.0 -0.000000      0.000000 1.00 
1 1 1 -60 0  4  o 25.11942 15.78834 43.61092  180.0 -0.000000      0.000000 0.29 
1 1 1 -60 0  5  o 107.1432 8.059946 148.0694  0.0   -0.000000      0.000000 1.00 
1 1 1 -60 0  6  o 230.5857 5.290720 295.7980  360.0 -0.000000      0.000000 1.00 
1 1 1 -60 0  7  o 256.7059 5.653780 303.2139  0.0   -0.000000      0.000000 1.00 
1 1 1 -60 0  8  o 46.74329 19.05870 101.8919  0.0   -0.000000      0.000000 0.83 
1 1 1 -60 0  9  o 24.21920 16.14006 17.57523  180.0 -0.000000      0.000000 0.11 
1 1 1 -60 0  10 o 128.9253 8.845981 188.3182  0.0   -0.000000      0.000000 1.00 
1 1 1 -60 0  11 o 113.9329 9.657674 116.6127  0.0   -0.000000      0.000000 1.00 
1 1 1 -60 0  12 o 181.2675 7.982336 283.8447  180.0 -0.000000      0.000000 1.00 
1 1 1 -60 0  13 o 52.80204 21.11578 86.40535  0.0   -0.000000      0.000000 0.81 
1 1 1 -60 0  14 o 277.5558 6.320261 303.0715  0.0   -0.000000      0.000000 1.00 
1 1 1 -60 0  15 o 32.78256 19.08856 83.60251  180.0 -0.000000      0.000000 0.63 
1 1 1 -60 0  16 o 29.99662 18.14347 23.41391  180.0 -0.000000      0.000000 0.19 
1 1 1 -60 0  17 o 87.14156 11.76549 20.38626  180.0 -0.000000      0.000000 0.50 
1 1 1 -60 0  18 o 45.61250 21.13609 93.99353  360.0 -0.000000      0.000000 0.85 
1 1 1 -60 0  19 o 76.45981 11.96326 136.4776  0.0   -0.000000      0.000000 1.00 
1 1 1 -60 0  20 o 15.94542 11.56397 48.06372  360.0 -0.000000      0.000000 0.29 
1 1 1 -60 0  21 o 20.71795 13.81870 89.19432  180.0 -0.000000      0.000000 0.65 
1 1 1 -60 0  22 f 149.7712 7.342169 190.7648  360.0 -0.000000      0.000000 0.00 
1 1 1 -60 0  23 o 22.45454 14.67589 68.69169  180.0 -0.000000      0.000000 0.65 
1 1 1 -60 0  24 o 62.10041 16.10802 12.27940  180.0 -0.000000      0.000000 0.39 
1 1 1 -60 0  25 o 23.89246 15.16097 4.981947  180.0 -0.000000      0.000000 0.07 
1 1 1 -60 0  26 o 60.77368 14.88431 124.8545  180.0 -0.000000      0.000000 1.00 
1 1 1 -60 0  27 o 55.87576 16.16353 78.78368  360.0 -0.000000      0.000000 0.99 
1 1 1 -60 0  28 o 24.42779 15.50488 10.47264  180.0 -0.000000      0.000000 0.16 
1 1 1 -60 0  29 f 82.18741 10.89909 88.10831  180.0 ?              ?        0.00 
1 1 1 -60 2  1  o 112.3673 5.103805 136.3783  119.4 -6.699715      10.20761 0.96 
1 1 1 -60 2  2  o 162.2130 4.366507 153.5180  44.2  -10.64497      8.733014 0.97 
1 1 1 -60 2  3  o 78.76581 7.378833 76.01283  322.1 8.582108       14.75767 0.86 
1 1 1 -60 2  4  o 36.81706 10.47921 45.76381  141.4 2.736546       20.95841 0.44 
1 1 1 -60 2  5  o 58.20448 10.33391 84.09361  55.6  -16.06514      20.66781 0.79 
1 1 1 -60 2  6  o 167.6341 4.596294 192.2963  287.0 -3.270447      9.192589 0.97 
1 1 1 -60 2  7  f 46.84233 11.23429 21.17280  40.6  6.805595       22.46858 0.00 
1 1 1 -60 2  8  o 143.9751 5.535477 186.4708  21.7  -11.98586      11.07095 0.97 
1 1 1 -60 2  9  o 83.62200 8.872058 116.1918  291.0 -14.81779      17.74412 0.90 
1 1 1 -60 2  10 o 107.2468 6.636505 116.4213  245.1 4.783051       13.27301 0.93 
1 1 1 -60 2  11 o 121.8246 6.863435 168.2951  5.0   -5.705887      13.72687 0.96 
1 1 1 -60 2  12 o 69.12381 11.07406 111.5438  336.2 4.150475       22.14813 0.87 
1 1 1 -60 2  13 o 41.91619 9.800246 97.00547  313.5 34.85519       19.60049 0.74 
1 1 1 -60 2  14 o 32.75047 10.19312 56.49859  66.3  -14.86498      20.38623 0.47 
1 1 1 -60 2  15 o 45.79348 12.19085 115.8638  317.4 -5.806824      24.38170 0.81 
1 1 1 -60 2  16 o 52.79711 11.70243 115.9426  329.1 15.23470       23.40486 0.85 
1 1 1 -60 2  17 o 69.81705 9.572447 106.5619  79.7  18.98785       19.14489 0.89 
1 1 1 -60 2  18 o 182.5993 4.561768 269.1169  59.7  -5.530518      9.123536 0.99 
1 1 1 -60 2  19 o 35.93400 10.75748 69.11201  18.8  -2.830742      21.51496 0.66 
1 1 1 -60 2  20 o 74.04097 8.698134 96.82067  45.8  -17.16355      17.39627 0.91 
1 1 1 -60 2  21 o 49.07853 11.23076 51.18864  33.2  -14.88705      22.46151 0.72 
1 1 1 -60 2  22 o 117.3951 7.138152 164.4079  39.0  -15.89998      14.27630 0.97 
1 1 1 -60 2  23 o 88.22556 7.606254 173.5906  27.9  8.542015       15.21251 0.97 
1 1 1 -60 2  24 o 96.82612 6.774609 103.6585  162.3 16.40698       13.54922 0.96 
1 1 1 -60 2  25 o 36.17697 9.870770 37.70780  205.2 17.07041       19.74154 0.62 
1 1 1 -60 2  26 o 30.37339 9.186236 10.68205  353.3 9.449486       18.37247 0.19 
1 1 1 -60 2  27 o 109.4085 5.829664 162.0584  112.5 -14.85154      11.65933 0.98 
1 1 1 -60 2  28 o 113.8266 6.156378 169.6449  134.5 -6.177826      12.31276 0.98 
1 1 1 -60 2  29 o 31.01352 9.636515 47.23238  98.6  ?              ?        0.72 
1 1 1 -60 4  1  f 178.6772 4.048441 147.2977  116.0 -4.211777      8.096882 0.00 
1 1 1 -60 4  2  o 153.4428 4.377857 189.2646  68.5  -25.74725      8.755714 0.98 
1 1 1 -60 4  3  o 71.06265 9.888869 86.93787  134.7 32.82705       19.77774 0.89 
1 1 1 -60 4  4  o 178.0451 4.545066 190.3544  184.6 1.675949       9.090132 0.98 
1 1 1 -60 4  5  o 161.0913 4.871662 198.5225  173.2 1.452118       9.743324 0.98 
1 1 1 -60 4  6  o 119.5846 5.331941 106.3340  120.8 13.19933       10.66388 0.94 
1 1 1 -60 4  7  o 38.26179 10.77587 54.34292  232.2 -16.91759      21.55174 0.55 
1 1 1 -60 4  8  o 51.84403 11.36093 36.84864  205.4 -3.725792      22.72186 0.51 
1 1 1 -60 4  9  o 86.32938 7.873501 108.8268  67.8  -19.22968      15.74700 0.91 
1 1 1 -60 4  10 o 100.1424 7.308731 113.0466  83.1  -7.053627      14.61746 0.93 
1 1 1 -60 4  11 o 191.2015 4.148725 243.9831  218.7 2.028610       8.297450 0.98 
1 1 1 -60 4  12 o 133.8782 5.497598 164.4293  155.8 1.775955       10.99520 0.97 
1 1 1 -60 4  13 o 91.68054 8.466581 97.52409  199.8 21.65290       16.93316 0.91 
1 1 1 -60 4  14 o 32.71329 10.37944 97.27814  331.3 -1.002758      20.75888 0.72 
1 1 1 -60 4  15 o 102.1975 7.190905 133.3863  355.6 15.41503       14.38181 0.95 
1 1 1 -60 4  16 o 93.73379 8.915679 97.23753  355.3 -8.851624      17.83136 0.92 
1 1 1 -60 4  17 o 79.71770 9.740656 56.74572  2.3   15.58481       19.48131 0.85 
1 1 1 -60 4  18 o 37.06699 10.66380 59.57868  213.8 7.560539       21.32759 0.67 
1 1 1 -60 4  19 o 90.24993 7.768111 126.8870  350.1 -13.08270      15.53622 0.95 
1 1 1 -60 4  20 o 62.81452 13.58671 81.14177  105.1 -27.68024      27.17342 0.88 
1 1 1 -60 4  21 o 111.2050 6.915041 147.7009  152.0 20.29151       13.83008 0.97 
1 1 1 -60 4  22 o 42.53786 11.01422 38.65313  121.7 4.767014       22.02844 0.67 
1 1 1 -60 4  23 o 38.76239 10.07368 46.28623  357.2 -22.92316      20.14737 0.72 
1 1 1 -60 4  24 o 27.89309 8.908691 11.73916  208.6 -16.52262      17.81738 0.20 
1 1 1 -60 4  25 o 54.24399 10.80899 86.86196  70.5  23.26904       21.61798 0.90 
1 1 1 -60 4  26 o 65.38211 9.414392 110.0786  339.8 -6.801613      18.82878 0.94 
1 1 1 -60 4  27 o 70.77893 10.19138 108.2771  140.2 ?              ?        0.95 
1 1 1 -60 4  28 o 77.61665 7.563090 89.27771  104.3 ?              ?        0.96 
1 1 1 -60 6  1  o 47.33930 10.14370 77.14771  208.9 8.307831       20.28741 0.86 
1 1 1 -60 6  2  f 48.00188 11.35951 103.1828  40.0  9.051018       22.71901 0.00 
1 1 1 -60 6  3  o 62.18252 9.072397 44.21252  129.1 34.40252       18.14479 0.81 
1 1 1 -60 6  4  o 101.6729 6.545202 107.7120  248.1 -4.775375      13.09040 0.96 
1 1 1 -60 6  5  o 60.12655 10.84147 96.06863  264.2 -8.551182      21.68294 0.90 
1 1 1 -60 6  6  o 34.29714 9.927694 51.95633  284.1 -11.93047      19.85539 0.63 
1 1 1 -60 6  7  o 70.44667 10.01992 84.91543  124.9 14.76512       20.03984 0.90 
1 1 1 -60 6  8  o 31.62320 9.596188 5.165782  208.8 11.78838       19.19238 0.07 
1 1 1 -60 6  9  o 131.9988 5.818349 172.1219  266.8 -13.17899      11.63670 0.98 
1 1 1 -60 6  10 o 124.4608 7.214571 168.7637  225.5 -11.23030      14.42914 0.97 
1 1 1 -60 6  11 o 56.66630 11.02751 32.98736  211.4 -26.12766      22.05502 0.62 
1 1 1 -60 6  12 o 42.00174 10.53985 66.62737  333.6 16.03036       21.07969 0.76 
1 1 1 -60 6  13 o 59.05111 11.49606 44.21981  40.4  -10.89740      22.99213 0.74 
1 1 1 -60 6  14 o 101.8248 7.521385 94.94357  133.1 1.803047       15.04277 0.95 
1 1 1 -60 6  15 o 120.3323 6.730751 164.7505  227.9 3.949150       13.46150 0.98 
1 1 1 -60 6  16 o 72.48570 9.848039 107.6669  165.3 0.2241592      19.69608 0.94 
1 1 1 -60 6  17 o 135.9883 6.144567 135.6976  148.5 -13.68462      12.28913 0.98 
1 1 1 -60 6  18 o 32.38622 10.19486 19.33260  106.5 1.976877       20.38971 0.34 
1 1 1 -60 6  19 o 49.44102 11.40327 64.21403  358.3 9.858250       22.80654 0.85 
1 1 1 -60 6  20 o 43.83816 11.29061 56.12387  99.0  -31.57644      22.58122 0.79 
1 1 1 -60 6  21 o 44.46989 11.12502 75.43597  175.7 6.042763       22.25004 0.86 
1 1 1 -60 6  22 o 53.32627 11.50967 44.62564  41.5  6.467712       23.01934 0.78 
1 1 1 -60 6  23 f 27.24828 9.143330 56.65804  344.5 -4.398373      18.28666 0.00 
1 1 1 -60 6  24 o 64.69228 9.689427 79.18510  62.2  -20.08225      19.37885 0.92 
1 1 1 -60 6  25 o 122.0524 6.498253 198.8621  94.9  ?              ?        0.99 
1 1 1 -60 6  26 o 36.34263 10.62929 52.97581  39.5  ?              ?        0.79 
1 1 1 -60 8  1  o 64.93044 11.43983 75.59248  221.1 -7.147923      22.87967 0.91 
1 1 1 -60 8  2  o 61.88884 8.408974 105.4357  139.5 -60.93455      16.81795 0.94 
1 1 1 -60 8  3  o 39.55321 10.35802 47.18558  6.4   15.04562       20.71603 0.72 
1 1 1 -60 8  4  o 37.35463 11.94262 67.55079  202.6 13.32038       23.88525 0.78 
1 1 1 -60 8  5  o 69.97411 11.78561 108.7069  154.3 6.880302       23.57121 0.94 
1 1 1 -60 8  6  o 54.16117 11.31779 110.0656  146.9 -6.410194      22.63558 0.92 
1 1 1 -60 8  7  o 58.48349 11.32941 116.1485  150.5 -17.92290      22.65883 0.93 
1 1 1 -60 8  8  o 69.24004 10.11014 82.03509  227.4 22.24698       20.22027 0.92 
1 1 1 -60 8  9  o 32.27400 10.02842 40.31105  276.4 1.716404       20.05685 0.60 
1 1 1 -60 8  10 f 41.75962 10.99866 47.63918  181.1 24.25195       21.99732 0.00 
1 1 1 -60 8  11 o 36.49366 10.53331 12.48248  272.8 3.144146       21.06662 0.25 
1 1 1 -60 8  12 o 54.01139 11.51627 80.98528  53.7  0.2176399      23.03254 0.89 
1 1 1 -60 8  13 o 41.93532 11.70820 62.72862  94.0  -6.849068      23.41640 0.80 
1 1 1 -60 8  14 o 29.81483 9.374973 37.33955  205.9 15.01428       18.74995 0.56 
1 1 1 -60 8  15 o 69.99960 9.797059 78.53085  279.1 -11.69080      19.59412 0.92 
1 1 1 -60 8  16 o 46.89656 11.68352 18.21473  242.3 2.845272       23.36703 0.43 
1 1 1 -60 8  17 o 45.49058 11.46205 25.05730  348.1 16.08575       22.92409 0.54 
1 1 1 -60 8  18 o 26.12895 8.885264 31.40000  326.1 -8.325195      17.77053 0.47 
1 1 1 -60 8  19 o 44.06366 11.83272 71.55482  177.5 -14.51993      23.66545 0.85 
1 1 1 -60 8  20 o 56.61110 11.99842 69.97557  100.7 2.141125       23.99683 0.89 
1 1 1 -60 8  21 o 58.95105 12.59928 98.59902  84.7  ?              ?        0.93 
1 1 1 -60 8  22 o 34.63181 10.84287 28.37440  106.2 ?              ?        0.57 
1 1 1 -60 10 6  x ?        ?        98.62904  311.9 ?              ?        0.00 
1 1 1 -60 10 7  o 34.09282 10.64292 68.68916  359.3 ?              ?        0.83 
1 1 1 -60 10 8  o 36.01313 10.88728 47.94960  279.4 ?              ?        0.75 
1 1 1 -60 10 9  f 26.78400 8.944064 40.52568  134.5 ?              ?        0.00 
1 1 1 -60 10 10 o 97.44963 7.755909 121.4693  123.3 ?              ?        0.97 
1 1 1 -60 10 11 o 41.63170 12.37002 37.24310  348.2 ?              ?        0.69 
1 1 1 -60 10 12 o 50.34418 11.13242 64.03777  315.8 ?              ?        0.88 
1 1 1 -60 10 13 o 37.36803 11.01879 67.02023  195.0 ?              ?        0.84 
1 1 1 -60 10 14 o 64.24249 11.00546 79.02592  220.0 ?              ?        0.93 
1 1 1 -60 10 15 x ?        ?        16.63274  260.9 ?              ?        0.00 
1 1 1 -59 1  1  o 125.8076 4.997160 132.1780  230.6 7.152229       9.994320 0.95 
1 1 1 -59 1  2  o 51.02418 9.067133 68.37391  119.0 24.21281       18.13427 0.69 
1 1 1 -59 1  3  o 58.36242 9.603891 89.29097  273.6 -15.30078      19.20778 0.80 
1 1 1 -59 1  4  f 88.58405 6.856387 68.42051  143.4 11.13002       13.71277 0.00 
1 1 1 -59 1  5  o 91.48729 7.290026 123.0121  118.4 -10.42202      14.58005 0.91 
1 1 1 -59 1  6  o 59.59986 9.546414 75.31051  197.4 -24.02505      19.09283 0.74 
1 1 1 -59 1  7  o 49.17962 12.11248 40.24361  143.6 -2.359577      24.22497 0.44 
1 1 1 -59 1  8  o 90.25196 7.766710 121.2263  329.3 8.335571       15.53342 0.91 
1 1 1 -59 1  9  o 57.42782 10.18467 78.28705  319.0 21.21473       20.36933 0.74 
1 1 1 -59 1  10 o 142.6459 5.903226 167.1244  251.2 -24.30344      11.80645 0.96 
1 1 1 -59 1  11 o 37.67600 11.08364 10.17937  309.5 -18.63840      22.16728 0.10 
1 1 1 -59 1  12 o 97.35403 7.101707 69.86749  88.0  -20.84359      14.20341 0.85 
1 1 1 -59 1  13 o 82.88911 9.796840 96.86893  28.3  -32.66655      19.59368 0.87 
1 1 1 -59 1  14 o 78.59820 10.08374 151.1446  94.6  40.93001       20.16747 0.92 
1 1 1 -59 1  15 o 59.54068 11.41806 26.83795  165.0 -13.79308      22.83611 0.39 
1 1 1 -59 1  16 o 114.2037 6.501671 159.0711  4.1   8.100349       13.00334 0.95 
1 1 1 -59 1  17 o 74.11273 9.578725 86.28554  260.5 -27.77565      19.15745 0.85 
1 1 1 -59 1  18 o 83.28307 7.510565 103.5278  75.4  -17.40434      15.02113 0.90 
1 1 1 -59 1  19 o 83.11567 7.714348 97.06894  150.1 -7.641174      15.42870 0.90 
1 1 1 -59 1  20 o 83.29041 7.266431 131.4602  342.1 6.949059       14.53286 0.93 
1 1 1 -59 1  21 o 71.83887 9.386302 117.6930  91.6  15.94199       18.77260 0.92 
1 1 1 -59 1  22 o 149.9698 4.911289 174.4937  18.5  -3.502640      9.822578 0.98 
1 1 1 -59 1  23 o 66.64362 9.018080 79.24023  275.8 0.7099228      18.03616 0.89 
1 1 1 -59 1  24 o 95.83768 6.540120 143.5333  139.4 -2.164040      13.08024 0.97 
1 1 1 -59 1  25 o 34.28350 9.580424 7.526880  37.6  18.03148       19.16085 0.15 
1 1 1 -59 1  26 o 45.41038 10.45158 78.13286  12.4  10.98349       20.90316 0.87 
1 1 1 -59 1  27 o 99.13972 6.236079 124.1821  131.5 -16.68687      12.47216 0.97 
1 1 1 -59 1  28 f 59.62019 13.11346 81.76971  173.3 10.21327       26.22692 0.00 
1 1 1 -59 1  29 o 61.96171 9.632730 90.93633  189.9 36.45393       19.26546 0.93 
1 1 1 -59 1  30 o 27.74648 9.172862 15.48665  228.2 ?              ?        0.31 
1 1 1 -59 3  1  o 74.71072 8.104634 79.00011  296.7 24.40477       16.20927 0.87 
1 1 1 -59 3  2  o 66.84691 9.254236 59.27858  94.9  16.43316       18.50847 0.77 
1 1 1 -59 3  3  o 192.2619 3.600149 197.0387  88.2  -7.031830      7.200298 0.98 
1 1 1 -59 3  4  o 208.0719 4.347727 194.2905  160.5 -2.210052      8.695455 0.98 
1 1 1 -59 3  5  o 166.5709 4.284482 177.1133  173.4 7.368332       8.568963 0.97 
1 1 1 -59 3  6  o 103.6580 6.919426 102.2900  277.1 18.82784       13.83885 0.91 
1 1 1 -59 3  7  o 94.17214 6.716700 93.91497  214.4 -0.2779236     13.43340 0.89 
1 1 1 -59 3  8  o 121.0106 5.974688 141.6714  225.3 24.06349       11.94938 0.95 
1 1 1 -59 3  9  f 47.92906 11.59726 18.33177  84.2  -3.891979      23.19452 0.00 
1 1 1 -59 3  10 o 95.67215 6.823499 122.1373  35.0  -25.21296      13.64700 0.92 
1 1 1 -59 3  11 o 202.3884 4.676654 223.0736  160.2 4.355286       9.353308 0.98 
1 1 1 -59 3  12 o 43.22589 11.61027 21.82833  16.1  6.540188       23.22053 0.25 
1 1 1 -59 3  13 o 124.9182 6.112755 184.0338  338.8 -17.68459      12.22551 0.96 
1 1 1 -59 3  14 o 45.38198 11.75884 20.61174  311.2 -8.651653      23.51768 0.25 
1 1 1 -59 3  15 o 97.26163 7.640331 111.1157  172.2 20.92072       15.28066 0.92 
1 1 1 -59 3  16 o 105.8525 6.882362 143.3730  85.1  -12.29781      13.76472 0.95 
1 1 1 -59 3  17 o 57.13709 10.78577 119.6485  101.8 -20.87902      21.57155 0.87 
1 1 1 -59 3  18 o 46.06422 10.95049 41.27467  176.0 15.74476       21.90098 0.53 
1 1 1 -59 3  19 o 56.29485 11.85769 68.59946  314.3 -11.48134      23.71539 0.78 
1 1 1 -59 3  20 o 108.2979 6.056024 145.7550  82.0  -14.28116      12.11205 0.96 
1 1 1 -59 3  21 o 80.56122 7.852447 116.2486  139.6 -8.065598      15.70489 0.94 
1 1 1 -59 3  22 o 87.47305 7.423105 122.5266  106.3 21.49933       14.84621 0.95 
1 1 1 -59 3  23 o 151.1653 7.042435 223.3555  305.9 11.53937       14.08487 0.99 
1 1 1 -59 3  24 o 90.84893 7.582468 121.8795  303.5 -4.130417      15.16494 0.96 
1 1 1 -59 3  25 o 39.92505 11.10862 71.86621  78.1  7.820320       22.21725 0.83 
1 1 1 -59 3  26 f 141.8802 5.208371 195.6317  333.3 -11.91966      10.41674 0.00 
1 1 1 -59 3  27 o 28.05479 9.269603 46.70467  116.5 5.079712       18.53921 0.63 
1 1 1 -59 3  28 o 46.70450 10.25929 43.87118  126.9 16.14166       20.51859 0.78 
1 1 1 -59 3  29 o 36.97495 10.68267 78.15255  22.7  ?              ?        0.86 
1 1 1 -59 5  1  o 48.54763 9.797266 32.25084  139.9 23.13160       19.59453 0.57 
1 1 1 -59 5  2  o 41.16221 10.71768 36.75584  64.7  6.492382       21.43536 0.53 
1 1 1 -59 5  3  o 28.69529 9.288865 45.04564  54.6  -0.6457214     18.57773 0.46 
1 1 1 -59 5  4  f 46.07885 11.13511 65.72870  19.0  11.84901       22.27023 0.00 
1 1 1 -59 5  5  o 44.17717 11.46416 97.45515  349.3 4.129944       22.92832 0.81 
1 1 1 -59 5  6  o 152.9403 4.903795 203.9251  296.5 -22.85628      9.807590 0.98 
1 1 1 -59 5  7  o 45.76925 11.74278 59.98036  269.0 6.993591       23.48556 0.65 
1 1 1 -59 5  8  o 56.28567 10.47090 100.3942  16.0  -3.157539      20.94181 0.85 
1 1 1 -59 5  9  o 56.40111 9.281083 97.77673  288.9 -45.73859      18.56217 0.85 
1 1 1 -59 5  10 o 62.84091 10.40870 100.2375  293.2 -15.37694      20.81740 0.86 
1 1 1 -59 5  11 o 94.19659 7.407448 153.7298  263.8 -16.44360      14.81490 0.95 
1 1 1 -59 5  12 o 78.92500 8.488639 110.6498  159.3 -41.88106      16.97728 0.91 
1 1 1 -59 5  13 o 51.18351 12.47416 75.54477  326.7 10.83706       24.94832 0.76 
1 1 1 -59 5  14 o 39.30911 10.76245 96.03006  21.0  -9.509869      21.52491 0.77 
1 1 1 -59 5  15 o 43.47424 10.81338 24.01613  287.7 -26.97821      21.62676 0.35 
1 1 1 -59 5  16 o 61.13415 11.01621 73.46677  327.4 15.33912       22.03241 0.83 
1 1 1 -59 5  17 o 56.17374 10.67023 72.77891  27.2  32.85206       21.34046 0.83 
1 1 1 -59 5  18 o 124.8986 5.704018 156.2500  242.7 -17.62608      11.40804 0.97 
1 1 1 -59 5  19 o 88.38330 8.738782 100.2443  298.3 43.56333       17.47756 0.94 
1 1 1 -59 5  20 o 76.07384 8.558572 126.5652  284.3 24.01105       17.11714 0.95 
1 1 1 -59 5  21 o 58.75996 10.08000 101.7127  184.4 28.35476       20.16001 0.92 
1 1 1 -59 5  22 o 109.9710 5.901649 180.9888  108.4 -17.03368      11.80330 0.98 
1 1 1 -59 5  23 o 33.03471 10.07586 63.57654  151.1 3.303555       20.15172 0.76 
1 1 1 -59 5  24 o 52.10341 10.81829 95.37682  288.3 7.652657       21.63658 0.91 
1 1 1 -59 5  25 o 33.41140 10.19652 25.78197  48.2  1.108967       20.39305 0.46 
1 1 1 -59 5  26 o 50.20309 11.04821 72.72661  256.3 8.817921       22.09641 0.88 
1 1 1 -59 5  27 o 41.71326 11.02857 37.34223  162.0 ?              ?        0.71 
1 1 1 -59 5  28 o 33.28400 10.37914 48.08005  104.1 ?              ?        0.75 
1 1 1 -59 7  1  o 34.75000 10.18094 44.12781  146.8 0.9096603      20.36188 0.64 
1 1 1 -59 7  2  o 76.07622 8.959313 94.38551  261.4 -7.621468      17.91863 0.94 
1 1 1 -59 7  3  o 141.4570 5.157592 179.7203  270.2 7.560638       10.31518 0.98 
1 1 1 -59 7  4  o 72.33212 8.428048 49.18610  301.0 -14.78084      16.85610 0.87 
1 1 1 -59 7  5  o 38.27032 10.70033 30.96330  149.7 -12.76008      21.40067 0.52 
1 1 1 -59 7  6  o 67.73228 10.78673 69.01852  292.4 5.493980       21.57346 0.88 
1 1 1 -59 7  7  o 115.1123 7.523866 182.2455  300.0 0.2515411      15.04773 0.98 
1 1 1 -59 7  8  o 134.8747 5.415478 172.0398  254.8 7.517822       10.83096 0.98 
1 1 1 -59 7  9  o 105.8283 6.137381 156.1336  176.1 -14.44473      12.27476 0.97 
1 1 1 -59 7  10 o 101.8300 7.051704 181.8810  184.4 -3.162163      14.10341 0.97 
1 1 1 -59 7  11 o 77.21484 9.187684 110.4064  319.0 14.96174       18.37537 0.94 
1 1 1 -59 7  12 o 146.6247 5.930849 215.7218  319.7 -1.458817      11.86170 0.99 
1 1 1 -59 7  13 o 52.01124 11.16785 65.83794  268.4 -5.799038      22.33570 0.83 
1 1 1 -59 7  14 o 200.1737 4.572804 263.3914  196.2 -1.369644      9.145608 0.99 
1 1 1 -59 7  15 o 41.89757 11.21515 91.91466  168.7 4.346714       22.43030 0.86 
1 1 1 -59 7  16 o 41.44736 11.16209 38.94665  60.6  14.81544       22.32417 0.65 
1 1 1 -59 7  17 o 50.36646 12.61825 65.88179  282.6 -26.99300      25.23650 0.84 
1 1 1 -59 7  18 o 47.83941 11.60277 52.07352  354.1 4.832718       23.20553 0.79 
1 1 1 -59 7  19 o 45.32209 12.16463 101.2927  124.7 -1.750416      24.32926 0.89 
1 1 1 -59 7  20 o 44.72369 11.11048 40.41119  224.7 -38.34504      22.22095 0.71 
1 1 1 -59 7  21 o 46.83455 11.70654 78.92255  251.2 -27.44347      23.41309 0.87 
1 1 1 -59 7  22 o 88.99239 7.785487 116.2356  135.4 9.222160       15.57097 0.96 
1 1 1 -59 7  23 o 41.04329 10.68089 82.27191  10.5  16.84166       21.36178 0.87 
1 1 1 -59 7  24 o 40.90932 10.06671 34.42290  76.7  ?              ?        0.69 
1 1 1 -59 7  25 o 106.6441 7.053695 185.7527  107.7 ?              ?        0.99 
1 1 1 -59 9  1  o 40.59370 12.15429 51.61901  223.7 ?              ?        0.77 
1 1 1 -59 9  2  o 57.50116 10.68837 61.01879  150.3 ?              ?        0.88 
1 1 1 -59 9  3  o 45.69049 11.68645 40.15543  23.6  5.267864       23.37290 0.72 
1 1 1 -59 9  4  o 54.76832 10.62744 98.61467  202.4 -40.56628      21.25487 0.92 
1 1 1 -59 9  5  o 44.55010 11.59607 64.15721  84.1  9.899136       23.19213 0.83 
1 1 1 -59 9  6  o 102.1931 6.769361 122.6932  3.4   -2.394539      13.53872 0.97 
1 1 1 -59 9  7  o 63.50577 10.31400 112.1943  359.9 24.59181       20.62801 0.94 
1 1 1 -59 9  8  o 39.08227 11.10512 18.37517  322.7 -16.76200      22.21023 0.37 
1 1 1 -59 9  9  o 38.27049 10.91690 22.30512  19.3  -14.84964      21.83380 0.44 
1 1 1 -59 9  10 o 30.26810 9.828303 27.90926  302.6 -17.55583      19.65661 0.45 
1 1 1 -59 9  11 o 72.49106 9.467769 80.56246  147.8 2.794472       18.93554 0.93 
1 1 1 -59 9  12 o 42.16941 10.71393 33.31735  72.2  19.29067       21.42787 0.63 
1 1 1 -59 9  13 o 62.73309 11.13452 80.03533  18.7  -3.297482      22.26905 0.91 
1 1 1 -59 9  14 o 43.14909 10.66138 22.63735  28.6  19.99694       21.32275 0.50 
1 1 1 -59 9  15 o 82.21561 8.633474 98.55544  190.9 2.184029       17.26695 0.95 
1 1 1 -59 9  16 o 79.93291 9.083045 119.8908  159.3 18.14587       18.16609 0.96 
1 1 1 -59 9  17 o 45.86536 12.02394 56.13735  86.0  -19.63757      24.04788 0.81 
1 1 1 -59 9  18 o 34.41488 10.12849 32.92869  182.3 -26.21684      20.25699 0.60 
1 1 1 -59 9  19 o 42.23948 11.15201 52.36590  79.2  ?              ?        0.80 
1 1 1 -59 9  20 o 86.10699 8.920886 135.3918  52.7  ?              ?        0.97 
1 1 1 -59 9  21 x ?        ?        235.1907  65.7  ?              ?        0.00 
1 1 1 -58 0  1  o 125.8714 6.538322 120.3325  360.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  2  o 20.35701 13.59678 8.994508  180.0 -0.000000      0.000000 0.05 
1 1 1 -58 0  3  o 131.0045 7.727985 135.8843  180.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  4  o 329.4179 5.105829 279.8114  180.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  5  o 134.5003 6.714656 161.6594  180.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  6  o 20.18485 13.83333 47.42249  180.0 -0.000000      0.000000 0.24 
1 1 1 -58 0  7  o 71.46032 15.14910 81.14582  180.0 -0.000000      0.000000 0.91 
1 1 1 -58 0  8  o 83.24626 10.98670 121.4471  180.0 -0.000000      0.000000 0.99 
1 1 1 -58 0  9  o 16.03054 11.66028 120.9070  180.0 -0.000000      0.000000 0.51 
1 1 1 -58 0  10 o 26.30504 17.22794 49.89896  0.0   -0.000000      0.000000 0.35 
1 1 1 -58 0  11 o 57.35711 18.78834 124.7242  360.0 -0.000000      0.000000 0.96 
1 1 1 -58 0  12 o 64.10580 17.97409 27.86694  180.0 -0.000000      0.000000 0.45 
1 1 1 -58 0  13 o 244.4112 6.816884 278.0963  180.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  14 o 63.15012 17.75399 61.88120  180.0 -0.000000      0.000000 0.77 
1 1 1 -58 0  15 o 43.33867 21.54928 65.79182  0.0   -0.000000      0.000000 0.59 
1 1 1 -58 0  16 o 24.99854 16.24484 17.09993  0.0   -0.000000      0.000000 0.11 
1 1 1 -58 0  17 o 41.48454 19.27533 36.64264  0.0   -0.000000      0.000000 0.37 
1 1 1 -58 0  18 o 100.1055 9.766397 114.1199  0.0   -0.000000      0.000000 1.00 
1 1 1 -58 0  19 o 45.39573 20.25568 87.76688  180.0 -0.000000      0.000000 0.79 
1 1 1 -58 0  20 o 112.5913 8.061745 153.4322  360.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  21 o 40.07490 18.86650 5.957194  0.0   -0.000000      0.000000 0.07 
1 1 1 -58 0  22 o 80.07775 11.13200 85.01101  180.0 -0.000000      0.000000 0.99 
1 1 1 -58 0  23 f 91.38744 8.202980 128.1067  0.0   -0.000000      0.000000 0.00 
1 1 1 -58 0  24 o 93.40881 9.409375 101.3646  0.0   -0.000000      0.000000 1.00 
1 1 1 -58 0  25 o 36.68841 18.38578 36.58751  360.0 -0.000000      0.000000 0.56 
1 1 1 -58 0  26 o 121.9885 7.346465 233.7176  360.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  27 o 92.74418 9.279539 148.6901  180.0 -0.000000      0.000000 1.00 
1 1 1 -58 0  28 o 49.80878 16.51619 99.84948  180.0 -0.000000      0.000000 0.99 
1 1 1 -58 0  29 o 16.70835 11.80689 39.44214  180.0 -0.000000      0.000000 0.42 
1 1 1 -58 0  30 o 37.77209 19.76215 13.75739  360.0 ?              ?        0.28 
1 1 1 -58 0  31 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -58 2  1  o 242.4518 3.642735 267.3730  225.2 -17.59796      7.285470 0.99 
1 1 1 -58 2  2  o 86.17290 7.064925 164.6682  196.2 -29.17439      14.12985 0.93 
1 1 1 -58 2  3  o 98.71386 5.833507 138.9826  359.2 0.2060089      11.66701 0.93 
1 1 1 -58 2  4  o 158.9065 3.852447 176.2556  162.4 -13.12552      7.704894 0.97 
1 1 1 -58 2  5  o 159.0131 4.792132 222.4115  166.1 -29.01637      9.584265 0.97 
1 1 1 -58 2  6  o 42.60308 10.55683 58.39380  114.4 -9.643265      21.11365 0.52 
1 1 1 -58 2  7  o 45.06979 10.30071 37.20090  73.3  12.70631       20.60142 0.39 
1 1 1 -58 2  8  o 63.04375 10.33908 75.64867  47.9  -33.89957      20.67815 0.76 
1 1 1 -58 2  9  o 68.17068 9.653594 105.9903  68.0  -11.10635      19.30719 0.86 
1 1 1 -58 2  10 o 110.8580 7.030464 134.9001  284.3 27.21278       14.06093 0.94 
1 1 1 -58 2  11 o 156.3857 5.270657 174.1529  208.1 10.59042       10.54131 0.97 
1 1 1 -58 2  12 o 135.9338 5.473587 191.5190  237.8 -16.03435      10.94717 0.97 
1 1 1 -58 2  13 o 116.1177 6.254440 166.8584  305.8 19.31596       12.50888 0.95 
1 1 1 -58 2  14 o 61.17621 8.740745 101.9005  327.7 59.21649       17.48149 0.83 
1 1 1 -58 2  15 o 36.32460 10.54389 21.65550  10.4  -2.761623      21.08779 0.20 
1 1 1 -58 2  16 o 85.86760 7.507005 136.1295  26.3  2.658470       15.01401 0.92 
1 1 1 -58 2  17 o 55.00003 9.720558 86.54666  232.9 40.43819       19.44112 0.78 
1 1 1 -58 2  18 o 164.3102 5.031604 241.7287  202.4 28.46216       10.06321 0.98 
1 1 1 -58 2  19 o 133.2679 5.519280 153.7609  183.9 -10.94788      11.03856 0.96 
1 1 1 -58 2  20 o 35.20546 10.71931 75.16622  154.9 -1.015831      21.43861 0.64 
1 1 1 -58 2  21 o 113.0238 5.780293 205.7809  168.7 1.484970       11.56059 0.97 
1 1 1 -58 2  22 o 106.6710 6.637828 176.3238  63.6  -22.14056      13.27566 0.97 
1 1 1 -58 2  23 o 84.06310 8.008116 145.4477  269.2 31.25342       16.01623 0.96 
1 1 1 -58 2  24 o 144.2402 4.479595 206.6526  302.4 30.68504       8.959189 0.98 
1 1 1 -58 2  25 o 35.12818 10.14265 16.68419  155.6 11.04603       20.28530 0.31 
1 1 1 -58 2  26 o 101.4101 5.618864 109.0160  270.1 -7.844658      11.23773 0.97 
1 1 1 -58 2  27 o 45.26832 10.38401 34.57104  191.3 10.74505       20.76801 0.67 
1 1 1 -58 2  28 o 104.1932 6.734656 129.0913  81.1  -26.20345      13.46931 0.97 
1 1 1 -58 2  29 o 77.59134 8.345904 54.33023  39.4  7.874382       16.69181 0.91 
1 1 1 -58 2  30 o 49.86483 10.65968 53.54610  95.5  ?              ?        0.85 
1 1 1 -58 4  1  o 123.9944 5.032864 156.5493  347.3 -9.612152      10.06573 0.96 
1 1 1 -58 4  2  o 91.47903 5.985985 120.9509  356.1 -3.390602      11.97197 0.93 
1 1 1 -58 4  3  o 191.9256 4.222516 225.1233  52.7  -12.57062      8.445031 0.98 
1 1 1 -58 4  4  o 177.3326 4.457043 170.2036  349.0 -8.985764      8.914086 0.97 
1 1 1 -58 4  5  o 58.99625 9.792862 91.22849  353.4 -6.754692      19.58572 0.81 
1 1 1 -58 4  6  o 53.86974 11.45113 109.3875  200.4 -0.7820587     22.90226 0.82 
1 1 1 -58 4  7  o 98.20182 6.367767 153.3840  340.0 -16.10966      12.73553 0.94 
1 1 1 -58 4  8  o 132.4945 5.008575 205.6752  296.9 -0.2573395     10.01715 0.97 
1 1 1 -58 4  9  o 152.7204 4.985934 164.3897  23.8  -30.88448      9.971869 0.96 
1 1 1 -58 4  10 o 245.6093 4.094200 299.6999  29.5  -18.70125      8.188399 0.99 
1 1 1 -58 4  11 o 44.72058 10.20928 15.50196  132.3 -30.81555      20.41857 0.19 
1 1 1 -58 4  12 o 84.87482 7.297419 95.51482  38.0  -21.79346      14.59484 0.88 
1 1 1 -58 4  13 o 99.52797 7.915872 126.4304  328.6 11.01472       15.83174 0.93 
1 1 1 -58 4  14 o 83.84755 9.339932 92.18004  17.4  30.31080       18.67986 0.88 
1 1 1 -58 4  15 o 46.20123 10.85098 24.70899  206.0 19.88239       21.70196 0.31 
1 1 1 -58 4  16 o 57.89784 12.12518 26.67823  69.5  2.228008       24.25036 0.41 
1 1 1 -58 4  17 o 35.72652 11.02562 58.54364  54.4  -3.020420      22.05123 0.54 
1 1 1 -58 4  18 o 116.3734 6.509759 177.9788  220.6 -31.09872      13.01952 0.97 
1 1 1 -58 4  19 o 53.28526 9.856311 74.26292  201.4 30.56204       19.71262 0.80 
1 1 1 -58 4  20 o 113.7589 10.01004 115.3353  304.8 34.21896       20.02009 0.95 
1 1 1 -58 4  21 o 83.83221 8.041371 135.4787  266.4 -12.93987      16.08274 0.95 
1 1 1 -58 4  22 f 117.8394 5.788175 168.2705  105.5 3.248154       11.57635 0.00 
1 1 1 -58 4  23 o 74.78111 8.519441 105.9781  302.6 -0.7906494     17.03888 0.94 
1 1 1 -58 4  24 o 193.9627 4.543453 324.7053  255.5 -7.713501      9.086905 0.99 
1 1 1 -58 4  25 o 69.26121 9.759628 81.83618  154.6 13.76699       19.51926 0.92 
1 1 1 -58 4  26 o 48.95676 10.52614 70.76388  0.1   -8.637169      21.05228 0.87 
1 1 1 -58 4  27 o 127.0106 5.508996 201.8474  281.0 3.811577       11.01799 0.99 
1 1 1 -58 4  28 o 59.18556 10.49551 65.21977  312.8 8.460129       20.99103 0.89 
1 1 1 -58 4  29 o 38.28910 10.94146 48.46697  38.4  ?              ?        0.77 
1 1 1 -58 6  1  o 40.72025 10.87678 79.81516  58.7  -2.323940      21.75356 0.81 
1 1 1 -58 6  2  o 60.36484 9.959306 33.61069  336.9 39.96912       19.91861 0.66 
1 1 1 -58 6  3  o 77.31311 7.692473 90.35440  16.6  1.591675       15.38495 0.91 
1 1 1 -58 6  4  o 116.4967 6.336948 180.8243  77.8  -22.01170      12.67390 0.97 
1 1 1 -58 6  5  o 49.65496 9.664113 40.48175  335.1 -29.89850      19.32823 0.60 
1 1 1 -58 6  6  o 163.9073 4.806165 198.6203  304.5 -2.685471      9.612329 0.98 
1 1 1 -58 6  7  o 79.14854 7.793006 125.3677  18.7  4.389946       15.58601 0.93 
1 1 1 -58 6  8  o 174.8672 4.605394 215.7711  57.2  3.164795       9.210789 0.98 
1 1 1 -58 6  9  o 102.4149 5.933940 122.1068  45.5  -21.73339      11.86788 0.94 
1 1 1 -58 6  10 f 38.41999 11.70724 83.16125  81.8  5.008484       23.41449 0.00 
1 1 1 -58 6  11 o 90.64647 6.757843 109.7041  239.6 -8.587997      13.51569 0.93 
1 1 1 -58 6  12 o 83.93716 8.219930 143.3627  215.0 -29.36765      16.43986 0.94 
1 1 1 -58 6  13 o 92.73589 6.841353 116.7083  340.2 -2.479439      13.68271 0.94 
1 1 1 -58 6  14 o 118.5452 6.903087 149.7852  320.5 9.583847       13.80617 0.96 
1 1 1 -58 6  15 o 200.5457 4.210986 256.6861  341.5 -26.00021      8.421971 0.99 
1 1 1 -58 6  16 o 34.62188 10.61802 65.28911  272.1 -16.27954      21.23604 0.67 
1 1 1 -58 6  17 o 137.6774 5.759387 208.5838  160.9 3.812500       11.51877 0.98 
1 1 1 -58 6  18 o 33.67266 10.14297 26.96255  288.3 -24.93975      20.28594 0.39 
1 1 1 -58 6  19 o 167.5114 4.869563 205.8456  45.4  9.964172       9.739125 0.99 
1 1 1 -58 6  20 o 61.12651 10.54279 61.85684  17.9  -27.43145      21.08558 0.86 
1 1 1 -58 6  21 o 55.50542 11.65690 109.3880  228.3 -0.1377869E-01 23.31380 0.92 
1 1 1 -58 6  22 o 68.04391 10.04184 81.81720  83.3  -1.935394      20.08369 0.92 
1 1 1 -58 6  23 o 128.6946 5.570888 228.6385  307.9 -4.786774      11.14178 0.99 
1 1 1 -58 6  24 o 47.33410 11.68923 36.77719  270.4 -5.737766      23.37846 0.69 
1 1 1 -58 6  25 o 55.73413 10.83425 96.62442  116.4 19.48989       21.66850 0.92 
1 1 1 -58 6  26 o 29.87140 9.349841 49.82606  329.8 6.167416       18.69968 0.71 
1 1 1 -58 6  27 o 41.71975 10.86287 51.57260  138.2 ?              ?        0.81 
1 1 1 -58 8  1  o 48.41076 11.61746 22.74575  56.2  10.45523       23.23492 0.50 
1 1 1 -58 8  2  o 32.59580 10.08052 31.62918  289.4 -6.882902      20.16103 0.50 
1 1 1 -58 8  3  o 52.83764 10.42054 128.9119  223.1 -6.117619      20.84109 0.93 
1 1 1 -58 8  4  o 53.91796 12.85314 57.05287  181.9 -2.288120      25.70628 0.82 
1 1 1 -58 8  5  o 40.71076 10.92362 62.49725  358.0 10.41848       21.84724 0.80 
1 1 1 -58 8  6  o 65.58206 10.05606 108.3227  337.2 -40.31038      20.11212 0.94 
1 1 1 -58 8  7  o 147.4188 5.404191 202.7750  359.6 5.200562       10.80838 0.99 
1 1 1 -58 8  8  o 33.43248 10.43341 41.31048  24.2  -5.645315      20.86683 0.59 
1 1 1 -58 8  9  o 60.36583 9.327056 105.7218  185.7 -51.18104      18.65411 0.93 
1 1 1 -58 8  10 o 37.00849 10.28988 20.38074  9.3   14.06433       20.57975 0.37 
1 1 1 -58 8  11 o 52.70725 12.07552 34.04515  62.3  -16.79523      24.15104 0.66 
1 1 1 -58 8  12 o 146.9800 5.346569 199.4788  238.0 -1.081482      10.69314 0.99 
1 1 1 -58 8  13 o 45.74967 11.60682 57.75129  169.2 -14.34295      23.21364 0.79 
1 1 1 -58 8  14 o 38.12000 9.916128 97.01260  160.3 19.85509       19.83226 0.87 
1 1 1 -58 8  15 o 130.8708 5.395358 196.9451  127.3 -20.12196      10.79072 0.99 
1 1 1 -58 8  16 o 40.88337 11.28789 59.72838  135.8 -15.44689      22.57578 0.79 
1 1 1 -58 8  17 o 47.96360 10.41472 52.69585  239.4 21.02323       20.82944 0.81 
1 1 1 -58 8  18 o 37.23230 10.70578 57.47741  22.5  -16.94494      21.41157 0.77 
1 1 1 -58 8  19 o 92.29379 7.109495 111.8061  250.7 -2.918190      14.21899 0.96 
1 1 1 -58 8  20 o 89.52646 8.986991 129.0079  203.6 1.523926       17.97398 0.97 
1 1 1 -58 8  21 o 61.33177 10.16533 103.8588  148.9 -27.29736      20.33065 0.94 
1 1 1 -58 8  22 o 75.50749 11.05686 132.9516  149.9 -6.887825      22.11371 0.96 
1 1 1 -58 8  23 o 31.92961 10.07257 49.75563  17.4  ?              ?        0.73 
1 1 1 -58 8  24 o 31.38597 10.04980 18.00783  322.7 ?              ?        0.39 
1 1 1 -58 10 1  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -58 10 2  o 32.93033 10.93416 63.22900  163.0 ?              ?        0.80 
1 1 1 -58 10 3  o 34.44025 11.10231 82.58706  102.0 ?              ?        0.85 
1 1 1 -58 10 4  o 30.73160 9.725038 86.38715  167.0 ?              ?        0.85 
1 1 1 -58 10 5  o 39.11323 11.11305 25.64085  95.6  4.195217       22.22611 0.53 
1 1 1 -58 10 6  o 54.16721 11.40888 76.40344  107.9 4.959324       22.81775 0.89 
1 1 1 -58 10 7  o 55.21579 11.37889 85.89596  100.6 -38.11343      22.75778 0.91 
1 1 1 -58 10 8  o 30.35700 9.772590 49.31549  183.2 -1.360725      19.54518 0.69 
1 1 1 -58 10 9  o 36.84994 11.17622 53.20169  143.3 -4.535957      22.35244 0.75 
1 1 1 -58 10 10 o 46.46441 11.15910 71.29360  62.5  -19.28441      22.31820 0.86 
1 1 1 -58 10 11 o 76.13434 8.990240 70.68575  136.1 7.320045       17.98048 0.93 
1 1 1 -58 10 12 o 41.54647 11.00525 41.62984  225.0 8.727486       22.01050 0.72 
1 1 1 -58 10 13 f 51.14909 10.91229 46.59857  88.4  6.979420       21.82457 0.00 
1 1 1 -58 10 14 o 53.47402 11.05216 71.57891  82.4  -17.67175      22.10433 0.89 
1 1 1 -58 10 15 o 73.89186 9.954144 117.3133  222.6 22.00781       19.90829 0.96 
1 1 1 -58 10 16 o 118.3466 6.386598 184.8816  196.3 ?              ?        0.99 
1 1 1 -58 10 17 o 32.67081 10.45500 49.11398  227.4 ?              ?        0.73 
1 1 1 -58 10 18 o 39.70161 10.15034 41.14731  178.3 ?              ?        0.76 
1 1 1 -58 10 19 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -57 1  1  o 66.14476 8.441228 96.85165  35.3  20.76507       16.88246 0.83 
1 1 1 -57 1  2  o 215.2509 3.608445 248.5922  275.2 33.05157       7.216889 0.98 
1 1 1 -57 1  3  o 85.16976 7.168916 136.3238  266.0 0.8822021      14.33783 0.91 
1 1 1 -57 1  4  o 130.3680 4.861675 147.4634  147.5 -53.48817      9.723351 0.95 
1 1 1 -57 1  5  o 166.1049 4.030714 147.8476  232.2 -17.24255      8.061428 0.97 
1 1 1 -57 1  6  o 101.7254 6.592520 150.6336  211.3 -31.45725      13.18504 0.95 
1 1 1 -57 1  7  o 46.53136 11.76891 91.14812  178.3 4.341122       23.53782 0.77 
1 1 1 -57 1  8  o 96.93185 7.105023 86.99294  42.1  1.869080       14.21005 0.91 
1 1 1 -57 1  9  o 55.27566 10.94751 51.66602  48.7  4.802269       21.89502 0.67 
1 1 1 -57 1  10 o 49.10386 11.64952 74.86871  149.8 -7.230705      23.29903 0.75 
1 1 1 -57 1  11 o 122.1131 6.329748 170.5825  179.7 26.84145       12.65950 0.96 
1 1 1 -57 1  12 o 91.04556 7.843706 56.08305  69.5  12.24958       15.68741 0.84 
1 1 1 -57 1  13 o 43.76297 11.16075 74.33380  39.4  -13.68073      22.32150 0.70 
1 1 1 -57 1  14 o 97.03490 8.229025 195.6888  303.3 45.62874       16.45805 0.96 
1 1 1 -57 1  15 o 128.3689 6.192648 157.5731  242.5 -19.40614      12.38530 0.96 
1 1 1 -57 1  16 o 120.8174 6.246797 126.6075  110.8 -13.79970      12.49359 0.94 
1 1 1 -57 1  17 o 137.2072 4.910010 250.4062  51.5  9.751266       9.820021 0.97 
1 1 1 -57 1  18 o 43.97638 11.28328 69.89642  155.6 -8.926392      22.56657 0.62 
1 1 1 -57 1  19 o 156.8898 4.602722 213.6460  205.6 -29.66222      9.205443 0.97 
1 1 1 -57 1  20 o 85.17827 8.427249 121.6022  215.5 5.326439       16.85450 0.92 
1 1 1 -57 1  21 o 186.2182 4.398688 243.8050  284.2 -13.03943      8.797377 0.98 
1 1 1 -57 1  22 o 73.32802 7.089481 146.6890  358.6 -13.61832      14.17896 0.93 
1 1 1 -57 1  23 o 163.8295 4.568487 197.8399  66.3  12.98283       9.136974 0.98 
1 1 1 -57 1  24 o 29.97311 9.247416 70.82806  311.6 -5.835831      18.49483 0.68 
1 1 1 -57 1  25 o 139.6482 5.026636 162.3916  11.0  0.4147949      10.05327 0.98 
1 1 1 -57 1  26 o 186.4836 4.361852 230.2073  342.3 15.45334       8.723703 0.99 
1 1 1 -57 1  27 o 81.85965 6.589683 94.74977  323.6 -6.330391      13.17937 0.95 
1 1 1 -57 1  28 o 42.46207 12.29299 95.56735  44.1  -8.382877      24.58598 0.88 
1 1 1 -57 1  29 o 52.01632 9.403948 37.93107  196.1 -38.23682      18.80790 0.76 
1 1 1 -57 1  30 o 48.85136 11.43243 70.51778  147.3 -16.61780      22.86487 0.87 
1 1 1 -57 1  31 o 39.20332 10.60196 38.11559  68.0  ?              ?        0.72 
1 1 1 -57 3  1  o 155.5814 4.077448 221.0663  343.8 -8.521271      8.154897 0.97 
1 1 1 -57 3  2  o 148.1814 4.183861 141.9445  295.7 -0.5321655     8.367723 0.96 
1 1 1 -57 3  3  o 95.36456 5.866090 143.4291  64.5  -8.247406      11.73218 0.93 
1 1 1 -57 3  4  o 65.99223 8.650718 118.2937  17.3  37.76448       17.30144 0.86 
1 1 1 -57 3  5  o 37.05736 10.43824 105.6816  7.6   6.682804       20.87647 0.69 
1 1 1 -57 3  6  o 139.8674 4.611821 139.6244  83.1  3.676941       9.223641 0.95 
1 1 1 -57 3  7  f 82.38541 7.633191 94.48389  16.1  4.173431       15.26638 0.00 
1 1 1 -57 3  8  o 254.8486 4.080651 215.1974  113.2 23.10091       8.161303 0.98 
1 1 1 -57 3  9  f 164.9952 4.579630 151.0842  346.6 1.529434       9.159261 0.00 
1 1 1 -57 3  10 o 184.9639 4.294232 232.8375  335.6 -7.075851      8.588464 0.98 
1 1 1 -57 3  11 o 59.06302 11.91318 75.82841  2.6   -17.01525      23.82636 0.76 
1 1 1 -57 3  12 o 103.9419 7.848619 94.03233  179.8 54.13051       15.69724 0.91 
1 1 1 -57 3  13 o 106.5409 6.832353 148.6277  194.4 -3.521866      13.66471 0.94 
1 1 1 -57 3  14 o 124.0743 6.196767 122.1170  342.0 14.64993       12.39353 0.94 
1 1 1 -57 3  15 o 116.6456 6.333483 126.3394  290.2 -6.696373      12.66697 0.94 
1 1 1 -57 3  16 o 38.24580 11.02652 91.12944  192.3 -10.78845      22.05304 0.67 
1 1 1 -57 3  17 o 79.42736 8.137449 88.99670  181.4 -11.94073      16.27490 0.86 
1 1 1 -57 3  18 o 71.73923 10.06517 186.4288  223.1 12.84125       20.13034 0.93 
1 1 1 -57 3  19 o 53.77142 10.56476 69.90687  87.8  34.20546       21.12953 0.73 
1 1 1 -57 3  20 o 153.9527 4.937976 175.3210  167.8 -14.60588      9.875953 0.97 
1 1 1 -57 3  21 o 126.7876 5.441409 185.0656  140.7 -3.035606      10.88282 0.97 
1 1 1 -57 3  22 o 153.3838 5.141896 210.4410  37.2  -18.70459      10.28379 0.98 
1 1 1 -57 3  23 o 97.43039 10.20240 123.2626  268.2 45.54319       20.40481 0.95 
1 1 1 -57 3  24 o 141.1445 5.027338 192.2269  212.0 24.88220       10.05468 0.98 
1 1 1 -57 3  25 o 41.21658 10.23234 101.4100  217.8 -25.77225      20.46467 0.88 
1 1 1 -57 3  26 o 51.66058 10.33680 49.11706  169.7 -26.86983      20.67360 0.81 
1 1 1 -57 3  27 o 70.11339 9.080135 103.1939  206.5 4.010139       18.16027 0.94 
1 1 1 -57 3  28 o 40.07861 10.17627 51.78326  184.8 13.95024       20.35253 0.76 
1 1 1 -57 3  29 o 55.51103 10.57861 56.76786  143.4 2.095108       21.15722 0.86 
1 1 1 -57 3  30 o 51.28959 11.41667 76.96318  359.0 ?              ?        0.90 
1 1 1 -57 5  1  o 175.9389 3.903561 228.8885  90.6  -19.13739      7.807121 0.98 
1 1 1 -57 5  2  o 158.5251 4.647374 188.9892  89.3  -9.842239      9.294747 0.98 
1 1 1 -57 5  3  o 63.88419 10.00233 109.4380  148.4 -37.49143      20.00466 0.87 
1 1 1 -57 5  4  o 68.94891 8.907551 71.83730  107.7 -31.23535      17.81510 0.80 
1 1 1 -57 5  5  o 92.55585 8.547473 129.1344  109.8 -55.16370      17.09495 0.92 
1 1 1 -57 5  6  o 179.9826 4.193859 259.5911  141.7 -10.57353      8.387718 0.98 
1 1 1 -57 5  7  o 98.96507 7.178315 124.5652  74.4  26.68368       14.35663 0.93 
1 1 1 -57 5  8  o 140.3142 5.400468 179.3298  223.3 4.738068       10.80094 0.97 
1 1 1 -57 5  9  o 56.82928 9.716932 61.24782  104.5 -23.80112      19.43386 0.69 
1 1 1 -57 5  10 o 48.10799 11.28330 55.50970  346.1 -13.03207      22.56660 0.58 
1 1 1 -57 5  11 o 51.06897 10.83716 70.87646  246.2 -3.623596      21.67432 0.70 
1 1 1 -57 5  12 o 120.2813 5.528492 157.0702  142.3 18.99252       11.05698 0.95 
1 1 1 -57 5  13 o 43.95909 11.22388 69.15424  293.9 -1.247391      22.44777 0.64 
1 1 1 -57 5  14 o 63.49487 10.91047 48.07367  286.7 -32.85160      21.82094 0.65 
1 1 1 -57 5  15 o 87.04070 9.523292 51.45276  297.7 35.81862       19.04658 0.79 
1 1 1 -57 5  16 o 128.4571 6.186744 175.8097  120.0 -8.427643      12.37349 0.97 
1 1 1 -57 5  17 o 162.3167 6.856310 194.3097  126.1 15.25792       13.71262 0.98 
1 1 1 -57 5  18 o 89.79910 7.672910 188.7175  280.2 9.995377       15.34582 0.96 
1 1 1 -57 5  19 o 39.72437 11.03071 60.27577  241.0 -14.00655      22.06142 0.66 
1 1 1 -57 5  20 o 27.25881 8.793391 33.52601  155.0 6.305918       17.58678 0.36 
1 1 1 -57 5  21 o 89.35429 8.193976 154.4447  277.6 37.15356       16.38795 0.96 
1 1 1 -57 5  22 o 39.52308 10.83950 36.43285  82.5  -0.2315598     21.67901 0.57 
1 1 1 -57 5  23 o 64.62361 9.356466 88.16915  347.7 14.23960       18.71293 0.92 
1 1 1 -57 5  24 o 39.33458 10.68479 44.55348  44.0  3.905262       21.36958 0.71 
1 1 1 -57 5  25 o 68.05740 10.44439 104.7704  150.0 -18.05092      20.88877 0.94 
1 1 1 -57 5  26 o 51.30248 10.99298 44.96386  330.2 -10.37489      21.98596 0.78 
1 1 1 -57 5  27 o 51.62029 10.74909 52.04647  252.4 32.57689       21.49818 0.83 
1 1 1 -57 5  28 o 36.02676 9.951210 26.50324  113.4 ?              ?        0.54 
1 1 1 -57 5  29 o 58.92090 10.18043 95.28242  37.1  ?              ?        0.94 
1 1 1 -57 7  1  o 82.38741 6.555164 95.37370  78.7  3.533234       13.11033 0.94 
1 1 1 -57 7  2  o 69.26450 9.652175 43.54890  58.9  37.00319       19.30435 0.80 
1 1 1 -57 7  3  o 29.61046 9.589025 15.22586  349.9 7.972654       19.17805 0.20 
1 1 1 -57 7  4  o 99.61356 5.830856 106.8614  171.4 -7.278503      11.66171 0.95 
1 1 1 -57 7  5  o 75.71124 9.338600 106.3589  299.7 14.47360       18.67720 0.92 
1 1 1 -57 7  6  o 85.71823 6.479371 115.8583  352.4 -16.75340      12.95874 0.94 
1 1 1 -57 7  7  o 72.81198 11.91573 101.8891  103.9 28.27465       23.83146 0.90 
1 1 1 -57 7  8  o 95.49921 6.732959 113.0694  84.6  5.744766       13.46592 0.94 
1 1 1 -57 7  9  o 49.32722 10.57409 62.41610  34.6  29.70832       21.14817 0.74 
1 1 1 -57 7  10 o 95.03075 6.487469 149.9311  79.6  -4.615471      12.97494 0.96 
1 1 1 -57 7  11 o 39.50854 11.01808 43.25406  277.5 4.616188       22.03616 0.53 
1 1 1 -57 7  12 o 38.31612 10.44583 24.15438  225.3 -15.27828      20.89165 0.33 
1 1 1 -57 7  13 o 126.3856 5.850659 184.5357  16.8  7.228958       11.70132 0.97 
1 1 1 -57 7  14 o 54.28678 10.90994 86.90987  262.0 -0.3834114     21.81989 0.86 
1 1 1 -57 7  15 o 60.95881 10.56736 91.79134  201.0 1.916683       21.13472 0.89 
1 1 1 -57 7  16 o 30.01658 9.313834 23.16348  126.6 5.649630       18.62767 0.31 
1 1 1 -57 7  17 o 46.60659 11.11051 50.98606  108.4 -10.74395      22.22102 0.73 
1 1 1 -57 7  18 o 93.13091 9.416000 120.9653  314.7 32.14637       18.83200 0.96 
1 1 1 -57 7  19 o 39.86389 10.34919 13.45453  303.2 21.54646       20.69838 0.28 
1 1 1 -57 7  20 o 81.79872 9.035166 61.99973  232.8 8.275566       18.07033 0.92 
1 1 1 -57 7  21 o 94.48038 7.500123 101.0085  245.4 -14.69434      15.00025 0.96 
1 1 1 -57 7  22 o 28.88157 9.510255 10.50901  143.8 -3.801609      19.02051 0.18 
1 1 1 -57 7  23 o 132.6417 5.635863 197.7590  319.5 12.68442       11.27173 0.99 
1 1 1 -57 7  24 o 79.62157 8.048996 121.4391  253.2 9.105957       16.09799 0.96 
1 1 1 -57 7  25 o 106.6456 6.601461 129.8073  227.9 -15.58112      13.20292 0.98 
1 1 1 -57 7  26 o 49.97678 11.22046 93.15154  276.5 ?              ?        0.92 
1 1 1 -57 7  27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -57 9  1  o 39.57803 12.77225 59.17349  295.8 15.80867       25.54450 0.76 
1 1 1 -57 9  2  o 40.23093 9.543478 78.39919  333.9 -26.19927      19.08696 0.85 
1 1 1 -57 9  3  o 73.56517 8.940804 75.35662  179.1 12.74747       17.88161 0.92 
1 1 1 -57 9  4  o 91.40331 7.620373 147.1310  144.7 -7.618721      15.24075 0.97 
1 1 1 -57 9  5  o 113.6969 6.820245 161.9006  120.8 -13.12813      13.64049 0.98 
1 1 1 -57 9  6  o 70.86971 9.897195 103.2783  145.1 3.331451       19.79439 0.94 
1 1 1 -57 9  7  o 56.43430 10.73773 64.06704  0.4   -13.58587      21.47546 0.87 
1 1 1 -57 9  8  o 35.35164 10.13218 25.00022  321.1 -21.04994      20.26436 0.46 
1 1 1 -57 9  9  o 44.42453 11.26307 89.09331  185.6 17.50566       22.52614 0.88 
1 1 1 -57 9  10 o 31.59365 9.384077 55.03226  118.9 12.48351       18.76815 0.72 
1 1 1 -57 9  11 o 57.65103 10.90814 33.67269  57.4  -21.26601      21.81628 0.74 
1 1 1 -57 9  12 o 70.88484 9.248167 122.3597  241.4 7.875298       18.49633 0.95 
1 1 1 -57 9  13 o 35.96995 10.62615 31.71186  179.5 -9.621428      21.25229 0.56 
1 1 1 -57 9  14 o 57.25133 9.697083 120.6580  314.1 29.21359       19.39417 0.94 
1 1 1 -57 9  15 o 39.04995 11.15801 54.12080  203.6 -0.2475739E-01 22.31602 0.76 
1 1 1 -57 9  16 o 118.2325 6.437073 123.2766  169.9 -3.193085      12.87415 0.97 
1 1 1 -57 9  17 o 40.08443 11.26600 99.24888  232.8 -4.146366      22.53199 0.88 
1 1 1 -57 9  18 o 67.74985 10.16366 100.0678  13.5  -0.8076859     20.32732 0.94 
1 1 1 -57 9  19 o 94.36982 7.420181 136.2498  268.6 10.12268       14.84036 0.97 
1 1 1 -57 9  20 o 152.2531 5.389144 260.7058  229.4 -8.889267      10.77829 0.99 
1 1 1 -57 9  21 o 38.26311 10.99717 83.47268  290.7 5.621914       21.99434 0.87 
1 1 1 -57 9  22 o 78.17555 9.673368 123.7135  23.7  ?              ?        0.96 
1 1 1 -57 9  23 x ?        ?        72.71336  350.6 ?              ?        0.00 
1 1 1 -57 11 4  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -57 11 5  x ?        ?        205.6030  7.2   ?              ?        0.00 
1 1 1 -57 11 6  o 29.74431 9.451883 5.057050  229.0 ?              ?        0.11 
1 1 1 -57 11 7  o 39.99837 11.27811 75.30403  143.8 ?              ?        0.87 
1 1 1 -57 11 8  o 32.94285 10.32433 70.03279  63.2  ?              ?        0.83 
1 1 1 -57 11 9  o 44.20140 11.47719 41.18515  58.6  ?              ?        0.75 
1 1 1 -57 11 10 o 29.82969 9.939692 41.62675  30.9  ?              ?        0.66 
1 1 1 -57 11 11 o 45.59867 9.689411 53.83157  10.9  ?              ?        0.84 
1 1 1 -57 11 12 o 31.92756 9.936337 67.75043  307.8 ?              ?        0.82 
1 1 1 -57 11 13 o 62.65664 10.65051 96.57791  348.8 ?              ?        0.94 
1 1 1 -57 11 14 o 45.47134 13.07536 78.76389  12.3  ?              ?        0.88 
1 1 1 -57 11 15 o 41.73067 11.67329 79.58401  342.8 ?              ?        0.88 
1 1 1 -56 0  1  o 206.0878 5.012963 208.8173  0.0   -0.000000      0.000000 1.00 
1 1 1 -56 0  2  o 99.91843 7.379660 78.17548  0.0   -0.000000      0.000000 0.98 
1 1 1 -56 0  3  o 57.61339 13.32404 89.32915  180.0 -0.000000      0.000000 0.91 
1 1 1 -56 0  4  o 15.89112 11.38618 39.51553  180.0 -0.000000      0.000000 0.20 
1 1 1 -56 0  5  o 132.6943 6.603677 154.2760  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  6  o 96.86861 7.432011 183.6357  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  7  o 25.17521 16.23462 35.22036  360.0 -0.000000      0.000000 0.30 
1 1 1 -56 0  8  o 80.04360 10.03553 123.5523  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  9  o 198.6303 6.282857 199.0934  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  10 o 173.3430 6.951248 204.3362  360.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  11 o 278.9008 6.289643 312.6734  0.0   -0.000000      0.000000 1.00 
1 1 1 -56 0  12 o 62.10984 20.53440 32.19215  360.0 -0.000000      0.000000 0.57 
1 1 1 -56 0  13 f 39.85554 19.92899 98.87487  360.0 -0.000000      0.000000 0.00 
1 1 1 -56 0  14 o 136.9840 7.514536 164.2118  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  15 o 181.8755 6.571866 265.2359  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  16 o 40.72492 19.92198 89.35513  360.0 -0.000000      0.000000 0.79 
1 1 1 -56 0  17 o 19.04945 13.37719 66.62939  0.0   -0.000000      0.000000 0.37 
1 1 1 -56 0  18 o 209.7238 6.203862 316.4228  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  19 f 231.2404 5.893478 298.1272  180.0 -0.000000      0.000000 0.00 
1 1 1 -56 0  20 o 122.2375 7.926727 158.1713  180.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  21 o 88.54704 9.324752 103.5222  0.0   -0.000000      0.000000 0.99 
1 1 1 -56 0  22 o 77.06396 9.837971 92.27184  0.0   -0.000000      0.000000 0.98 
1 1 1 -56 0  23 o 192.8670 5.358707 232.1121  0.0   -0.000000      0.000000 1.00 
1 1 1 -56 0  24 o 68.04329 14.42261 3.108093  180.0 -0.000000      0.000000 0.08 
1 1 1 -56 0  25 o 92.50307 9.002640 129.0587  360.0 -0.000000      0.000000 1.00 
1 1 1 -56 0  26 o 32.10497 16.73980 75.67209  0.0   -0.000000      0.000000 0.82 
1 1 1 -56 0  27 o 71.25884 14.86732 114.3997  0.0   -0.000000      0.000000 1.00 
1 1 1 -56 0  28 o 25.20435 15.26054 40.51601  0.0   -0.000000      0.000000 0.53 
1 1 1 -56 0  29 o 37.44133 18.86004 48.15638  0.0   -0.000000      0.000000 0.73 
1 1 1 -56 0  30 o 50.96863 18.06765 85.23884  180.0 -0.000000      0.000000 0.98 
1 1 1 -56 0  31 o 35.27003 22.94128 52.67294  180.0 ?              ?        0.73 
1 1 1 -56 2  1  o 108.4458 5.241459 179.2193  40.1  -4.130249      10.48292 0.95 
1 1 1 -56 2  2  o 90.98521 5.654264 89.60544  333.4 -16.25262      11.30853 0.87 
1 1 1 -56 2  3  o 59.93830 8.628918 52.43944  119.5 17.28120       17.25784 0.65 
1 1 1 -56 2  4  o 46.83385 11.08678 106.9929  352.2 -4.644814      22.17356 0.80 
1 1 1 -56 2  5  o 187.7157 4.143507 260.0268  319.9 -29.11378      8.287014 0.98 
1 1 1 -56 2  6  o 31.69842 9.758991 21.71704  53.6  -0.8447838E-01 19.51798 0.22 
1 1 1 -56 2  7  o 166.4982 4.853177 224.5151  175.6 26.52679       9.706353 0.98 
1 1 1 -56 2  8  o 301.5217 3.955906 333.2904  121.8 -1.615601      7.911812 0.99 
1 1 1 -56 2  9  o 191.6427 4.437291 204.6970  164.7 -41.65842      8.874581 0.98 
1 1 1 -56 2  10 o 106.4120 6.126901 141.2218  206.7 -1.659508      12.25380 0.96 
1 1 1 -56 2  11 o 152.2543 5.328933 125.4510  359.8 1.894928       10.65787 0.97 
1 1 1 -56 2  12 o 237.3951 4.478501 313.8513  73.7  12.51245       8.957002 0.99 
1 1 1 -56 2  13 o 121.7038 6.342670 188.2894  172.3 -19.44099      12.68534 0.97 
1 1 1 -56 2  14 f 70.21948 9.532983 86.99982  291.6 11.51995       19.06597 0.00 
1 1 1 -56 2  15 o 101.6545 6.520709 129.0795  251.6 -10.96387      13.04142 0.94 
1 1 1 -56 2  16 o 60.62191 10.20654 139.0159  228.2 -35.80886      20.41309 0.89 
1 1 1 -56 2  17 o 103.2765 6.922068 145.4487  5.9   2.563377       13.84414 0.94 
1 1 1 -56 2  18 o 78.07956 9.082291 111.4642  266.5 36.09979       18.16458 0.89 
1 1 1 -56 2  19 o 136.1456 5.424095 183.2066  343.5 27.71953       10.84819 0.96 
1 1 1 -56 2  20 o 99.80357 5.875649 138.9347  77.7  -17.42202      11.75130 0.94 
1 1 1 -56 2  21 f 49.36828 10.56502 41.90092  42.8  -1.889561      21.13004 0.00 
1 1 1 -56 2  22 o 49.15717 10.54099 77.27094  162.7 -5.488827      21.08197 0.76 
1 1 1 -56 2  23 o 38.66383 9.765527 42.46688  7.8   17.21594       19.53105 0.51 
1 1 1 -56 2  24 o 91.66859 6.550741 59.13046  202.5 16.03967       13.10148 0.89 
1 1 1 -56 2  25 o 66.93658 8.541580 111.3992  43.7  -6.315517      17.08316 0.93 
1 1 1 -56 2  26 o 131.0236 5.174336 148.3748  331.5 25.17741       10.34867 0.98 
1 1 1 -56 2  27 o 100.9691 6.223741 171.8383  228.2 -8.387138      12.44748 0.98 
1 1 1 -56 2  28 o 70.24524 9.237496 85.69841  219.5 14.96072       18.47499 0.93 
1 1 1 -56 2  29 o 47.18894 10.98365 79.88545  204.7 2.304783       21.96731 0.88 
1 1 1 -56 2  30 o 65.74692 9.819552 69.23582  263.6 6.904457       19.63910 0.91 
1 1 1 -56 2  31 o 74.94333 9.443837 83.29782  270.4 ?              ?        0.94 
1 1 1 -56 4  1  o 173.4780 3.900574 218.8130  73.2  -3.230225      7.801149 0.98 
1 1 1 -56 4  2  f 86.98656 7.455689 98.33553  214.8 20.72215       14.91138 0.00 
1 1 1 -56 4  3  o 262.3620 3.974633 304.1322  198.6 -40.87685      7.949266 0.99 
1 1 1 -56 4  4  o 134.9124 5.217022 149.7083  280.2 -24.85457      10.43404 0.95 
1 1 1 -56 4  5  o 47.83755 11.23039 61.27340  239.3 -2.759426      22.46078 0.59 
1 1 1 -56 4  6  o 203.2019 3.959471 223.6637  133.7 -6.601028      7.918941 0.98 
1 1 1 -56 4  7  o 272.6103 3.812609 340.6463  184.2 -20.30890      7.625219 0.99 
1 1 1 -56 4  8  o 291.9838 4.180744 404.8401  156.5 10.60910       8.361488 0.99 
1 1 1 -56 4  9  o 135.0139 5.025182 200.6728  37.2  24.96673       10.05036 0.97 
1 1 1 -56 4  10 o 199.4215 4.197318 237.8313  240.8 -13.13832      8.394636 0.98 
1 1 1 -56 4  11 o 55.30503 10.58332 76.55917  233.8 14.64011       21.16663 0.76 
1 1 1 -56 4  12 o 108.3173 7.062349 182.5313  109.8 10.46448       14.12470 0.96 
1 1 1 -56 4  13 o 51.04295 10.25135 55.69580  345.1 31.13742       20.50270 0.62 
1 1 1 -56 4  14 o 35.60918 10.67033 57.89728  217.1 -6.911007      21.34067 0.49 
1 1 1 -56 4  15 o 117.5634 6.315981 142.6796  229.3 -1.131073      12.63196 0.94 
1 1 1 -56 4  16 o 49.10921 12.59454 52.25436  108.3 5.201202       25.18908 0.55 
1 1 1 -56 4  17 o 89.22614 7.186115 111.0645  175.4 13.86616       14.37223 0.91 
1 1 1 -56 4  18 o 99.45618 6.583751 88.42341  102.4 -1.968216      13.16750 0.90 
1 1 1 -56 4  19 o 143.4381 4.809092 249.7263  103.7 8.449295       9.618183 0.98 
1 1 1 -56 4  20 o 129.3913 8.515999 179.2181  178.7 22.10334       17.03200 0.97 
1 1 1 -56 4  21 o 73.68103 9.307077 68.73951  170.2 3.357536       18.61415 0.85 
1 1 1 -56 4  22 o 192.4684 4.249021 314.4501  51.5  -34.75705      8.498042 0.99 
1 1 1 -56 4  23 o 56.79622 9.257004 96.73017  57.5  0.5136337      18.51401 0.89 
1 1 1 -56 4  24 o 40.05219 10.00278 100.5589  158.1 19.04653       20.00555 0.86 
1 1 1 -56 4  25 o 40.19263 10.79349 63.26437  227.1 12.94247       21.58698 0.79 
1 1 1 -56 4  26 o 102.3689 6.044423 146.5651  136.0 10.55341       12.08885 0.98 
1 1 1 -56 4  27 o 59.97434 10.22201 132.5343  116.0 -11.33509      20.44401 0.95 
1 1 1 -56 4  28 o 63.34652 9.060427 134.2224  234.5 28.53676       18.12085 0.95 
1 1 1 -56 4  29 o 26.37596 8.835849 55.79256  167.3 5.941990       17.67170 0.70 
1 1 1 -56 4  30 o 67.23776 9.944724 102.4819  65.0  ?              ?        0.95 
1 1 1 -56 6  1  o 146.1636 5.012263 164.6345  219.2 17.11024       10.02453 0.97 
1 1 1 -56 6  2  o 81.90157 7.871970 79.36422  15.3  2.011139       15.74394 0.88 
1 1 1 -56 6  3  o 48.91221 10.95924 47.63287  314.4 1.840473       21.91848 0.58 
1 1 1 -56 6  4  o 132.2291 5.367820 199.2512  172.3 32.33891       10.73564 0.97 
1 1 1 -56 6  5  o 77.28385 8.212632 88.87111  195.1 13.15625       16.42526 0.87 
1 1 1 -56 6  6  o 115.4934 5.417631 118.3987  178.9 12.15134       10.83526 0.94 
1 1 1 -56 6  7  o 151.2955 4.532103 145.8903  134.8 -12.67261      9.064205 0.96 
1 1 1 -56 6  8  o 34.11040 10.07899 19.29051  166.9 19.16432       20.15799 0.19 
1 1 1 -56 6  9  o 68.24566 10.18144 50.57955  67.6  32.91717       20.36288 0.69 
1 1 1 -56 6  10 o 64.30582 9.797379 74.86893  156.2 33.00342       19.59476 0.79 
1 1 1 -56 6  11 o 138.5670 4.952218 184.7558  199.4 -16.74971      9.904436 0.97 
1 1 1 -56 6  12 o 135.2092 5.248641 192.6543  163.0 4.047379       10.49728 0.97 
1 1 1 -56 6  13 o 43.98301 10.43457 25.67040  109.3 15.54100       20.86915 0.32 
1 1 1 -56 6  14 o 40.45284 11.37580 58.07890  169.1 9.414833       22.75160 0.57 
1 1 1 -56 6  15 f 92.82117 6.984687 105.3913  222.6 -20.56522      13.96937 0.00 
1 1 1 -56 6  16 o 48.23472 10.28215 81.40648  346.1 -38.59071      20.56430 0.77 
1 1 1 -56 6  17 o 51.51773 10.70471 111.4872  285.4 19.64548       21.40941 0.86 
1 1 1 -56 6  18 o 152.3706 4.991325 248.3124  260.3 0.7923889      9.982650 0.98 
1 1 1 -56 6  19 o 92.33885 7.670920 132.0129  256.3 -17.28743      15.34184 0.95 
1 1 1 -56 6  20 f 45.14074 11.15030 40.45033  305.5 -20.45261      22.30061 0.00 
1 1 1 -56 6  21 o 60.07416 10.49511 104.3312  352.5 31.61871       20.99022 0.91 
1 1 1 -56 6  22 o 61.45092 9.651025 59.65863  265.7 6.959282       19.30205 0.86 
1 1 1 -56 6  23 o 85.21452 8.633691 113.9465  273.0 -4.392128      17.26738 0.96 
1 1 1 -56 6  24 o 36.50504 10.65726 29.41471  272.4 -7.721855      21.31452 0.53 
1 1 1 -56 6  25 o 31.33318 9.496616 68.94202  296.5 -9.345243      18.99323 0.78 
1 1 1 -56 6  26 o 44.22401 10.94670 75.16370  309.5 11.50195       21.89341 0.86 
1 1 1 -56 6  27 o 64.70302 9.113041 134.1288  285.5 -3.543488      18.22608 0.96 
1 1 1 -56 6  28 o 51.16303 10.76744 104.1897  7.3   ?              ?        0.93 
1 1 1 -56 8  1  o 67.88781 9.428546 62.99123  258.5 23.40181       18.85709 0.89 
1 1 1 -56 8  2  o 45.09155 11.11049 115.6880  61.8  0.3525581      22.22097 0.90 
1 1 1 -56 8  3  o 143.6180 4.706858 154.2373  93.0  -22.51114      9.413715 0.98 
1 1 1 -56 8  4  o 98.56312 9.294819 112.2381  118.4 ?              ?        0.95 
1 1 1 -56 8  5  o 90.91908 6.744953 129.4504  79.5  -1.815056      13.48991 0.96 
1 1 1 -56 8  6  o 86.47073 7.673460 100.9797  119.2 -9.052238      15.34692 0.94 
1 1 1 -56 8  7  o 177.4895 4.825515 236.1427  211.7 16.07089       9.651030 0.99 
1 1 1 -56 8  8  o 72.85832 10.12886 122.3770  221.1 5.322990       20.25771 0.93 
1 1 1 -56 8  9  o 63.97776 9.625407 102.3678  130.1 -38.35137      19.25081 0.91 
1 1 1 -56 8  10 o 123.3196 5.859335 168.8602  117.3 13.47572       11.71867 0.97 
1 1 1 -56 8  11 o 101.0839 6.470507 181.5210  343.2 -17.40805      12.94101 0.97 
1 1 1 -56 8  12 o 51.01594 10.35195 70.82519  29.7  -35.24242      20.70389 0.82 
1 1 1 -56 8  13 o 79.11173 9.470689 126.7819  306.2 35.59860       18.94138 0.94 
1 1 1 -56 8  14 o 124.4652 5.543236 207.1752  282.6 -4.128700      11.08647 0.98 
1 1 1 -56 8  15 o 62.89874 10.34450 127.6066  25.1  -32.37757      20.68901 0.93 
1 1 1 -56 8  16 o 131.2574 5.571790 198.0209  32.9  -16.06863      11.14358 0.98 
1 1 1 -56 8  17 o 33.41086 9.696775 80.63846  282.2 11.36396       19.39355 0.81 
1 1 1 -56 8  18 o 130.3055 5.678464 173.1040  320.0 -10.88680      11.35693 0.98 
1 1 1 -56 8  19 o 72.47762 10.07119 119.9130  14.3  -5.569633      20.14239 0.95 
1 1 1 -56 8  20 o 32.13488 9.909810 71.07325  283.0 4.868544       19.81962 0.79 
1 1 1 -56 8  21 o 105.2665 6.823578 130.8945  269.8 5.413780       13.64716 0.97 
1 1 1 -56 8  22 o 31.36096 10.01669 71.69513  309.4 -3.289640      20.03338 0.79 
1 1 1 -56 8  23 o 40.20193 10.47063 25.35499  46.7  -24.66059      20.94126 0.54 
1 1 1 -56 8  24 o 26.46722 8.926650 24.60696  307.9 0.5312347E-01  17.85330 0.42 
1 1 1 -56 8  25 o 50.21152 11.28701 117.2483  336.3 ?              ?        0.93 
1 1 1 -56 8  26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -56 10 1  o 49.61082 13.67183 25.55525  42.8  -7.651649      27.34366 0.57 
1 1 1 -56 10 2  o 90.22444 11.54716 105.1825  201.2 -5.634956      23.09433 0.95 
1 1 1 -56 10 3  o 71.08820 10.98045 69.27338  212.0 -10.12366      21.96090 0.91 
1 1 1 -56 10 4  o 40.71809 10.93156 102.8766  5.8   12.52592       21.86311 0.89 
1 1 1 -56 10 5  o 94.63110 7.135159 92.97702  4.5   19.81121       14.27032 0.96 
1 1 1 -56 10 6  o 63.09218 10.65113 51.99442  178.1 11.88948       21.30226 0.86 
1 1 1 -56 10 7  o 29.28687 9.457305 68.79375  127.3 -8.559654      18.91461 0.76 
1 1 1 -56 10 8  o 31.51888 9.952910 18.15071  313.8 2.813509       19.90582 0.32 
1 1 1 -56 10 9  f 38.95267 10.80364 85.74442  268.7 -14.60239      21.60729 0.00 
1 1 1 -56 10 10 o 61.16183 10.91164 125.7447  252.5 -14.85005      21.82328 0.94 
1 1 1 -56 10 11 o 60.61639 10.02626 78.68698  259.3 -24.35508      20.05253 0.91 
1 1 1 -56 10 12 o 57.07706 12.03435 68.30704  235.4 -12.89890      24.06871 0.88 
1 1 1 -56 10 13 o 86.89732 8.741784 143.6525  71.0  20.18166       17.48357 0.97 
1 1 1 -56 10 14 o 84.62186 9.247307 148.3953  57.2  22.91367       18.49461 0.97 
1 1 1 -56 10 15 o 45.89308 10.77221 97.72694  186.3 12.69149       21.54443 0.90 
1 1 1 -56 10 16 o 115.0380 6.833675 173.1459  143.1 12.32677       13.66735 0.98 
1 1 1 -56 10 17 o 35.80023 10.60176 50.83426  114.6 5.060093       21.20352 0.74 
1 1 1 -56 10 18 o 44.82547 10.98848 68.13540  30.5  -25.29615      21.97696 0.86 
1 1 1 -56 10 19 o 34.62372 10.83826 33.08004  30.8  ?              ?        0.60 
1 1 1 -56 10 20 o 42.75525 11.68237 73.77132  164.2 ?              ?        0.87 
1 1 1 -56 10 21 o 41.25923 11.59458 28.37839  41.2  ?              ?        0.63 
1 1 1 -55 1  1  o 158.6693 4.042656 167.1439  42.0  -7.941269      8.085312 0.97 
1 1 1 -55 1  2  o 136.7236 4.608604 192.9138  83.7  6.170319       9.217208 0.97 
1 1 1 -55 1  3  o 105.5264 5.619382 110.3056  116.5 35.55347       11.23876 0.94 
1 1 1 -55 1  4  o 54.36240 9.246397 84.52942  356.3 -22.06497      18.49279 0.83 
1 1 1 -55 1  5  o 49.20167 10.69323 31.25060  51.0  12.94742       21.38645 0.45 
1 1 1 -55 1  6  o 106.5810 7.467289 186.1053  149.6 77.43893       14.93458 0.96 
1 1 1 -55 1  7  o 243.9467 4.191805 282.0483  184.1 37.10925       8.383611 0.99 
1 1 1 -55 1  8  o 127.0771 5.788559 157.4356  214.0 26.93217       11.57712 0.96 
1 1 1 -55 1  9  o 110.1144 5.735727 162.6167  157.6 17.87862       11.47145 0.96 
1 1 1 -55 1  10 o 107.8823 6.449568 94.92454  222.6 21.17741       12.89914 0.92 
1 1 1 -55 1  11 o 246.0745 4.601762 355.5439  280.7 -6.542297      9.203525 0.99 
1 1 1 -55 1  12 o 100.8925 7.143701 171.4575  233.8 10.65414       14.28740 0.95 
1 1 1 -55 1  13 o 149.7181 5.299615 257.4787  73.9  23.38544       10.59923 0.98 
1 1 1 -55 1  14 o 40.29408 11.51892 91.04661  85.3  4.016685       23.03785 0.76 
1 1 1 -55 1  15 f 125.8069 5.664398 203.6471  203.4 -10.53672      11.32880 0.00 
1 1 1 -55 1  16 o 93.92591 6.696969 180.5276  227.9 -0.3025513     13.39394 0.96 
1 1 1 -55 1  17 o 31.29835 10.04039 96.95919  10.7  -14.72924      20.08078 0.71 
1 1 1 -55 1  18 o 87.37798 6.316648 102.2136  175.4 18.45605       12.63330 0.91 
1 1 1 -55 1  19 o 74.23623 8.140028 133.1227  316.4 -5.262726      16.28006 0.91 
1 1 1 -55 1  20 o 131.1190 4.892753 131.4198  85.2  1.284805       9.785505 0.95 
1 1 1 -55 1  21 o 80.31827 7.663825 136.4507  133.4 -9.825584      15.32765 0.92 
1 1 1 -55 1  22 o 71.92020 7.733694 153.0857  219.9 -11.87763      15.46739 0.92 
1 1 1 -55 1  23 o 77.19824 7.150060 86.74123  213.3 -11.31571      14.30012 0.88 
1 1 1 -55 1  24 o 212.4142 4.011786 270.9318  165.2 10.23703       8.023572 0.99 
1 1 1 -55 1  25 o 59.19158 10.16727 50.64434  334.1 -1.165108      20.33453 0.76 
1 1 1 -55 1  26 o 62.46241 9.619828 66.09888  211.1 -6.729122      19.23966 0.86 
1 1 1 -55 1  27 o 54.00552 8.871849 51.50035  158.7 -34.37656      17.74370 0.82 
1 1 1 -55 1  28 o 79.46426 9.967099 124.3724  332.1 -9.879837      19.93420 0.96 
1 1 1 -55 1  29 o 64.32851 9.649401 98.33643  38.9  23.76379       19.29880 0.93 
1 1 1 -55 1  30 o 62.03268 11.86339 107.2621  244.0 -13.15399      23.72678 0.93 
1 1 1 -55 1  31 o 80.47227 7.968059 106.9559  251.8 -9.287605      15.93612 0.96 
1 1 1 -55 1  32 f 31.18324 9.965655 47.19189  260.8 ?              ?        0.00 
1 1 1 -55 3  1  o 154.4285 4.215942 157.9797  29.2  -2.433807      8.431884 0.96 
1 1 1 -55 3  2  o 56.76552 9.487725 84.99564  126.8 -6.704815      18.97545 0.78 
1 1 1 -55 3  3  o 193.7368 4.276826 200.9861  213.5 -2.283524      8.553652 0.98 
1 1 1 -55 3  4  o 187.2105 3.950762 205.4389  253.8 -5.879700      7.901523 0.98 
1 1 1 -55 3  5  o 119.0655 4.874230 163.5781  313.8 17.30575       9.748461 0.96 
1 1 1 -55 3  6  o 101.1628 6.413720 117.1494  314.4 28.81340       12.82744 0.94 
1 1 1 -55 3  7  o 231.4514 3.654650 302.4412  174.4 14.81541       7.309300 0.99 
1 1 1 -55 3  8  o 146.8290 4.800150 145.4211  142.0 1.555359       9.600301 0.97 
1 1 1 -55 3  9  o 84.88030 7.047150 98.95025  273.3 8.572342       14.09430 0.92 
1 1 1 -55 3  10 o 176.5720 4.458426 258.2765  192.6 -14.55534      8.916852 0.99 
1 1 1 -55 3  11 o 54.97001 11.09104 33.05630  257.5 9.675617       22.18209 0.54 
1 1 1 -55 3  12 o 27.91759 9.194467 60.22331  336.1 0.9082794E-02  18.38893 0.54 
1 1 1 -55 3  13 o 83.18125 7.768599 117.7623  266.7 -10.52293      15.53720 0.93 
1 1 1 -55 3  14 o 216.4060 4.540560 298.8790  165.9 3.735291       9.081120 0.99 
1 1 1 -55 3  15 o 248.8091 4.133700 339.5111  219.2 -39.10066      8.267400 0.99 
1 1 1 -55 3  16 o 73.42619 8.346169 94.42216  288.9 -11.54237      16.69234 0.88 
1 1 1 -55 3  17 o 63.73243 9.107668 159.0094  176.9 -14.38995      18.21534 0.91 
1 1 1 -55 3  18 o 87.62453 7.031282 68.87153  53.7  9.354599       14.06256 0.84 
1 1 1 -55 3  19 o 83.75416 6.852519 115.9037  41.0  9.775314       13.70504 0.90 
1 1 1 -55 3  20 o 112.3725 5.425885 179.9604  206.8 -7.674904      10.85177 0.96 
1 1 1 -55 3  21 o 48.85018 10.68731 77.48588  228.8 7.927624       21.37463 0.73 
1 1 1 -55 3  22 o 74.46667 8.610060 121.6211  48.4  17.34402       17.22012 0.91 
1 1 1 -55 3  23 o 131.2595 8.026870 203.0245  341.7 -18.30587      16.05374 0.97 
1 1 1 -55 3  24 o 152.0902 4.738105 213.2101  216.5 14.87543       9.476210 0.98 
1 1 1 -55 3  25 o 102.1415 5.635341 170.9153  176.2 4.422768       11.27068 0.97 
1 1 1 -55 3  26 o 34.50394 9.303580 57.45293  246.3 -16.77028      18.60716 0.72 
1 1 1 -55 3  27 f 101.0152 5.752345 151.1808  238.6 -8.170311      11.50469 0.00 
1 1 1 -55 3  28 o 125.2307 5.325068 182.6380  200.0 7.649757       10.65014 0.98 
1 1 1 -55 3  29 o 57.07251 9.923230 78.69705  216.7 31.15181       19.84646 0.90 
1 1 1 -55 3  30 o 66.36240 10.61728 53.01352  110.5 -3.197746      21.23455 0.88 
1 1 1 -55 3  31 o 36.28497 10.32539 46.57571  222.8 ?              ?        0.75 
1 1 1 -55 5  1  o 87.00201 6.982825 115.7966  271.9 27.21066       13.96565 0.91 
1 1 1 -55 5  2  o 144.4647 4.374588 193.6365  325.2 -24.49591      8.749175 0.97 
1 1 1 -55 5  3  o 149.8722 4.610713 166.8303  214.4 -30.24039      9.221426 0.96 
1 1 1 -55 5  4  o 63.94527 9.622223 109.0252  306.6 -27.29316      19.24445 0.85 
1 1 1 -55 5  5  o 119.2796 4.851996 196.1768  305.4 -11.41741      9.703993 0.96 
1 1 1 -55 5  6  o 36.96178 10.89264 85.85436  11.3  1.135777       21.78528 0.63 
1 1 1 -55 5  7  o 145.4796 4.502527 161.3150  176.1 -30.92209      9.005054 0.96 
1 1 1 -55 5  8  o 165.4405 4.810812 151.2385  131.3 4.669250       9.621624 0.97 
1 1 1 -55 5  9  o 111.7057 6.067121 136.2180  51.7  6.389679       12.13424 0.94 
1 1 1 -55 5  10 o 52.52466 9.798800 126.4564  309.2 -21.12421      19.59760 0.86 
1 1 1 -55 5  11 o 56.12188 8.592501 81.79439  214.5 -47.61796      17.18500 0.78 
1 1 1 -55 5  12 o 69.63410 9.866348 150.4949  190.7 -6.647491      19.73270 0.91 
1 1 1 -55 5  13 o 132.8197 4.827160 202.7874  353.5 17.47494       9.654321 0.97 
1 1 1 -55 5  14 o 68.48579 10.40826 139.9117  311.1 -0.3642883     20.81652 0.90 
1 1 1 -55 5  15 o 104.3827 7.194602 180.5816  306.5 -2.764725      14.38920 0.95 
1 1 1 -55 5  16 o 139.9849 5.516663 207.8804  342.7 7.508926       11.03333 0.97 
1 1 1 -55 5  17 o 59.01019 13.34398 105.5568  265.2 -12.44476      26.68796 0.83 
1 1 1 -55 5  18 o 54.02925 10.17697 57.05263  196.7 4.395832       20.35394 0.67 
1 1 1 -55 5  19 o 83.17258 7.443470 134.9418  314.8 -7.049286      14.88694 0.93 
1 1 1 -55 5  20 o 54.88235 10.70998 47.75542  320.0 9.063015       21.41996 0.65 
1 1 1 -55 5  21 o 85.19209 8.308630 84.55647  102.5 -3.303795      16.61726 0.90 
1 1 1 -55 5  22 o 34.11745 10.04777 31.58774  45.2  -4.268770      20.09554 0.41 
1 1 1 -55 5  23 o 89.55034 6.745719 121.0592  302.4 2.482277       13.49144 0.95 
1 1 1 -55 5  24 o 47.47604 10.50080 53.74786  292.3 -9.832031      21.00160 0.78 
1 1 1 -55 5  25 o 122.6901 5.761678 184.3569  324.1 -7.807060      11.52336 0.98 
1 1 1 -55 5  26 o 41.45099 9.371754 16.57179  273.3 31.42876       18.74351 0.39 
1 1 1 -55 5  27 o 37.98898 10.90807 17.82561  204.9 4.890476       21.81614 0.37 
1 1 1 -55 5  28 o 57.46843 9.887609 108.1226  350.0 -19.20081      19.77522 0.93 
1 1 1 -55 5  29 o 48.62686 10.42671 65.41674  129.3 ?              ?        0.87 
1 1 1 -55 5  30 o 28.41153 8.849019 20.75068  288.9 ?              ?        0.42 
1 1 1 -55 7  1  o 64.27068 9.615472 86.54299  118.7 -20.19374      19.23094 0.88 
1 1 1 -55 7  2  o 48.27301 10.86965 103.4854  116.4 -14.60490      21.73930 0.85 
1 1 1 -55 7  3  o 94.39076 6.412138 111.9016  116.9 -36.64031      12.82428 0.93 
1 1 1 -55 7  4  o 92.67453 6.769541 117.0401  155.1 6.177628       13.53908 0.93 
1 1 1 -55 7  5  o 84.71974 7.852161 151.9576  71.7  -48.66383      15.70432 0.94 
1 1 1 -55 7  6  o 43.73478 8.576659 63.04123  13.9  -47.18006      17.15332 0.65 
1 1 1 -55 7  7  o 183.7785 5.930585 270.4465  204.7 -28.62280      11.86117 0.98 
1 1 1 -55 7  8  o 200.3874 4.003059 282.9135  194.7 9.404266       8.006119 0.99 
1 1 1 -55 7  9  o 70.96559 9.406765 111.6569  174.7 14.47250       18.81353 0.89 
1 1 1 -55 7  10 o 53.82556 10.23930 81.08105  316.2 23.52046       20.47860 0.78 
1 1 1 -55 7  11 o 51.84104 11.47708 25.83445  331.0 4.026779       22.95417 0.37 
1 1 1 -55 7  12 o 51.37089 10.72717 82.62519  105.3 8.481045       21.45434 0.78 
1 1 1 -55 7  13 o 95.48940 6.736946 178.8255  56.2  13.06797       13.47389 0.96 
1 1 1 -55 7  14 o 151.4097 4.847382 211.5857  50.7  -14.70151      9.694763 0.98 
1 1 1 -55 7  15 o 88.47928 7.123781 114.2201  271.4 7.241364       14.24756 0.93 
1 1 1 -55 7  16 o 35.66088 10.39006 5.877329  263.0 4.297440       20.78012 0.08 
1 1 1 -55 7  17 o 43.08639 10.45743 5.120302  246.4 -32.94521      20.91486 0.08 
1 1 1 -55 7  18 o 56.91796 11.44536 61.77883  30.3  -22.40460      22.89072 0.80 
1 1 1 -55 7  19 o 39.20340 11.36043 64.28489  71.7  -19.58377      22.72087 0.73 
1 1 1 -55 7  20 o 99.57418 6.744844 123.3698  111.3 0.2325439E-01  13.48969 0.96 
1 1 1 -55 7  21 f 117.8672 5.522058 214.4386  93.3  4.720131       11.04412 0.00 
1 1 1 -55 7  22 o 28.85072 9.344992 32.65852  14.4  0.2856693      18.68998 0.50 
1 1 1 -55 7  23 o 33.48654 9.885216 45.94749  69.9  -6.840984      19.77043 0.68 
1 1 1 -55 7  24 o 57.72989 10.35947 67.54244  177.6 -13.26789      20.71893 0.89 
1 1 1 -55 7  25 o 49.61773 10.87559 45.02624  281.4 -7.469181      21.75118 0.78 
1 1 1 -55 7  26 o 48.09282 10.27104 45.03841  55.4  -13.72104      20.54207 0.79 
1 1 1 -55 7  27 o 27.36914 9.008131 12.45905  313.4 ?              ?        0.24 
1 1 1 -55 7  28 o 29.07769 9.351821 56.96240  60.4  ?              ?        0.78 
1 1 1 -55 9  1  o 31.76783 10.82908 60.29178  22.5  10.62111       21.65815 0.72 
1 1 1 -55 9  2  o 40.45148 10.26647 66.94086  282.0 -13.17992      20.53294 0.82 
1 1 1 -55 9  3  o 88.48103 8.997758 144.1647  271.2 -31.79617      17.99552 0.97 
1 1 1 -55 9  4  o 98.75400 6.827360 127.5805  340.4 -28.85400      13.65472 0.97 
1 1 1 -55 9  5  o 57.62878 11.16504 67.46951  328.2 25.04356       22.33009 0.86 
1 1 1 -55 9  6  o 35.50395 10.16657 48.55300  18.1  10.98425       20.33314 0.66 
1 1 1 -55 9  7  o 27.83078 9.516184 38.09728  210.7 11.03453       19.03237 0.48 
1 1 1 -55 9  8  o 116.6712 6.019924 164.9923  325.3 13.54465       12.03985 0.98 
1 1 1 -55 9  9  o 42.42156 10.59609 78.30647  292.5 11.43921       21.19218 0.83 
1 1 1 -55 9  10 o 148.0754 4.538308 215.5672  202.4 -39.84337      9.076616 0.99 
1 1 1 -55 9  11 o 31.81437 9.830709 63.37103  299.5 1.279940       19.66142 0.71 
1 1 1 -55 9  12 o 107.2983 6.392384 123.1218  58.1  -3.333885      12.78477 0.97 
1 1 1 -55 9  13 o 76.75610 8.953432 124.2972  19.3  6.962494       17.90686 0.95 
1 1 1 -55 9  14 o 44.48689 11.51998 40.36327  119.5 6.523678       23.03996 0.68 
1 1 1 -55 9  15 o 77.60241 9.385653 155.5367  146.5 33.77851       18.77131 0.96 
1 1 1 -55 9  16 o 65.11005 11.03385 93.79591  20.8  -0.5467987E-01 22.06771 0.93 
1 1 1 -55 9  17 o 37.31279 10.85088 60.31663  191.9 -8.486916      21.70177 0.78 
1 1 1 -55 9  18 o 37.35437 10.83527 88.26375  227.7 -2.527657      21.67053 0.86 
1 1 1 -55 9  19 o 39.36505 10.99224 13.80654  51.8  -4.811188      21.98448 0.31 
1 1 1 -55 9  20 o 41.64034 10.90255 38.01281  204.6 11.79738       21.80509 0.68 
1 1 1 -55 9  21 o 71.34738 9.800381 133.1897  215.8 10.08703       19.60076 0.96 
1 1 1 -55 9  22 o 49.43796 11.36096 75.01297  335.7 15.52224       22.72192 0.88 
1 1 1 -55 9  23 o 106.4373 7.120086 90.92275  78.7  ?              ?        0.97 
1 1 1 -55 9  24 o 39.66206 11.61977 114.3784  195.2 ?              ?        0.91 
1 1 1 -55 11 1  o 45.77447 13.29792 128.3337  241.8 ?              ?        0.93 
1 1 1 -55 11 2  o 33.26010 10.90290 63.64901  281.2 ?              ?        0.80 
1 1 1 -55 11 3  o 37.49181 11.26745 27.21063  346.7 ?              ?        0.55 
1 1 1 -55 11 4  o 64.46945 12.64269 60.40707  108.8 22.95768       25.28538 0.88 
1 1 1 -55 11 5  o 55.66018 11.93194 59.38697  220.6 35.51516       23.86387 0.86 
1 1 1 -55 11 6  o 64.15916 11.47677 86.11198  253.6 8.549603       22.95353 0.92 
1 1 1 -55 11 7  o 43.83217 10.31002 57.64871  338.4 -35.82810      20.62004 0.82 
1 1 1 -55 11 8  o 40.87530 11.03759 97.58401  340.3 6.273193       22.07518 0.89 
1 1 1 -55 11 9  o 33.60604 10.14967 22.76760  319.6 -5.679190      20.29934 0.44 
1 1 1 -55 11 10 o 39.28571 10.06000 79.39693  202.3 22.41274       20.12000 0.86 
1 1 1 -55 11 11 o 69.26687 10.35178 119.3614  209.1 34.02758       20.70356 0.95 
1 1 1 -55 11 12 o 102.8706 7.332817 162.7147  220.3 9.037003       14.66563 0.98 
1 1 1 -55 11 13 o 32.98618 10.50738 11.59987  336.5 -13.58604      21.01476 0.24 
1 1 1 -55 11 14 o 54.39606 11.17644 80.99557  6.7   13.38039       22.35287 0.91 
1 1 1 -55 11 15 o 48.07579 11.40800 105.9872  333.6 1.708847       22.81599 0.92 
1 1 1 -55 11 16 o 46.49930 10.95732 85.62959  118.8 ?              ?        0.90 
1 1 1 -55 11 17 o 69.52170 11.23474 113.9750  50.8  ?              ?        0.95 
1 1 1 -55 11 18 o 37.43304 11.22548 37.78271  339.4 ?              ?        0.70 
1 1 1 -55 11 19 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -54 0  1  o 18.02765 12.13663 7.468394  180.0 -0.000000      0.000000 0.05 
1 1 1 -54 0  2  o 18.02483 12.19134 21.40816  180.0 -0.000000      0.000000 0.13 
1 1 1 -54 0  3  o 111.5896 7.726760 144.5168  360.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  4  o 55.41719 16.93836 28.33384  360.0 -0.000000      0.000000 0.41 
1 1 1 -54 0  5  o 22.49638 14.49959 41.89303  180.0 -0.000000      0.000000 0.25 
1 1 1 -54 0  6  o 23.26151 14.78131 51.28697  0.0   -0.000000      0.000000 0.31 
1 1 1 -54 0  7  o 157.6730 7.310644 170.8086  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  8  o 101.2247 11.03760 80.41669  180.0 -0.000000      0.000000 0.97 
1 1 1 -54 0  9  o 51.24486 19.09479 70.72168  0.0   -0.000000      0.000000 0.70 
1 1 1 -54 0  10 o 51.86487 19.88048 101.0977  0.0   -0.000000      0.000000 0.85 
1 1 1 -54 0  11 o 113.9435 7.962551 188.3356  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  12 o 56.76834 16.44939 89.63527  180.0 -0.000000      0.000000 0.87 
1 1 1 -54 0  13 o 162.5476 7.420236 257.8941  0.0   -0.000000      0.000000 1.00 
1 1 1 -54 0  14 o 100.8094 12.39629 215.3958  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  15 o 46.37519 20.34837 102.3158  180.0 -0.000000      0.000000 0.87 
1 1 1 -54 0  16 o 46.42331 19.52622 98.83272  360.0 -0.000000      0.000000 0.89 
1 1 1 -54 0  17 o 188.1377 6.350868 314.2981  0.0   -0.000000      0.000000 1.00 
1 1 1 -54 0  18 o 42.57984 19.00943 135.6397  180.0 -0.000000      0.000000 0.96 
1 1 1 -54 0  19 o 109.4611 9.311450 194.2717  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  20 o 46.19709 16.34155 142.2452  360.0 -0.000000      0.000000 0.96 
1 1 1 -54 0  21 o 29.83440 16.45943 44.57408  180.0 -0.000000      0.000000 0.34 
1 1 1 -54 0  22 o 24.49220 15.44603 80.76086  180.0 -0.000000      0.000000 0.50 
1 1 1 -54 0  23 o 151.1572 6.260514 165.5973  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  24 o 183.5660 6.266510 187.2996  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  25 o 57.27245 14.19002 55.91886  180.0 -0.000000      0.000000 0.82 
1 1 1 -54 0  26 o 80.50056 10.20975 123.9218  180.0 -0.000000      0.000000 1.00 
1 1 1 -54 0  27 o 28.99823 16.58732 122.9800  180.0 -0.000000      0.000000 0.93 
1 1 1 -54 0  28 o 16.89650 12.04796 49.78046  360.0 -0.000000      0.000000 0.46 
1 1 1 -54 0  29 o 29.35784 16.41314 16.46941  0.0   -0.000000      0.000000 0.26 
1 1 1 -54 0  30 o 50.95605 17.50264 80.69046  0.0   -0.000000      0.000000 0.98 
1 1 1 -54 0  31 o 18.25606 12.68426 24.58780  180.0 -0.000000      0.000000 0.29 
1 1 1 -54 0  32 o 21.50185 14.70250 11.70570  360.0 ?              ?        0.17 
1 1 1 -54 2  1  o 157.2256 3.680232 181.1835  357.7 0.7136230      7.360463 0.97 
1 1 1 -54 2  2  o 187.1899 3.521594 233.6043  117.9 23.82130       7.043188 0.98 
1 1 1 -54 2  3  o 61.22853 8.673682 48.29227  132.5 3.205509       17.34736 0.71 
1 1 1 -54 2  4  o 124.7932 4.664118 84.70914  25.1  21.29684       9.328237 0.93 
1 1 1 -54 2  5  o 169.1069 4.451986 193.5474  56.1  3.589111       8.903972 0.98 
1 1 1 -54 2  6  o 78.00789 8.927114 55.73008  319.9 -19.04099      17.85423 0.77 
1 1 1 -54 2  7  o 30.49964 9.440716 30.95077  203.6 1.629976       18.88143 0.26 
1 1 1 -54 2  8  o 115.9431 5.007006 114.0792  192.1 -7.647942      10.01401 0.93 
1 1 1 -54 2  9  o 93.60875 7.548256 167.9396  221.8 -10.50117      15.09651 0.94 
1 1 1 -54 2  10 o 204.6645 4.361114 268.5444  207.9 36.95567       8.722228 0.98 
1 1 1 -54 2  11 o 80.69606 8.798651 162.4437  233.3 16.40665       17.59730 0.93 
1 1 1 -54 2  12 o 168.0095 4.917697 219.5943  238.6 -15.11942      9.835394 0.98 
1 1 1 -54 2  13 o 123.0504 5.810655 221.8112  84.5  15.65657       11.62131 0.97 
1 1 1 -54 2  14 o 209.4255 4.516403 263.8762  128.8 10.38634       9.032806 0.99 
1 1 1 -54 2  15 f 209.1646 4.799036 341.2841  222.7 2.477463       9.598072 0.00 
1 1 1 -54 2  16 o 107.4392 5.813726 153.0315  282.9 -34.54146      11.62745 0.96 
1 1 1 -54 2  17 o 72.68452 9.185559 55.76451  245.8 9.679848       18.37112 0.81 
1 1 1 -54 2  18 o 59.40275 9.881744 131.3478  329.4 -19.94553      19.76349 0.90 
1 1 1 -54 2  19 o 155.6005 4.567570 177.1232  115.0 6.263184       9.135139 0.97 
1 1 1 -54 2  20 o 265.8340 4.063206 370.7743  221.5 19.46588       8.126411 0.99 
1 1 1 -54 2  21 o 121.5911 4.836274 193.2238  279.6 0.7868423      9.672548 0.96 
1 1 1 -54 2  22 o 71.16837 9.465450 84.61704  76.7  -22.73305      18.93090 0.84 
1 1 1 -54 2  23 f 113.9541 5.162781 246.4396  216.8 21.05898       10.32556 0.00 
1 1 1 -54 2  24 o 137.6518 4.843373 208.2783  148.9 3.509552       9.686747 0.98 
1 1 1 -54 2  25 o 177.0773 4.370255 235.7157  76.9  19.52682       8.740511 0.99 
1 1 1 -54 2  26 o 71.84299 9.542220 107.8064  78.8  -24.91130      19.08444 0.93 
1 1 1 -54 2  27 o 117.4196 5.379637 156.7320  349.3 32.81892       10.75927 0.98 
1 1 1 -54 2  28 o 61.56594 8.668146 128.9316  1.3   -38.66203      17.33629 0.95 
1 1 1 -54 2  29 o 36.76818 10.46754 18.08738  314.9 -1.423027      20.93509 0.36 
1 1 1 -54 2  30 o 58.43980 9.951796 85.85334  293.3 0.4906006      19.90359 0.91 
1 1 1 -54 2  31 o 55.13824 9.819880 86.65093  269.1 10.92200       19.63976 0.92 
1 1 1 -54 2  32 o 43.05555 11.28798 74.34116  253.8 ?              ?        0.88 
1 1 1 -54 4  1  o 25.23105 8.162318 57.79152  233.0 -0.9507790     16.32464 0.36 
1 1 1 -54 4  2  o 24.66901 8.317152 23.89094  239.3 6.092524       16.63430 0.17 
1 1 1 -54 4  3  o 69.21196 8.632652 115.6729  13.1  -13.71925      17.26530 0.89 
1 1 1 -54 4  4  o 61.05230 8.720320 72.17132  240.3 -34.72519      17.44064 0.80 
1 1 1 -54 4  5  o 109.8205 5.792747 133.0966  317.2 8.187347       11.58549 0.95 
1 1 1 -54 4  6  o 84.25662 7.174385 122.5187  303.6 1.929939       14.34877 0.93 
1 1 1 -54 4  7  o 169.6642 3.964582 185.4181  166.4 -19.07074      7.929165 0.98 
1 1 1 -54 4  8  o 154.0907 4.928619 211.7526  346.4 -15.19543      9.857239 0.98 
1 1 1 -54 4  9  o 125.9022 5.133100 146.0512  309.7 -14.47247      10.26620 0.96 
1 1 1 -54 4  10 o 98.63351 7.103186 152.0878  337.6 33.91249       14.20637 0.96 
1 1 1 -54 4  11 o 46.86443 9.641507 86.84933  12.4  -24.53754      19.28301 0.81 
1 1 1 -54 4  12 o 136.0459 5.359996 164.7495  276.6 -19.13699      10.71999 0.97 
1 1 1 -54 4  13 o 177.9026 4.527477 277.2316  298.4 5.118164       9.054954 0.99 
1 1 1 -54 4  14 o 168.8228 4.885710 213.5943  298.4 -4.387054      9.771420 0.98 
1 1 1 -54 4  15 o 101.6043 7.276005 112.7537  264.6 -43.30208      14.55201 0.94 
1 1 1 -54 4  16 o 92.37050 7.882130 101.0906  24.2  52.63930       15.76426 0.91 
1 1 1 -54 4  17 o 47.18699 9.866727 106.0134  131.6 20.48501       19.73345 0.81 
1 1 1 -54 4  18 o 122.2348 5.855446 150.7637  175.1 -6.180428      11.71089 0.95 
1 1 1 -54 4  19 o 34.94191 9.504283 32.33301  298.9 21.39449       19.00857 0.30 
1 1 1 -54 4  20 o 36.66705 11.00748 22.67694  45.1  -10.46086      22.01496 0.23 
1 1 1 -54 4  21 o 48.72171 10.73230 101.4809  267.7 -23.81708      21.46461 0.81 
1 1 1 -54 4  22 o 44.09758 10.55631 61.04388  32.9  0.8991051      21.11261 0.65 
1 1 1 -54 4  23 o 43.89442 10.53009 38.47465  156.5 -7.441406      21.06017 0.52 
1 1 1 -54 4  24 o 152.8012 4.485628 225.8882  203.3 -5.874588      8.971256 0.98 
1 1 1 -54 4  25 o 58.46051 9.800268 131.1248  300.2 9.414070       19.60054 0.93 
1 1 1 -54 4  26 o 123.4583 5.042771 187.6413  332.2 6.277878       10.08554 0.98 
1 1 1 -54 4  27 o 23.84407 8.049470 22.27260  192.1 3.311913       16.09894 0.32 
1 1 1 -54 4  28 o 56.24604 9.697165 22.68085  114.8 17.61217       19.39433 0.61 
1 1 1 -54 4  29 o 40.16811 10.39204 56.34926  280.7 20.52838       20.78408 0.79 
1 1 1 -54 4  30 o 42.86141 10.97599 86.32817  147.2 -8.861683      21.95199 0.89 
1 1 1 -54 4  31 o 32.41010 10.17014 50.47451  86.3  ?              ?        0.75 
1 1 1 -54 6  1  o 55.52689 9.537032 75.91584  196.4 -29.99004      19.07406 0.76 
1 1 1 -54 6  2  o 254.7138 4.222944 233.0230  212.8 15.86716       8.445888 0.99 
1 1 1 -54 6  3  o 299.1913 3.935066 273.2691  239.1 18.65195       7.870133 0.99 
1 1 1 -54 6  4  o 94.19823 6.033284 104.8323  334.8 14.37391       12.06657 0.90 
1 1 1 -54 6  5  o 88.57281 7.715350 118.7653  344.1 -22.77560      15.43070 0.91 
1 1 1 -54 6  6  o 210.9411 4.124945 327.5428  304.0 20.69098       8.249890 0.99 
1 1 1 -54 6  7  o 50.29097 10.73825 60.80372  226.0 5.440975       21.47651 0.62 
1 1 1 -54 6  8  o 72.82539 8.292453 28.29489  331.9 -13.82050      16.58491 0.49 
1 1 1 -54 6  9  o 49.41403 10.91284 94.15713  22.9  7.411961       21.82568 0.77 
1 1 1 -54 6  10 o 71.23898 9.271659 131.3599  13.1  -16.69786      18.54332 0.90 
1 1 1 -54 6  11 o 83.15234 6.601724 105.8609  125.5 -0.9207458     13.20345 0.89 
1 1 1 -54 6  12 o 92.71908 6.177503 64.72522  176.2 4.220871       12.35501 0.84 
1 1 1 -54 6  13 o 182.4111 4.177519 249.8757  65.5  -29.59476      8.355039 0.98 
1 1 1 -54 6  14 o 163.5728 4.811438 215.3318  73.2  -20.21245      9.622876 0.98 
1 1 1 -54 6  15 o 152.6139 5.403582 229.6096  131.2 -1.774551      10.80716 0.98 
1 1 1 -54 6  16 o 32.18785 10.15349 10.56088  50.3  -6.964998      20.30699 0.10 
1 1 1 -54 6  17 o 47.55007 11.01293 109.7377  301.2 3.369114       22.02585 0.82 
1 1 1 -54 6  18 o 78.52122 8.451097 89.24274  111.1 -8.621811      16.90219 0.88 
1 1 1 -54 6  19 o 67.32355 9.335596 166.2194  195.9 53.28858       18.67119 0.93 
1 1 1 -54 6  20 o 51.52770 11.10728 110.0906  149.1 -12.99140      22.21456 0.87 
1 1 1 -54 6  21 o 147.4014 5.231816 233.6472  72.3  -9.939194      10.46363 0.98 
1 1 1 -54 6  22 o 75.19414 7.738633 123.5821  321.5 1.113113       15.47727 0.94 
1 1 1 -54 6  23 o 72.71856 8.133121 105.5808  228.1 5.914398       16.26624 0.94 
1 1 1 -54 6  24 o 143.9043 4.869941 224.3216  187.7 15.37053       9.739882 0.99 
1 1 1 -54 6  25 o 36.23936 10.27961 52.33940  259.2 13.41024       20.55922 0.74 
1 1 1 -54 6  26 o 36.89362 9.888947 66.43596  141.1 -9.499897      19.77789 0.81 
1 1 1 -54 6  27 o 44.51112 10.91895 72.52658  200.6 -13.46512      21.83791 0.86 
1 1 1 -54 6  28 o 34.78147 10.05867 79.52181  306.6 -2.596550      20.11734 0.85 
1 1 1 -54 6  29 o 44.71431 9.666689 74.98643  139.6 ?              ?        0.89 
1 1 1 -54 8  1  o 123.7027 5.361750 150.9648  311.4 -31.61578      10.72350 0.97 
1 1 1 -54 8  2  f 85.79941 8.130919 39.38288  329.7 28.74457       16.26184 0.00 
1 1 1 -54 8  3  o 119.5968 5.277294 140.7228  15.7  10.01773       10.55459 0.96 
1 1 1 -54 8  4  o 275.4548 5.586166 362.5583  345.7 ?              ?        0.99 
1 1 1 -54 8  5  o 70.03259 8.448105 98.74117  342.0 21.09314       16.89621 0.90 
1 1 1 -54 8  6  o 100.8884 6.252986 165.2551  358.9 -13.65933      12.50597 0.96 
1 1 1 -54 8  7  o 66.98091 8.932549 116.1736  281.6 -41.90508      17.86510 0.90 
1 1 1 -54 8  8  o 135.5744 5.814354 172.9056  253.3 6.054749       11.62871 0.97 
1 1 1 -54 8  9  o 36.95110 9.826680 75.38490  131.7 -19.49110      19.65336 0.68 
1 1 1 -54 8  10 o 68.39216 9.464296 101.5950  71.8  18.19194       18.92859 0.89 
1 1 1 -54 8  11 o 79.66026 7.517711 76.28383  114.9 9.509209       15.03542 0.88 
1 1 1 -54 8  12 o 75.09853 8.114920 82.01458  184.6 1.824173       16.22984 0.88 
1 1 1 -54 8  13 f 104.4414 5.762236 166.8664  201.4 6.373627       11.52447 0.00 
1 1 1 -54 8  14 o 35.31616 10.71147 101.0299  219.0 -5.053455      21.42293 0.78 
1 1 1 -54 8  15 o 72.35813 8.942760 94.81902  308.9 37.80604       17.88552 0.91 
1 1 1 -54 8  16 o 41.10312 10.40135 74.44373  148.3 12.55492       20.80269 0.77 
1 1 1 -54 8  17 o 30.16486 9.538812 40.34286  137.7 3.778082       19.07762 0.49 
1 1 1 -54 8  18 o 37.15621 10.32011 36.57645  199.4 -18.75167      20.64021 0.55 
1 1 1 -54 8  19 o 69.63526 10.50389 114.7749  244.8 -10.57898      21.00778 0.94 
1 1 1 -54 8  20 o 72.93488 8.320341 87.07239  100.8 -4.499451      16.64068 0.93 
1 1 1 -54 8  21 o 160.6655 5.014489 259.5011  92.1  0.4699707E-01  10.02898 0.99 
1 1 1 -54 8  22 o 43.90985 11.64992 118.9098  46.4  0.4459496      23.29984 0.91 
1 1 1 -54 8  23 o 139.0351 5.623237 192.4453  31.8  -7.094269      11.24647 0.99 
1 1 1 -54 8  24 o 31.64483 9.786677 11.86843  135.8 8.056131       19.57335 0.23 
1 1 1 -54 8  25 o 33.02773 9.671661 45.64121  49.8  -8.708458      19.34332 0.70 
1 1 1 -54 8  26 o 37.84769 11.03981 84.00692  2.0   ?              ?        0.87 
1 1 1 -54 8  27 o 27.42899 9.296762 16.17087  153.0 ?              ?        0.33 
1 1 1 -54 10 1  o 46.73042 13.49448 50.48648  43.5  -3.556976      26.98897 0.75 
1 1 1 -54 10 2  o 56.31321 13.72683 66.73021  89.5  8.035801       27.45366 0.86 
1 1 1 -54 10 3  o 64.18768 9.542519 103.3171  245.1 -56.69128      19.08504 0.94 
1 1 1 -54 10 4  o 35.46573 10.24982 55.29619  320.2 -5.724480      20.49964 0.74 
1 1 1 -54 10 5  o 51.79560 11.38469 68.69019  292.0 -8.880844      22.76937 0.87 
1 1 1 -54 10 6  o 30.83439 9.700631 7.292651  178.1 5.336967       19.40126 0.14 
1 1 1 -54 10 7  o 64.58623 9.219584 86.76617  224.5 -9.784554      18.43917 0.93 
1 1 1 -54 10 8  o 49.07086 10.89622 67.16191  38.6  0.9744225      21.79243 0.86 
1 1 1 -54 10 9  o 72.83794 9.894005 153.9762  52.5  26.03743       19.78801 0.96 
1 1 1 -54 10 10 o 69.90819 11.62571 81.49929  258.2 -17.63179      23.25141 0.92 
1 1 1 -54 10 11 o 50.69845 11.54796 87.39705  271.1 -12.85377      23.09591 0.90 
1 1 1 -54 10 12 o 94.07276 7.544201 118.8697  262.2 17.16029       15.08840 0.97 
1 1 1 -54 10 13 o 122.2965 5.967377 170.4765  321.8 -19.89382      11.93475 0.98 
1 1 1 -54 10 14 o 89.35286 7.656967 134.9371  0.2   2.271370       15.31393 0.97 
1 1 1 -54 10 15 o 38.39486 11.11362 74.15714  346.7 -1.811974      22.22723 0.83 
1 1 1 -54 10 16 o 89.34327 7.566947 149.3111  37.3  -5.949814      15.13389 0.97 
1 1 1 -54 10 17 o 125.2077 6.012567 189.3020  92.8  12.84354       12.02513 0.99 
1 1 1 -54 10 18 o 54.47015 11.44238 71.07024  169.6 -20.22745      22.88476 0.88 
1 1 1 -54 10 19 o 38.33147 11.00533 73.74467  261.0 1.969158       22.01065 0.84 
1 1 1 -54 10 20 o 30.68782 9.950500 65.87028  269.6 0.2014179      19.90100 0.78 
1 1 1 -54 10 21 o 59.43606 9.897672 101.4506  210.3 -30.42878      19.79534 0.94 
1 1 1 -54 10 22 f 34.41413 10.27641 39.78699  196.1 ?              ?        0.00 
1 1 1 -54 10 23 x ?        ?        49.30957  106.5 ?              ?        0.00 
1 1 1 -54 12 4  x ?        ?        15.06675  301.9 ?              ?        0.00 
1 1 1 -54 12 5  o 58.84422 10.79923 64.02981  278.9 ?              ?        0.90 
1 1 1 -54 12 6  o 64.86495 10.61848 107.1190  176.4 ?              ?        0.95 
1 1 1 -54 12 7  o 58.48527 12.49870 91.97338  156.0 ?              ?        0.92 
1 1 1 -54 12 8  o 69.20549 11.30500 117.1717  69.2  ?              ?        0.95 
1 1 1 -54 12 9  f 35.86393 10.68591 72.55211  11.5  ?              ?        0.00 
1 1 1 -54 12 10 o 38.43211 10.97396 25.55506  217.4 ?              ?        0.56 
1 1 1 -54 12 11 o 40.23357 11.12625 82.64279  104.3 ?              ?        0.88 
1 1 1 -54 12 12 o 45.51636 11.92545 100.8405  108.2 ?              ?        0.91 
1 1 1 -54 12 13 f 40.90552 11.63495 35.54554  131.9 ?              ?        0.00 
1 1 1 -54 12 14 o 37.90722 11.06526 60.09161  186.0 ?              ?        0.83 
1 1 1 -54 12 15 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -53 1  1  o 138.8885 4.285714 170.4610  145.6 -49.90930      8.571427 0.97 
1 1 1 -53 1  2  o 29.99851 9.095785 37.30991  260.2 -1.876789      18.19157 0.31 
1 1 1 -53 1  3  o 212.3466 3.361749 287.5797  357.3 1.145844       6.723499 0.99 
1 1 1 -53 1  4  o 57.06098 8.845781 127.4346  286.2 36.44372       17.69156 0.85 
1 1 1 -53 1  5  o 205.0073 3.903443 247.0145  19.6  -1.927185      7.806886 0.98 
1 1 1 -53 1  6  o 247.1693 3.775916 308.0877  79.5  6.720566       7.551831 0.99 
1 1 1 -53 1  7  o 188.6761 4.377774 213.3261  78.4  -19.16046      8.755548 0.98 
1 1 1 -53 1  8  o 223.4097 4.330993 231.8090  21.4  24.57832       8.661985 0.98 
1 1 1 -53 1  9  o 229.6636 4.262744 286.5284  74.2  21.68315       8.525489 0.98 
1 1 1 -53 1  10 o 116.1991 6.671691 165.2365  96.8  46.34699       13.34338 0.95 
1 1 1 -53 1  11 o 206.4725 4.294755 277.2477  296.6 24.98164       8.589509 0.98 
1 1 1 -53 1  12 o 175.8449 4.499765 299.4389  283.4 -21.45518      8.999530 0.98 
1 1 1 -53 1  13 o 138.5457 4.790451 198.3138  156.6 3.454865       9.580901 0.97 
1 1 1 -53 1  14 o 189.7737 4.460940 279.4909  165.4 2.655167       8.921880 0.98 
1 1 1 -53 1  15 o 170.9786 4.566967 236.9234  250.0 -0.2979736     9.133934 0.98 
1 1 1 -53 1  16 f 150.8653 4.742559 235.3691  331.5 4.332306       9.485118 0.00 
1 1 1 -53 1  17 o 68.94743 9.086048 115.5935  57.4  -45.42895      18.17210 0.90 
1 1 1 -53 1  18 o 87.25803 7.108782 133.3746  301.9 3.427818       14.21756 0.94 
1 1 1 -53 1  19 o 160.3249 4.135217 222.2317  85.8  -20.59081      8.270433 0.98 
1 1 1 -53 1  20 o 155.0236 4.677853 229.5902  145.2 -1.865356      9.355706 0.98 
1 1 1 -53 1  21 o 80.05885 7.665042 91.68018  48.6  -37.65263      15.33008 0.88 
1 1 1 -53 1  22 o 151.3666 4.113594 287.0209  32.5  -12.45316      8.227188 0.98 
1 1 1 -53 1  23 o 195.8949 3.868515 223.6179  222.8 17.41422       7.737030 0.98 
1 1 1 -53 1  24 o 36.84212 9.286482 42.73947  356.4 18.18383       18.57296 0.44 
1 1 1 -53 1  25 o 81.46583 7.739496 103.0562  61.4  40.59825       15.47899 0.91 
1 1 1 -53 1  26 o 59.58903 10.04690 78.97305  106.6 4.533314       20.09381 0.85 
1 1 1 -53 1  27 o 100.2782 6.014188 148.8392  205.8 9.542816       12.02838 0.97 
1 1 1 -53 1  28 o 38.40963 11.88983 33.13618  117.7 -21.27012      23.77967 0.53 
1 1 1 -53 1  29 o 73.65424 8.197280 71.68971  118.7 1.199974       16.39456 0.92 
1 1 1 -53 1  30 o 118.1844 5.796944 161.2633  75.7  13.25460       11.59389 0.98 
1 1 1 -53 1  31 o 39.40594 11.10314 83.61633  223.8 -10.02967      22.20627 0.86 
1 1 1 -53 1  32 o 35.36351 10.17348 21.18315  295.8 ?              ?        0.45 
1 1 1 -53 1  33 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -53 3  1  o 153.7075 4.051383 137.6604  164.3 -0.5325623     8.102767 0.97 
1 1 1 -53 3  2  o 129.0226 4.361284 104.2446  176.8 17.41082       8.722569 0.95 
1 1 1 -53 3  3  o 157.8487 3.966119 184.9919  72.8  -11.02809      7.932238 0.98 
1 1 1 -53 3  4  o 225.4493 3.656827 310.5771  113.4 55.01199       7.313653 0.99 
1 1 1 -53 3  5  o 37.31278 10.22839 136.8266  159.2 20.33914       20.45677 0.80 
1 1 1 -53 3  6  o 118.6331 5.227993 126.5124  12.4  -33.53111      10.45599 0.94 
1 1 1 -53 3  7  o 62.09721 9.041162 82.14694  57.1  13.26091       18.08232 0.79 
1 1 1 -53 3  8  o 89.42162 6.344830 90.55959  279.0 -41.20905      12.68966 0.88 
1 1 1 -53 3  9  o 192.6409 4.352649 305.6302  353.3 -53.79234      8.705298 0.98 
1 1 1 -53 3  10 o 150.5316 4.884125 169.8088  9.8   11.85449       9.768250 0.97 
1 1 1 -53 3  11 o 229.5534 4.341471 294.0806  77.7  14.34613       8.682941 0.99 
1 1 1 -53 3  12 o 52.27740 9.752204 90.11290  216.5 28.03518       19.50441 0.78 
1 1 1 -53 3  13 o 181.0081 4.808289 242.8557  112.2 13.33794       9.616577 0.98 
1 1 1 -53 3  14 o 225.2075 4.052293 308.1900  21.5  -3.682098      8.104587 0.99 
1 1 1 -53 3  15 o 154.7148 4.801919 223.0891  18.9  -27.10194      9.603839 0.98 
1 1 1 -53 3  16 o 80.02956 9.036139 128.1385  313.5 17.41014       18.07228 0.93 
1 1 1 -53 3  17 o 124.1752 5.849730 165.7142  48.3  17.28094       11.69946 0.97 
1 1 1 -53 3  18 o 78.61714 8.035871 157.5894  155.8 -7.434074      16.07174 0.94 
1 1 1 -53 3  19 o 205.1293 4.327034 298.0595  193.4 9.061386       8.654069 0.99 
1 1 1 -53 3  20 f 45.15187 9.619791 152.6908  306.7 -27.35281      19.23958 0.00 
1 1 1 -53 3  21 o 82.81712 6.818716 103.2418  260.0 -16.64159      13.63743 0.89 
1 1 1 -53 3  22 o 38.57473 10.32484 49.84747  55.1  -3.087746      20.64968 0.48 
1 1 1 -53 3  23 o 58.12669 11.82322 67.96436  125.5 -0.4598427     23.64644 0.75 
1 1 1 -53 3  24 o 102.6736 5.581294 89.92629  102.1 20.48465       11.16259 0.92 
1 1 1 -53 3  25 o 89.79786 6.094407 129.1720  12.7  -33.13933      12.18881 0.95 
1 1 1 -53 3  26 o 143.0030 4.597722 207.9610  41.6  42.23505       9.195443 0.98 
1 1 1 -53 3  27 o 152.5840 4.823234 228.5274  33.3  -0.1048279     9.646467 0.99 
1 1 1 -53 3  28 o 71.50360 7.653811 124.4455  324.2 1.617088       15.30762 0.96 
1 1 1 -53 3  29 o 101.7863 6.234952 146.2263  303.2 14.05444       12.46990 0.97 
1 1 1 -53 3  30 o 104.6044 6.608143 161.2113  343.1 -2.983368      13.21629 0.98 
1 1 1 -53 3  31 o 66.14500 9.997078 89.01463  75.8  -22.36483      19.99416 0.93 
1 1 1 -53 3  32 o 45.43900 10.99869 99.43713  86.5  ?              ?        0.92 
1 1 1 -53 5  1  o 69.19431 8.545765 98.44885  351.2 20.52848       17.09153 0.84 
1 1 1 -53 5  2  o 59.14492 8.934415 76.39106  156.9 -40.64173      17.86883 0.77 
1 1 1 -53 5  3  o 105.1990 5.204379 103.1634  297.0 2.653183       10.40876 0.92 
1 1 1 -53 5  4  o 49.09440 9.967574 35.02915  223.5 26.07798       19.93515 0.48 
1 1 1 -53 5  5  o 72.49326 8.931529 104.8993  325.5 36.07991       17.86306 0.90 
1 1 1 -53 5  6  f 290.9733 3.987748 369.7822  264.8 6.898560       7.975495 0.00 
1 1 1 -53 5  7  o 102.9957 5.735795 180.1401  155.5 8.911400       11.47159 0.97 
1 1 1 -53 5  8  o 104.8445 5.992474 165.0710  85.7  -36.78564      11.98495 0.96 
1 1 1 -53 5  9  o 109.7503 5.133018 189.6322  151.2 -13.64280      10.26604 0.97 
1 1 1 -53 5  10 o 146.6443 4.974878 209.2932  62.7  -18.92044      9.949757 0.98 
1 1 1 -53 5  11 o 102.5417 6.463114 112.5531  81.5  -23.25934      12.92623 0.95 
1 1 1 -53 5  12 o 31.19896 9.446626 38.58010  314.1 9.201971       18.89325 0.41 
1 1 1 -53 5  13 o 93.27676 8.455873 154.8217  231.4 19.44865       16.91175 0.95 
1 1 1 -53 5  14 o 105.0283 7.600844 164.4931  208.4 40.32816       15.20169 0.96 
1 1 1 -53 5  15 f 108.0033 6.045169 206.4228  157.7 22.41768       12.09034 0.00 
1 1 1 -53 5  16 o 111.2869 6.500865 200.7539  182.5 -20.36182      13.00173 0.96 
1 1 1 -53 5  17 o 152.0839 6.345115 229.0238  204.8 0.1757965      12.69023 0.98 
1 1 1 -53 5  18 o 117.6619 6.068743 152.3670  226.6 10.56050       12.13749 0.95 
1 1 1 -53 5  19 o 47.72763 9.050616 60.88081  181.8 -38.11030      18.10123 0.64 
1 1 1 -53 5  20 o 89.42309 6.413723 133.6919  269.1 -1.043762      12.82745 0.93 
1 1 1 -53 5  21 o 65.72350 9.873611 146.0383  68.0  -3.066864      19.74722 0.91 
1 1 1 -53 5  22 o 151.4467 4.962614 179.1120  116.0 -0.5650482     9.925227 0.98 
1 1 1 -53 5  23 o 70.55014 8.528379 82.08499  189.9 -7.651176      17.05676 0.88 
1 1 1 -53 5  24 o 105.1130 6.274575 104.9184  182.0 -28.95274      12.54915 0.95 
1 1 1 -53 5  25 o 73.86858 7.611385 105.1703  62.3  -7.791290      15.22277 0.94 
1 1 1 -53 5  26 o 92.90781 6.289273 197.4173  42.2  -4.844734      12.57855 0.98 
1 1 1 -53 5  27 o 51.61214 9.757352 75.74828  265.9 -9.221642      19.51470 0.89 
1 1 1 -53 5  28 o 88.66815 6.826144 139.9391  263.0 -12.84426      13.65229 0.97 
1 1 1 -53 5  29 o 35.41171 10.30668 37.73754  35.8  13.82674       20.61336 0.63 
1 1 1 -53 5  30 o 38.80658 11.13386 85.50320  137.2 ?              ?        0.87 
1 1 1 -53 5  31 o 45.84321 10.87673 18.85593  208.4 ?              ?        0.53 
1 1 1 -53 7  1  o 188.1569 4.914454 197.9957  30.9  31.40608       9.828909 0.98 
1 1 1 -53 7  2  o 200.3470 4.211474 228.1402  3.5   7.521667       8.422949 0.98 
1 1 1 -53 7  3  o 193.6624 3.950478 221.3320  286.4 -0.6806793     7.900956 0.98 
1 1 1 -53 7  4  o 186.9795 4.281012 195.0757  314.3 3.779480       8.562024 0.98 
1 1 1 -53 7  5  o 66.65646 8.875185 128.7195  119.3 -18.01690      17.75037 0.89 
1 1 1 -53 7  6  o 41.96526 10.78939 62.34621  34.1  3.659798       21.57879 0.57 
1 1 1 -53 7  7  o 86.10365 9.241349 107.9163  76.9  21.82404       18.48270 0.90 
1 1 1 -53 7  8  o 135.9864 4.858403 144.1664  356.1 29.40272       9.716805 0.95 
1 1 1 -53 7  9  o 44.58194 10.03428 133.2372  30.7  -20.56984      20.06856 0.83 
1 1 1 -53 7  10 o 38.72853 10.88116 47.48668  67.8  -8.149330      21.76232 0.44 
1 1 1 -53 7  11 o 97.00975 8.162806 110.0289  185.6 3.945930       16.32561 0.91 
1 1 1 -53 7  12 o 62.61681 9.002559 79.03822  250.1 -20.05038      18.00512 0.80 
1 1 1 -53 7  13 o 141.5241 5.023888 188.6630  170.2 20.04829       10.04778 0.97 
1 1 1 -53 7  14 o 126.9279 5.667071 179.5151  265.9 15.62571       11.33414 0.96 
1 1 1 -53 7  15 o 133.9860 5.319234 208.4979  353.6 17.55799       10.63847 0.97 
1 1 1 -53 7  16 o 101.6921 6.338469 120.3903  23.4  6.767487       12.67694 0.94 
1 1 1 -53 7  17 f 108.6239 6.560616 158.1695  303.8 -38.06956      13.12123 0.00 
1 1 1 -53 7  18 o 90.12498 7.571693 117.9007  315.9 4.571159       15.14339 0.93 
1 1 1 -53 7  19 f 85.15861 7.790216 135.1261  211.2 8.153122       15.58043 0.00 
1 1 1 -53 7  20 f 151.0190 5.168657 250.2736  89.1  -7.189072      10.33731 0.00 
1 1 1 -53 7  21 o 117.0061 5.195165 157.8205  32.6  5.550873       10.39033 0.97 
1 1 1 -53 7  22 o 121.3513 5.579152 124.4817  318.4 9.675674       11.15830 0.97 
1 1 1 -53 7  23 o 40.43132 9.993606 73.44907  303.3 -20.64490      19.98721 0.83 
1 1 1 -53 7  24 o 133.0746 4.876369 168.5042  168.3 -2.044876      9.752738 0.98 
1 1 1 -53 7  25 o 76.04243 9.048281 187.0243  108.9 -29.77955      18.09656 0.97 
1 1 1 -53 7  26 o 48.56367 9.897761 47.49649  61.8  -19.58319      19.79552 0.80 
1 1 1 -53 7  27 o 33.08974 10.31500 57.97593  319.6 15.52884       20.63001 0.76 
1 1 1 -53 7  28 o 24.52099 8.382504 35.99506  278.3 ?              ?        0.55 
1 1 1 -53 7  29 o 33.90237 10.19341 23.50371  164.8 ?              ?        0.52 
1 1 1 -53 9  1  o 47.82575 12.05787 35.88903  328.3 -2.336956      24.11574 0.63 
1 1 1 -53 9  2  o 84.14933 6.598109 114.4719  114.0 4.172729       13.19622 0.95 
1 1 1 -53 9  3  o 97.87962 7.346811 140.6522  202.6 -10.45901      14.69362 0.96 
1 1 1 -53 9  4  o 41.79105 10.64256 50.33746  279.1 -7.673019      21.28512 0.67 
1 1 1 -53 9  5  o 65.14528 10.21860 85.92764  290.1 0.1323700E-01  20.43719 0.89 
1 1 1 -53 9  6  o 93.57552 7.184577 120.7147  231.1 -16.39555      14.36915 0.95 
1 1 1 -53 9  7  o 100.2569 7.728939 136.9134  176.1 22.85503       15.45788 0.96 
1 1 1 -53 9  8  o 40.88113 11.09071 60.36580  75.9  -7.210941      22.18142 0.69 
1 1 1 -53 9  9  o 53.35796 10.30785 47.07571  87.5  -5.408173      20.61571 0.70 
1 1 1 -53 9  10 o 59.23590 10.46148 45.30396  225.5 3.510284       20.92296 0.72 
1 1 1 -53 9  11 o 62.15091 10.17468 72.52176  99.4  -11.83236      20.34935 0.85 
1 1 1 -53 9  12 o 39.61798 10.97448 55.81190  318.5 -0.6716156E-01 21.94896 0.67 
1 1 1 -53 9  13 o 139.6257 5.428159 153.2239  344.3 -5.480637      10.85632 0.98 
1 1 1 -53 9  14 f 41.76288 10.82819 113.2824  21.0  -14.98422      21.65639 0.00 
1 1 1 -53 9  15 o 32.02676 9.877383 64.96770  31.5  5.985096       19.75477 0.70 
1 1 1 -53 9  16 o 36.63173 10.47064 25.95566  258.6 -19.73614      20.94129 0.42 
1 1 1 -53 9  17 o 94.93393 7.545471 157.8762  22.8  5.930870       15.09094 0.97 
1 1 1 -53 9  18 o 39.63808 11.06059 50.07988  102.1 -17.33616      22.12117 0.72 
1 1 1 -53 9  19 o 103.0129 6.387341 136.2994  249.9 -26.95830      12.77468 0.97 
1 1 1 -53 9  20 o 33.99203 9.806468 53.26917  292.5 20.63288       19.61294 0.74 
1 1 1 -53 9  21 o 123.9324 6.594298 157.4113  106.3 18.54240       13.18860 0.98 
1 1 1 -53 9  22 o 56.95759 10.86089 100.3544  88.6  14.03516       21.72178 0.92 
1 1 1 -53 9  23 o 70.76601 10.59742 159.1048  12.0  13.29053       21.19484 0.96 
1 1 1 -53 9  24 o 31.25942 10.18155 59.87813  285.3 10.22909       20.36309 0.77 
1 1 1 -53 9  25 o 24.93340 8.515793 75.11860  172.8 ?              ?        0.81 
1 1 1 -53 9  26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -53 11 1  o 37.60390 10.84663 63.26423  174.7 -1.358395      21.69325 0.81 
1 1 1 -53 11 2  o 57.14819 12.71306 89.40868  119.2 -12.68520      25.42613 0.91 
1 1 1 -53 11 3  o 50.87206 10.95156 77.94176  275.4 -23.84611      21.90313 0.88 
1 1 1 -53 11 4  o 105.1704 6.887085 117.1782  327.1 24.40959       13.77417 0.97 
1 1 1 -53 11 5  o 51.46631 12.59102 132.3633  255.4 -1.382141      25.18205 0.93 
1 1 1 -53 11 6  o 135.3989 7.084554 201.2301  161.1 -16.32080      14.16911 0.99 
1 1 1 -53 11 7  o 57.60946 10.13057 90.14956  161.1 2.435787       20.26115 0.92 
1 1 1 -53 11 8  o 79.88466 9.016456 122.0018  337.6 22.37513       18.03291 0.96 
1 1 1 -53 11 9  o 67.91701 9.885420 169.3177  338.3 53.98021       19.77084 0.96 
1 1 1 -53 11 10 o 73.54884 10.22257 124.2005  345.3 33.88708       20.44514 0.95 
1 1 1 -53 11 11 o 77.84828 9.818119 118.4893  55.3  9.391190       19.63624 0.96 
1 1 1 -53 11 12 o 41.08297 10.88304 65.97887  184.2 -0.2422562     21.76609 0.83 
1 1 1 -53 11 13 o 70.43535 11.99030 162.5159  243.2 -31.64421      23.98060 0.96 
1 1 1 -53 11 14 o 78.72882 9.057724 138.6643  299.8 13.95652       18.11545 0.96 
1 1 1 -53 11 15 o 35.38719 10.46782 94.78098  302.2 -15.38248      20.93564 0.87 
1 1 1 -53 11 16 o 30.62751 9.967730 69.04279  81.7  -1.788416      19.93546 0.79 
1 1 1 -53 11 17 o 106.2359 7.171360 182.1859  90.2  5.526672       14.34272 0.98 
1 1 1 -53 11 18 f 100.5716 6.616538 177.3800  101.1 6.106407       13.23308 0.00 
1 1 1 -53 11 19 o 48.08964 12.13671 106.5793  95.4  ?              ?        0.92 
1 1 1 -53 11 20 o 35.77958 10.63966 34.04057  122.6 ?              ?        0.65 
1 1 1 -53 11 21 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -52 0  1  o 44.19530 17.31679 7.128073  360.0 -0.000000      0.000000 0.08 
1 1 1 -52 0  2  o 110.5380 6.894830 94.00435  360.0 -0.000000      0.000000 0.99 
1 1 1 -52 0  3  o 73.22146 10.19041 181.5313  360.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  4  o 224.5624 4.757696 253.2671  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  5  o 427.8341 5.698572 524.1929  0.0   -0.000000      0.000000 1.00 
1 1 1 -52 0  6  o 370.0940 6.637848 478.6333  360.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  7  o 100.8011 9.602710 135.8704  360.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  8  o 26.48157 16.70461 54.18634  0.0   -0.000000      0.000000 0.31 
1 1 1 -52 0  9  o 111.6752 8.376782 108.1390  0.0   -0.000000      0.000000 0.99 
1 1 1 -52 0  10 o 127.4618 7.734929 224.5285  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  11 o 48.08044 18.59148 93.70351  180.0 -0.000000      0.000000 0.76 
1 1 1 -52 0  12 o 55.23617 15.28599 62.93839  0.0   -0.000000      0.000000 0.67 
1 1 1 -52 0  13 o 288.9702 5.483200 389.7550  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  14 o 36.69720 18.30253 161.1703  180.0 -0.000000      0.000000 0.88 
1 1 1 -52 0  15 o 216.4894 5.760907 275.8958  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  16 o 54.91146 16.72944 123.8156  0.0   -0.000000      0.000000 0.94 
1 1 1 -52 0  17 o 113.1939 6.969371 182.9584  360.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  18 o 142.4684 6.332431 204.2456  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  19 o 65.86592 10.90931 69.85775  180.0 -0.000000      0.000000 0.93 
1 1 1 -52 0  20 o 23.01438 14.65596 24.85453  180.0 -0.000000      0.000000 0.21 
1 1 1 -52 0  21 o 93.31374 8.025018 68.49604  360.0 -0.000000      0.000000 0.98 
1 1 1 -52 0  22 o 53.33926 15.92128 108.8808  360.0 -0.000000      0.000000 0.93 
1 1 1 -52 0  23 o 289.8575 5.589403 396.1288  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  24 f 96.84283 8.290636 88.58926  360.0 -0.000000      0.000000 0.00 
1 1 1 -52 0  25 o 169.0873 5.642256 179.6968  0.0   -0.000000      0.000000 1.00 
1 1 1 -52 0  26 o 108.8488 8.942199 187.2817  360.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  27 o 74.24843 10.27633 118.8742  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  28 o 22.14664 14.61745 4.808136  180.0 -0.000000      0.000000 0.05 
1 1 1 -52 0  29 o 40.17677 19.95505 20.29109  0.0   -0.000000      0.000000 0.38 
1 1 1 -52 0  30 o 36.85114 20.06723 72.46378  180.0 -0.000000      0.000000 0.87 
1 1 1 -52 0  31 o 112.5168 10.19706 174.7665  180.0 -0.000000      0.000000 1.00 
1 1 1 -52 0  32 o 22.38928 14.80826 17.18266  0.0   -0.000000      0.000000 0.24 
1 1 1 -52 0  33 o 52.36501 20.05957 0.5111322 360.0 ?              ?        0.02 
1 1 1 -52 2  1  o 192.3487 3.435434 278.6328  180.2 -7.953476      6.870868 0.98 
1 1 1 -52 2  2  o 107.3876 4.969790 172.8868  190.1 24.37614       9.939580 0.95 
1 1 1 -52 2  3  o 88.58972 6.348410 96.07767  55.1  7.394852       12.69682 0.88 
1 1 1 -52 2  4  o 81.65258 7.926334 153.8901  291.9 -55.05396      15.85267 0.91 
1 1 1 -52 2  5  o 104.2147 5.751661 89.70667  106.6 14.94809       11.50332 0.88 
1 1 1 -52 2  6  o 86.64229 6.533070 98.61173  291.1 -0.5885925     13.06614 0.87 
1 1 1 -52 2  7  o 148.7608 4.268968 226.6131  355.4 8.119858       8.537935 0.97 
1 1 1 -52 2  8  o 278.5431 4.120388 360.5978  33.3  7.138672       8.240776 0.99 
1 1 1 -52 2  9  o 58.18670 10.65098 56.75559  300.6 -4.449299      21.30196 0.60 
1 1 1 -52 2  10 o 219.0409 4.334280 301.0492  43.6  37.69046       8.668561 0.98 
1 1 1 -52 2  11 o 465.5534 5.221764 641.0357  42.3  0.7778625      10.44353 1.00 
1 1 1 -52 2  12 o 98.86507 6.705739 167.6870  306.1 9.505798       13.41148 0.94 
1 1 1 -52 2  13 o 88.33566 6.965305 72.22450  233.1 -29.97656      13.93061 0.83 
1 1 1 -52 2  14 f 48.78036 10.12547 88.99615  346.4 -35.74372      20.25094 0.00 
1 1 1 -52 2  15 o 94.93770 7.402417 143.5397  25.0  26.28265       14.80483 0.93 
1 1 1 -52 2  16 o 146.4558 4.902117 157.9985  87.4  4.952011       9.804235 0.96 
1 1 1 -52 2  17 o 34.59017 9.964076 79.92030  214.0 1.962490       19.92815 0.64 
1 1 1 -52 2  18 o 141.8747 4.329947 162.1593  338.9 -3.603348      8.659895 0.97 
1 1 1 -52 2  19 o 134.0681 4.825510 211.2943  61.2  13.91789       9.651019 0.98 
1 1 1 -52 2  20 o 79.27650 7.596082 96.34814  38.8  27.21361       15.19216 0.91 
1 1 1 -52 2  21 o 106.8771 5.386715 192.4213  108.2 37.58719       10.77343 0.96 
1 1 1 -52 2  22 o 39.85647 9.422824 103.9495  353.8 -24.12728      18.84565 0.74 
1 1 1 -52 2  23 o 125.3224 4.765251 163.6704  308.7 -13.27711      9.530501 0.96 
1 1 1 -52 2  24 o 55.06998 8.697633 28.14396  111.5 43.71880       17.39527 0.43 
1 1 1 -52 2  25 o 102.5368 5.414862 133.1310  101.8 29.96455       10.82972 0.95 
1 1 1 -52 2  26 o 81.74359 7.268226 94.62109  107.0 -11.14830      14.53645 0.92 
1 1 1 -52 2  27 o 89.10133 6.935585 117.6650  169.4 4.642181       13.87117 0.95 
1 1 1 -52 2  28 o 34.22565 9.623537 29.13221  341.0 11.43364       19.24707 0.46 
1 1 1 -52 2  29 o 57.03469 10.34812 100.3391  9.7   19.62846       20.69624 0.92 
1 1 1 -52 2  30 o 93.43482 7.477798 120.2660  46.5  18.32765       14.95560 0.97 
1 1 1 -52 2  31 o 88.46671 7.316384 131.8278  63.4  -1.518486      14.63277 0.97 
1 1 1 -52 2  32 o 92.29804 8.332327 161.8493  64.8  -19.89162      16.66465 0.98 
1 1 1 -52 2  33 o 28.09012 9.452984 20.62557  322.1 ?              ?        0.41 
1 1 1 -52 4  1  o 89.76595 6.393933 76.81774  92.4  -14.05197      12.78787 0.90 
1 1 1 -52 4  2  o 39.18957 9.773565 84.50040  72.0  8.774937       19.54713 0.74 
1 1 1 -52 4  3  o 36.99160 10.40279 38.16852  113.0 1.951332       20.80557 0.41 
1 1 1 -52 4  4  f 100.4880 5.674125 163.1727  42.7  -4.741226      11.34825 0.00 
1 1 1 -52 4  5  o 48.76809 10.01911 86.00854  114.4 -1.138763      20.03822 0.75 
1 1 1 -52 4  6  o 275.4550 3.779133 363.4283  136.2 5.972839       7.558266 0.99 
1 1 1 -52 4  7  o 79.57825 7.085008 101.0813  141.0 -7.098572      14.17002 0.88 
1 1 1 -52 4  8  o 181.9704 4.011086 264.1303  248.4 18.71626       8.022171 0.98 
1 1 1 -52 4  9  o 95.36824 6.550528 132.1032  135.4 18.91077       13.10106 0.93 
1 1 1 -52 4  10 o 218.3167 3.728144 320.2828  150.4 16.85249       7.456288 0.99 
1 1 1 -52 4  11 o 171.9356 4.685728 225.4393  106.6 -13.40288      9.371456 0.98 
1 1 1 -52 4  12 o 143.9304 5.310018 110.0858  25.1  20.54201       10.62004 0.95 
1 1 1 -52 4  13 o 183.8871 4.657195 329.6668  171.0 -9.918091      9.314389 0.99 
1 1 1 -52 4  14 o 41.45742 10.75034 107.4012  116.2 6.072281       21.50069 0.79 
1 1 1 -52 4  15 o 115.6005 6.756217 138.4700  326.0 5.038231       13.51243 0.95 
1 1 1 -52 4  16 o 38.65474 10.68330 75.96628  279.6 6.548000       21.36659 0.72 
1 1 1 -52 4  17 o 66.18747 9.899478 102.8048  195.0 22.90671       19.79896 0.90 
1 1 1 -52 4  18 o 236.9151 4.323900 339.0078  265.5 18.37500       8.647799 0.99 
1 1 1 -52 4  19 o 103.1841 5.923370 140.1001  224.4 -8.418709      11.84674 0.95 
1 1 1 -52 4  20 o 67.85899 12.12567 142.9618  352.2 -31.10335      24.25134 0.90 
1 1 1 -52 4  21 o 224.9043 3.710149 318.1395  24.3  -31.61885      7.420298 0.99 
1 1 1 -52 4  22 o 66.54619 8.150108 127.4928  345.1 8.731483       16.30022 0.90 
1 1 1 -52 4  23 o 182.3790 4.224746 261.8374  247.9 1.277374       8.449492 0.98 
1 1 1 -52 4  24 o 143.8906 4.595520 218.3838  102.3 -26.35211      9.191041 0.98 
1 1 1 -52 4  25 o 63.08919 8.433662 144.8857  25.6  13.85652       16.86732 0.93 
1 1 1 -52 4  26 o 105.2204 6.188804 170.7024  15.5  4.091309       12.37761 0.97 
1 1 1 -52 4  27 o 92.80840 6.950064 123.3671  87.2  -11.34453      13.90013 0.96 
1 1 1 -52 4  28 o 22.90623 8.043058 47.75410  215.9 7.774569       16.08612 0.58 
1 1 1 -52 4  29 o 36.31312 10.50729 9.689959  34.1  7.208080       21.01457 0.20 
1 1 1 -52 4  30 o 39.67083 10.53468 24.45641  182.9 3.287254       21.06936 0.50 
1 1 1 -52 4  31 o 57.11879 10.03232 101.2498  171.0 8.434841       20.06465 0.93 
1 1 1 -52 4  32 o 50.82557 8.986809 52.79565  123.8 ?              ?        0.87 
1 1 1 -52 6  1  o 237.7468 3.772782 291.7530  71.9  12.17360       7.545563 0.99 
1 1 1 -52 6  2  f 116.2380 4.864396 141.4090  60.1  25.28456       9.728792 0.00 
1 1 1 -52 6  3  o 183.8838 4.117465 199.4611  31.8  -17.72136      8.234930 0.98 
1 1 1 -52 6  4  o 143.1611 4.243251 189.5815  71.9  -17.21596      8.486502 0.97 
1 1 1 -52 6  5  o 59.89210 9.825480 120.1597  72.3  -19.32023      19.65096 0.88 
1 1 1 -52 6  6  o 26.08837 8.591656 43.68288  65.3  -0.8242321     17.18331 0.36 
1 1 1 -52 6  7  o 196.6984 3.834085 246.7728  196.4 -34.79745      7.668170 0.99 
1 1 1 -52 6  8  o 146.8516 4.590458 204.7739  212.7 -27.10823      9.180916 0.98 
1 1 1 -52 6  9  o 66.75888 8.830563 58.42909  302.8 13.09326       17.66113 0.80 
1 1 1 -52 6  10 o 80.68894 7.209064 152.6482  335.7 -23.06291      14.41813 0.94 
1 1 1 -52 6  11 o 185.2257 4.260906 221.7984  291.2 22.90422       8.521811 0.98 
1 1 1 -52 6  12 o 196.2310 4.055433 247.9616  289.6 2.384903       8.110867 0.99 
1 1 1 -52 6  13 o 116.8570 5.376362 186.1920  294.1 -16.05409      10.75272 0.97 
1 1 1 -52 6  14 o 125.0671 5.774649 153.0508  253.5 -13.95414      11.54930 0.96 
1 1 1 -52 6  15 o 92.11986 7.004807 83.65441  17.4  7.758720       14.00961 0.89 
1 1 1 -52 6  16 o 52.53886 11.06791 25.54437  337.5 -8.243759      22.13582 0.35 
1 1 1 -52 6  17 o 87.24556 6.711718 130.7300  237.2 -22.16851      13.42344 0.92 
1 1 1 -52 6  18 o 65.65845 9.798215 87.21569  322.7 26.05497       19.59643 0.83 
1 1 1 -52 6  19 o 96.89742 6.437104 176.0931  81.1  -15.75745      12.87421 0.95 
1 1 1 -52 6  20 o 50.79652 9.521491 91.95561  196.0 -46.73420      19.04298 0.81 
1 1 1 -52 6  21 o 112.5006 5.858713 227.8530  195.4 6.012695       11.71743 0.97 
1 1 1 -52 6  22 o 34.04730 9.557634 80.57832  98.2  16.39850       19.11527 0.71 
1 1 1 -52 6  23 o 115.4941 5.567822 176.2168  15.5  -3.688232      11.13564 0.97 
1 1 1 -52 6  24 o 55.01086 9.775018 82.30326  119.4 -7.219883      19.55004 0.88 
1 1 1 -52 6  25 o 42.28931 10.43961 104.8624  96.1  6.380009       20.87922 0.89 
1 1 1 -52 6  26 o 102.4152 5.978477 133.4765  64.9  -22.63172      11.95695 0.97 
1 1 1 -52 6  27 o 49.95625 10.32878 67.38470  347.1 2.334785       20.65756 0.87 
1 1 1 -52 6  28 o 65.46667 9.050346 142.5846  243.2 34.72010       18.10069 0.96 
1 1 1 -52 6  29 o 45.29166 11.52912 75.67712  274.7 2.945011       23.05825 0.87 
1 1 1 -52 6  30 o 42.19629 10.87250 46.65374  74.0  ?              ?        0.79 
1 1 1 -52 8  1  o 94.56914 6.453555 66.26274  68.9  1.855644       12.90711 0.88 
1 1 1 -52 8  2  o 105.6009 5.997275 142.4605  122.0 -17.68238      11.99455 0.95 
1 1 1 -52 8  3  f 139.0916 4.599849 230.9664  189.2 11.68330       9.199697 0.00 
1 1 1 -52 8  4  o 45.47929 11.88186 61.38762  223.2 36.71251       23.76372 0.63 
1 1 1 -52 8  5  o 84.60429 6.914607 125.5118  290.9 0.6878052      13.82921 0.92 
1 1 1 -52 8  6  o 100.6444 6.547368 170.0922  197.7 18.92709       13.09474 0.95 
1 1 1 -52 8  7  o 116.0320 5.561016 144.2468  109.5 40.62591       11.12203 0.95 
1 1 1 -52 8  8  o 113.6867 5.971619 204.1637  2.7   17.50258       11.94324 0.96 
1 1 1 -52 8  9  o 53.31882 10.07188 76.70539  50.5  7.567539       20.14376 0.75 
1 1 1 -52 8  10 o 80.40914 7.405594 113.2526  37.3  -25.13402      14.81119 0.91 
1 1 1 -52 8  11 o 69.21861 8.457415 109.1369  60.4  14.50291       16.91483 0.88 
1 1 1 -52 8  12 o 160.7386 4.352460 202.8545  68.3  16.14365       8.704920 0.98 
1 1 1 -52 8  13 o 94.23984 7.517118 150.8554  92.9  21.58795       15.03424 0.94 
1 1 1 -52 8  14 o 88.89453 7.492409 101.6264  343.1 -5.675842      14.98482 0.91 
1 1 1 -52 8  15 o 82.14636 7.943529 144.6524  52.6  -25.88673      15.88706 0.94 
1 1 1 -52 8  16 o 95.10664 6.892435 92.31787  201.7 19.90340       13.78487 0.92 
1 1 1 -52 8  17 f 114.2982 5.568311 198.5494  14.7  -18.05907      11.13662 0.00 
1 1 1 -52 8  18 o 135.4759 5.379694 203.0874  49.2  35.05882       10.75939 0.98 
1 1 1 -52 8  19 o 238.8281 4.402184 317.3231  229.8 3.539719       8.804368 0.99 
1 1 1 -52 8  20 o 92.90758 8.093728 105.8561  208.0 8.020042       16.18746 0.95 
1 1 1 -52 8  21 o 119.5944 5.807840 202.8389  349.6 -3.314529      11.61568 0.98 
1 1 1 -52 8  22 o 39.26721 10.79620 19.01791  6.7   -0.2746925     21.59239 0.39 
1 1 1 -52 8  23 o 76.91129 8.805440 149.2546  282.4 -5.117767      17.61088 0.97 
1 1 1 -52 8  24 o 34.20412 10.52526 76.98628  209.4 16.63270       21.05051 0.82 
1 1 1 -52 8  25 o 143.9280 4.674132 218.7318  121.2 5.825546       9.348265 0.99 
1 1 1 -52 8  26 o 28.46975 8.672651 38.76707  304.2 -12.09263      17.34530 0.60 
1 1 1 -52 8  27 o 66.35107 10.16513 117.4165  306.3 ?              ?        0.95 
1 1 1 -52 8  28 o 42.60075 10.31609 39.89103  349.0 ?              ?        0.77 
1 1 1 -52 10 1  o 63.17995 14.10249 78.08876  59.6  4.350414       28.20498 0.89 
1 1 1 -52 10 2  o 45.05966 11.41589 74.17132  20.2  -26.88159      22.83178 0.85 
1 1 1 -52 10 3  o 133.8563 6.210772 186.3208  271.9 19.09348       12.42154 0.98 
1 1 1 -52 10 4  o 100.5999 8.909872 108.0635  201.6 24.20551       17.81974 0.96 
1 1 1 -52 10 5  o 49.33599 10.97385 74.55170  128.1 3.967751       21.94770 0.85 
1 1 1 -52 10 6  o 53.41203 10.97160 100.0151  39.5  21.32479       21.94320 0.90 
1 1 1 -52 10 7  o 64.55710 9.329135 91.47765  55.9  -31.56362      18.65827 0.91 
1 1 1 -52 10 8  o 68.50848 9.278008 71.95231  117.1 26.90635       18.55602 0.89 
1 1 1 -52 10 9  o 58.94082 9.660881 84.88580  254.5 26.98937       19.32176 0.89 
1 1 1 -52 10 10 o 38.51377 11.31342 62.77535  184.7 -6.381233      22.62684 0.74 
1 1 1 -52 10 11 o 129.9322 5.347479 171.6737  103.5 -8.514023      10.69496 0.98 
1 1 1 -52 10 12 f 39.59228 10.73250 32.63076  117.0 2.765442       21.46499 0.00 
1 1 1 -52 10 13 o 95.56715 6.832993 164.4118  264.0 -2.868286      13.66599 0.97 
1 1 1 -52 10 14 o 147.7322 5.185799 248.6704  268.4 26.25626       10.37160 0.99 
1 1 1 -52 10 15 f 99.71069 7.495836 117.7209  278.5 37.74551       14.99167 0.00 
1 1 1 -52 10 16 o 29.71898 9.461637 48.15576  242.1 -0.2931061     18.92327 0.66 
1 1 1 -52 10 17 o 61.03613 10.97489 107.5584  351.1 3.228367       21.94977 0.93 
1 1 1 -52 10 18 o 39.74813 11.06882 107.2437  78.6  -19.12038      22.13765 0.90 
1 1 1 -52 10 19 o 95.83902 6.757621 116.9333  123.2 -4.430977      13.51524 0.97 
1 1 1 -52 10 20 o 48.49186 11.17299 97.20859  161.1 -11.23669      22.34597 0.91 
1 1 1 -52 10 21 o 39.24203 10.86760 46.64355  104.8 -6.409050      21.73520 0.74 
1 1 1 -52 10 22 o 41.78572 11.28689 47.60373  126.0 13.09947       22.57379 0.77 
1 1 1 -52 10 23 o 44.53594 10.36004 73.99306  192.5 ?              ?        0.88 
1 1 1 -52 10 24 o 28.36921 9.210141 44.81105  296.0 ?              ?        0.70 
1 1 1 -52 12 1  o 46.85475 11.91371 76.73407  60.1  ?              ?        0.89 
1 1 1 -52 12 2  o 35.22860 10.63880 16.19064  350.7 ?              ?        0.36 
1 1 1 -52 12 3  o 32.52389 10.41156 13.25802  17.5  ?              ?        0.28 
1 1 1 -52 12 4  o 65.05085 12.43612 108.1112  62.7  20.39068       24.87224 0.94 
1 1 1 -52 12 5  o 45.60482 11.89820 88.39252  316.9 1.879017       23.79641 0.89 
1 1 1 -52 12 6  f 30.96152 9.927813 44.14716  241.5 4.185760       19.85563 0.00 
1 1 1 -52 12 7  o 44.44894 12.07010 75.05993  173.6 3.199650       24.14019 0.86 
1 1 1 -52 12 8  o 37.12847 11.08076 22.83626  114.6 -3.807049      22.16153 0.47 
1 1 1 -52 12 9  o 45.01257 11.81881 71.07828  328.5 0.6966400E-01  23.63762 0.86 
1 1 1 -52 12 10 o 97.28847 7.688026 157.8878  276.9 16.95641       15.37605 0.98 
1 1 1 -52 12 11 o 65.31809 10.26670 128.4473  314.1 -5.445194      20.53340 0.95 
1 1 1 -52 12 12 o 138.5032 6.353888 232.4799  39.2  6.365753       12.70778 0.99 
1 1 1 -52 12 13 o 85.45042 8.524372 128.4982  66.1  -3.427292      17.04874 0.97 
1 1 1 -52 12 14 o 42.16645 11.22934 48.16624  356.5 -15.99537      22.45867 0.78 
1 1 1 -52 12 15 o 58.83286 12.06514 75.84012  230.2 ?              ?        0.91 
1 1 1 -52 12 16 o 36.86499 11.73307 28.11376  56.5  ?              ?        0.56 
1 1 1 -52 12 17 o 64.99125 11.22471 110.9710  62.4  ?              ?        0.95 
1 1 1 -52 12 18 x ?        ?        128.7142  74.6  ?              ?        0.00 
1 1 1 -51 1  1  o 91.15089 5.709690 156.8356  88.3  28.51786       11.41938 0.93 
1 1 1 -51 1  2  o 150.4861 3.724478 201.9867  343.3 -28.72932      7.448956 0.97 
1 1 1 -51 1  3  o 35.41625 9.452512 120.7655  286.9 9.026773       18.90502 0.69 
1 1 1 -51 1  4  o 175.2701 3.743502 196.7793  180.4 -4.482986      7.487004 0.97 
1 1 1 -51 1  5  f 150.3472 4.170434 172.8364  298.5 -16.60010      8.340868 0.00 
1 1 1 -51 1  6  o 144.2103 4.346710 181.9046  290.5 8.705551       8.693420 0.96 
1 1 1 -51 1  7  o 221.1339 3.992950 388.1605  305.1 -20.55577      7.985900 0.99 
1 1 1 -51 1  8  o 138.5730 5.085036 251.2863  57.1  -37.80738      10.17007 0.97 
1 1 1 -51 1  9  o 237.3363 4.165048 312.7495  105.2 -7.210236      8.330095 0.99 
1 1 1 -51 1  10 o 114.2914 5.803894 167.9914  160.7 -5.649620      11.60779 0.94 
1 1 1 -51 1  11 o 100.8078 6.622117 122.7592  318.0 -17.34066      13.24423 0.91 
1 1 1 -51 1  12 o 125.2727 5.842871 218.0027  204.9 21.08179       11.68574 0.96 
1 1 1 -51 1  13 o 54.99895 10.80677 54.55047  165.0 21.00229       21.61353 0.56 
1 1 1 -51 1  14 o 223.3475 4.181878 276.0513  53.4  -14.25482      8.363755 0.98 
1 1 1 -51 1  15 o 29.52037 9.616951 23.54590  336.3 -4.450163      19.23390 0.17 
1 1 1 -51 1  16 o 48.09047 10.60943 80.06136  162.1 -3.533531      21.21887 0.68 
1 1 1 -51 1  17 o 189.1577 4.071335 302.2184  191.0 -23.62718      8.142671 0.98 
1 1 1 -51 1  18 o 54.99389 9.437166 41.10680  143.0 -8.021297      18.87433 0.54 
1 1 1 -51 1  19 o 212.5234 3.773428 287.7884  22.8  6.678314       7.546856 0.99 
1 1 1 -51 1  20 o 178.7171 4.127702 293.7175  354.8 -22.13040      8.255404 0.99 
1 1 1 -51 1  21 o 33.24241 9.429968 7.103593  241.4 -9.144003      18.85994 0.09 
1 1 1 -51 1  22 o 130.4119 4.893834 172.3421  161.4 -16.33840      9.787668 0.97 
1 1 1 -51 1  23 o 39.25173 9.626496 46.13222  198.1 -22.09738      19.25299 0.46 
1 1 1 -51 1  24 o 68.57736 8.240425 76.60027  339.9 26.92604       16.48085 0.81 
1 1 1 -51 1  25 o 94.14922 5.879296 107.6544  24.4  2.359993       11.75859 0.92 
1 1 1 -51 1  26 o 94.42978 6.036538 62.01785  299.2 8.117783       12.07308 0.87 
1 1 1 -51 1  27 o 119.4253 5.542825 161.1884  258.8 -21.51320      11.08565 0.97 
1 1 1 -51 1  28 o 207.4558 5.290642 253.6628  245.3 4.360214       10.58128 0.99 
1 1 1 -51 1  29 o 105.0958 6.333071 132.6344  273.9 24.68735       12.66614 0.97 
1 1 1 -51 1  30 o 32.37633 10.16206 64.39487  208.6 -1.789003      20.32411 0.76 
1 1 1 -51 1  31 o 53.06695 9.774943 87.37633  100.7 -27.65144      19.54989 0.91 
1 1 1 -51 1  32 o 33.85279 10.37136 72.39301  83.1  13.94845       20.74273 0.81 
1 1 1 -51 1  33 f 82.15059 9.555348 126.4659  182.9 ?              ?        0.00 
1 1 1 -51 3  1  o 27.29911 8.369563 72.07847  91.5  -4.818199      16.73913 0.48 
1 1 1 -51 3  2  o 153.4156 3.839355 237.9787  203.1 -3.198013      7.678711 0.97 
1 1 1 -51 3  3  o 153.8683 4.123412 231.0020  166.1 -29.85477      8.246824 0.97 
1 1 1 -51 3  4  o 97.10313 6.190742 88.10087  294.2 43.52146       12.38148 0.87 
1 1 1 -51 3  5  o 68.03166 7.620848 27.82113  185.5 -14.37632      15.24170 0.41 
1 1 1 -51 3  6  o 188.3866 3.760048 281.1675  318.9 33.50395       7.520096 0.98 
1 1 1 -51 3  7  f 255.9936 3.831805 277.0782  233.7 -7.966721      7.663610 0.00 
1 1 1 -51 3  8  o 239.9445 3.649458 349.3057  218.9 13.43803       7.298916 0.99 
1 1 1 -51 3  9  o 220.5063 4.194011 312.7223  251.2 27.06102       8.388022 0.99 
1 1 1 -51 3  10 o 155.3553 4.630205 269.5226  130.3 -26.90845      9.260409 0.98 
1 1 1 -51 3  11 o 73.79362 9.266506 14.15186  259.4 42.30650       18.53301 0.24 
1 1 1 -51 3  12 o 284.1088 4.087040 457.0037  327.0 33.21036       8.174080 0.99 
1 1 1 -51 3  13 o 80.98416 8.199667 87.39342  233.0 2.248093       16.39933 0.84 
1 1 1 -51 3  14 o 147.9171 5.305631 219.1620  202.3 18.38077       10.61126 0.97 
1 1 1 -51 3  15 o 112.4118 6.119056 170.0544  233.3 -39.13939      12.23811 0.95 
1 1 1 -51 3  16 o 152.2835 4.578167 225.6662  120.2 -17.28914      9.156335 0.98 
1 1 1 -51 3  17 o 51.73771 11.24314 42.94432  14.5  -23.32420      22.48629 0.54 
1 1 1 -51 3  18 o 164.7714 4.135436 261.3196  296.8 9.359894       8.270871 0.98 
1 1 1 -51 3  19 o 37.82154 10.42394 78.10368  87.0  -0.1421661     20.84788 0.73 
1 1 1 -51 3  20 o 84.16597 6.376581 87.58562  11.0  -25.89849      12.75316 0.91 
1 1 1 -51 3  21 o 118.8042 4.978706 179.1921  57.5  8.024086       9.957412 0.97 
1 1 1 -51 3  22 o 99.20877 6.092681 123.8499  123.5 28.33387       12.18536 0.93 
1 1 1 -51 3  23 o 49.78915 11.52627 68.51157  53.5  -17.45179      23.05254 0.68 
1 1 1 -51 3  24 o 130.4975 4.742135 195.2065  55.4  -15.35563      9.484270 0.97 
1 1 1 -51 3  25 o 158.0519 4.564696 223.5710  228.6 -15.02579      9.129392 0.98 
1 1 1 -51 3  26 o 45.75589 10.09213 40.77027  296.3 -14.13138      20.18426 0.57 
1 1 1 -51 3  27 o 162.5678 4.611576 225.1737  74.4  23.11049       9.223151 0.99 
1 1 1 -51 3  28 o 108.9197 5.859462 122.6426  76.9  4.793808       11.71892 0.97 
1 1 1 -51 3  29 o 56.56735 11.33368 72.48862  131.1 0.3629837      22.66736 0.89 
1 1 1 -51 3  30 o 30.17070 9.552671 24.40854  200.7 2.245941       19.10534 0.41 
1 1 1 -51 3  31 o 35.85221 10.85717 46.40970  347.6 5.090458       21.71434 0.69 
1 1 1 -51 3  32 o 62.31282 11.13235 80.00761  59.0  32.28550       22.26471 0.92 
1 1 1 -51 3  33 o 35.16369 11.10076 13.39601  145.6 ?              ?        0.32 
1 1 1 -51 5  1  o 108.0051 4.835046 114.9348  85.2  9.950615       9.670092 0.94 
1 1 1 -51 5  2  o 90.12213 6.480015 72.92091  24.5  11.40021       12.96003 0.89 
1 1 1 -51 5  3  o 121.9634 4.624500 170.5781  339.6 -17.35664      9.249001 0.97 
1 1 1 -51 5  4  o 159.0370 4.014991 204.8877  53.0  -12.71179      8.029983 0.98 
1 1 1 -51 5  5  o 33.38903 9.924253 22.43835  337.3 -6.524302      19.84851 0.22 
1 1 1 -51 5  6  o 61.75073 9.302645 50.10088  191.7 3.659073       18.60529 0.66 
1 1 1 -51 5  7  o 103.4374 5.703372 134.1247  3.3   -25.26173      11.40674 0.94 
1 1 1 -51 5  8  o 120.3747 5.134711 170.1208  321.8 -19.40412      10.26942 0.96 
1 1 1 -51 5  9  o 50.67128 10.90567 88.17305  4.7   5.037399       21.81135 0.76 
1 1 1 -51 5  10 o 104.9371 5.422786 198.3914  251.4 -30.38675      10.84557 0.96 
1 1 1 -51 5  11 o 42.29457 9.510199 113.8907  75.8  22.24208       19.02040 0.80 
1 1 1 -51 5  12 o 150.2311 4.327596 227.5060  12.2  15.91353       8.655192 0.98 
1 1 1 -51 5  13 o 175.9699 4.668149 253.6435  354.5 21.64308       9.336299 0.98 
1 1 1 -51 5  14 o 135.6783 4.693437 265.5210  52.2  -8.385941      9.386874 0.98 
1 1 1 -51 5  15 f 44.63070 10.32967 81.51334  33.4  -31.31754      20.65934 0.00 
1 1 1 -51 5  16 o 28.67264 9.213593 78.58352  159.4 -2.600143      18.42719 0.66 
1 1 1 -51 5  17 o 99.46524 8.653728 174.9610  331.4 5.956657       17.30746 0.96 
1 1 1 -51 5  18 o 151.3489 4.686650 265.3801  344.8 -19.13275      9.373301 0.98 
1 1 1 -51 5  19 o 35.75765 10.29214 74.14419  148.1 -19.44191      20.58428 0.62 
1 1 1 -51 5  20 o 41.90665 10.48194 134.0920  223.6 -2.058235      20.96389 0.82 
1 1 1 -51 5  21 o 85.03697 7.017933 135.2522  257.4 12.00617       14.03587 0.92 
1 1 1 -51 5  22 o 75.08800 7.005673 138.0337  287.3 6.904701       14.01135 0.92 
1 1 1 -51 5  23 o 118.8715 5.211913 187.3893  237.1 0.9942017      10.42383 0.97 
1 1 1 -51 5  24 o 196.7348 4.277597 313.9853  157.2 -47.56197      8.555195 0.99 
1 1 1 -51 5  25 o 29.35253 9.312745 59.05241  348.6 7.979794       18.62549 0.60 
1 1 1 -51 5  26 o 40.59322 9.581453 83.34213  17.9  -20.84097      19.16291 0.83 
1 1 1 -51 5  27 o 53.23479 9.553636 72.68814  138.5 -32.18068      19.10727 0.88 
1 1 1 -51 5  28 o 81.19086 9.147886 140.2357  179.4 -23.57246      18.29577 0.96 
1 1 1 -51 5  29 o 37.15979 10.35522 3.206155  266.5 -1.303936      20.71044 0.07 
1 1 1 -51 5  30 o 36.91868 10.70377 12.56010  149.0 -1.530643      21.40755 0.28 
1 1 1 -51 5  31 o 55.97323 10.87480 89.18538  232.6 ?              ?        0.92 
1 1 1 -51 7  1  o 116.7850 4.847051 164.5430  213.4 5.043953       9.694101 0.95 
1 1 1 -51 7  2  o 49.78383 9.859076 107.7319  61.9  -25.03993      19.71815 0.80 
1 1 1 -51 7  3  o 150.0869 4.770212 164.3346  50.3  -20.62045      9.540423 0.96 
1 1 1 -51 7  4  o 36.96053 10.27693 64.41548  303.1 13.88338       20.55386 0.55 
1 1 1 -51 7  5  o 124.1430 5.090020 155.3349  276.1 20.08350       10.18004 0.96 
1 1 1 -51 7  6  o 166.1081 4.260243 212.9551  132.8 9.144501       8.520487 0.98 
1 1 1 -51 7  7  o 103.3080 6.408645 147.9044  227.5 13.75499       12.81729 0.95 
1 1 1 -51 7  8  o 125.0244 5.038305 133.4421  276.1 -30.58513      10.07661 0.96 
1 1 1 -51 7  9  o 115.4519 5.503925 175.4712  77.1  0.7616501      11.00785 0.96 
1 1 1 -51 7  10 o 60.54165 8.252745 74.44045  114.2 1.156593       16.50549 0.81 
1 1 1 -51 7  11 o 45.79141 9.150578 119.0895  283.7 34.95410       18.30116 0.84 
1 1 1 -51 7  12 o 46.99080 11.04161 39.90659  228.3 2.566658       22.08322 0.50 
1 1 1 -51 7  13 o 52.73623 9.478833 66.01815  65.6  13.02365       18.95767 0.72 
1 1 1 -51 7  14 o 109.8250 5.151512 178.7910  141.5 9.146927       10.30302 0.96 
1 1 1 -51 7  15 o 192.6339 4.052705 284.2086  112.3 -10.15800      8.105411 0.98 
1 1 1 -51 7  16 o 68.14440 9.486940 68.03529  116.0 -40.96053      18.97388 0.78 
1 1 1 -51 7  17 o 89.73305 6.985290 101.7114  336.0 3.453964       13.97058 0.91 
1 1 1 -51 7  18 o 72.20808 9.277708 88.97502  96.8  1.347282       18.55542 0.86 
1 1 1 -51 7  19 o 217.5246 4.836331 322.8895  148.7 8.984024       9.672663 0.99 
1 1 1 -51 7  20 o 85.54860 7.351646 61.63090  130.2 -0.8730240     14.70329 0.86 
1 1 1 -51 7  21 o 105.6167 5.836463 189.2172  286.2 12.03809       11.67293 0.97 
1 1 1 -51 7  22 o 51.38318 11.06221 92.36095  269.8 -2.038177      22.12441 0.86 
1 1 1 -51 7  23 o 132.2113 5.568413 198.1983  289.4 -18.47248      11.13683 0.98 
1 1 1 -51 7  24 o 73.84052 8.887503 114.4136  326.0 2.000626       17.77501 0.95 
1 1 1 -51 7  25 o 143.0988 4.756109 212.9766  57.7  6.473907       9.512218 0.99 
1 1 1 -51 7  26 o 56.91400 10.16719 96.58525  144.8 -6.009674      20.33437 0.92 
1 1 1 -51 7  27 o 37.53690 10.35321 32.91661  249.6 12.10584       20.70642 0.59 
1 1 1 -51 7  28 o 91.94231 7.296465 128.0940  12.0  -2.965736      14.59293 0.97 
1 1 1 -51 7  29 o 43.98783 11.45074 92.68424  32.7  ?              ?        0.90 
1 1 1 -51 7  30 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -51 9  1  o 151.4222 6.729988 192.6226  120.2 -3.247223      13.45998 0.98 
1 1 1 -51 9  2  o 90.47268 6.297521 117.6680  97.0  -3.986298      12.59504 0.94 
1 1 1 -51 9  3  o 29.68239 9.461227 30.73843  106.1 -4.222683      18.92245 0.32 
1 1 1 -51 9  4  o 111.5747 5.774148 144.6256  145.2 -7.934013      11.54830 0.96 
1 1 1 -51 9  5  o 56.87421 10.74010 79.65852  34.7  -1.470501      21.48019 0.81 
1 1 1 -51 9  6  o 56.04164 10.07465 77.10002  50.1  -1.559998      20.14931 0.80 
1 1 1 -51 9  7  o 30.62152 9.620486 47.14795  65.0  -2.055511      19.24097 0.43 
1 1 1 -51 9  8  o 32.15127 9.654661 68.70319  89.4  2.267639       19.30932 0.58 
1 1 1 -51 9  9  o 56.20634 9.837663 94.19335  15.0  22.93903       19.67533 0.84 
1 1 1 -51 9  10 f 70.30656 8.809107 108.4546  63.7  -28.45643      17.61821 0.00 
1 1 1 -51 9  11 o 58.73817 9.601816 88.64024  240.4 -4.038189      19.20363 0.84 
1 1 1 -51 9  12 o 72.42743 8.799183 73.83209  342.7 3.737823       17.59837 0.85 
1 1 1 -51 9  13 o 92.24890 7.124199 121.2205  83.6  20.19846       14.24840 0.94 
1 1 1 -51 9  14 o 46.01507 10.41889 89.24622  18.5  -28.36806      20.83778 0.81 
1 1 1 -51 9  15 o 59.39941 10.35498 86.84030  23.9  -2.771000      20.70997 0.86 
1 1 1 -51 9  16 o 133.8798 5.575800 213.0123  188.1 -24.23360      11.15160 0.98 
1 1 1 -51 9  17 o 50.79723 11.01742 96.93685  173.7 -6.446133      22.03485 0.87 
1 1 1 -51 9  18 o 91.28673 7.878764 142.2438  33.1  -52.61304      15.75753 0.96 
1 1 1 -51 9  19 o 37.87350 10.47516 71.78683  359.3 -11.21195      20.95032 0.79 
1 1 1 -51 9  20 o 130.3490 4.946979 176.6696  166.4 22.45231       9.893957 0.98 
1 1 1 -51 9  21 o 83.37900 7.333643 91.54963  211.2 -19.77499      14.66729 0.95 
1 1 1 -51 9  22 o 62.44874 10.21123 96.19698  121.1 4.479393       20.42246 0.93 
1 1 1 -51 9  23 o 36.15070 10.81817 64.86421  129.6 16.41958       21.63634 0.80 
1 1 1 -51 9  24 o 44.57877 10.64379 81.93977  210.2 1.230556       21.28758 0.88 
1 1 1 -51 9  25 o 31.28896 9.899289 64.54365  118.7 3.367393       19.79858 0.79 
1 1 1 -51 9  26 o 35.96353 10.82902 60.77105  31.3  ?              ?        0.81 
1 1 1 -51 9  27 o 32.40703 10.02989 66.94469  227.6 ?              ?        0.83 
1 1 1 -51 11 1  o 136.9281 5.645738 199.7041  105.0 9.561020       11.29148 0.99 
1 1 1 -51 11 2  o 27.97792 9.393389 44.97822  5.4   -0.9686279E-01 18.78678 0.61 
1 1 1 -51 11 3  o 67.75368 11.75745 84.44248  351.7 -15.66477      23.51489 0.92 
1 1 1 -51 11 4  o 83.19290 10.19435 140.2109  88.6  -22.68491      20.38870 0.96 
1 1 1 -51 11 5  o 35.31986 10.45121 14.32901  44.0  10.14165       20.90242 0.29 
1 1 1 -51 11 6  o 75.76659 10.09374 126.6191  358.4 -19.83024      20.18749 0.96 
1 1 1 -51 11 7  o 64.93594 9.389474 115.4937  116.5 18.76387       18.77895 0.95 
1 1 1 -51 11 8  o 131.1160 5.185031 193.2714  148.2 10.97519       10.37006 0.99 
1 1 1 -51 11 9  o 81.01465 8.461703 105.3170  309.4 -22.04203      16.92341 0.95 
1 1 1 -51 11 10 o 55.81111 11.16034 83.89759  291.0 -10.41653      22.32067 0.90 
1 1 1 -51 11 11 o 65.01288 9.023760 66.11113  145.3 -15.86937      18.04752 0.91 
1 1 1 -51 11 12 o 125.7202 5.530488 196.6180  92.6  -9.337502      11.06098 0.99 
1 1 1 -51 11 13 o 158.8793 5.877398 261.1049  118.6 5.266098       11.75480 0.99 
1 1 1 -51 11 14 o 87.81270 9.413598 167.5422  203.6 53.59845       18.82720 0.97 
1 1 1 -51 11 15 o 91.85838 7.153327 176.1016  207.7 -25.21016      14.30665 0.98 
1 1 1 -51 11 16 o 70.78302 9.909761 113.0784  182.3 -2.870453      19.81952 0.95 
1 1 1 -51 11 17 o 84.54118 8.248467 142.0319  230.8 -12.30451      16.49693 0.97 
1 1 1 -51 11 18 o 51.45097 11.65429 71.89849  313.0 15.69223       23.30858 0.88 
1 1 1 -51 11 19 o 36.43734 10.45052 44.02007  11.7  -5.976704      20.90103 0.71 
1 1 1 -51 11 20 o 84.14759 8.321576 148.4035  229.5 -3.807892      16.64315 0.97 
1 1 1 -51 11 21 o 27.66178 9.204038 69.06046  282.3 ?              ?        0.80 
1 1 1 -51 11 22 o 38.40594 11.26931 22.55274  328.8 ?              ?        0.52 
1 1 1 -51 13 5  x ?        ?        73.08911  117.8 ?              ?        0.00 
1 1 1 -51 13 6  o 36.57189 11.43080 40.77741  186.8 ?              ?        0.71 
1 1 1 -51 13 7  o 40.20009 11.62454 63.42110  199.1 ?              ?        0.84 
1 1 1 -51 13 8  o 58.09880 11.63843 81.10580  237.7 ?              ?        0.92 
1 1 1 -51 13 9  o 25.11921 8.663419 44.38752  28.3  ?              ?        0.67 
1 1 1 -51 13 10 o 69.69115 10.73201 104.2216  293.9 ?              ?        0.95 
1 1 1 -51 13 11 o 91.07178 9.966368 153.3258  254.1 ?              ?        0.98 
1 1 1 -51 13 12 f 48.74584 10.47329 102.6879  351.7 ?              ?        0.00 
1 1 1 -51 13 13 x ?        ?        82.58870  346.9 ?              ?        0.00 
1 1 1 -50 0  1  o 44.41432 15.52129 118.3882  360.0 -0.000000      0.000000 0.82 
1 1 1 -50 0  2  o 243.3212 4.646174 375.4950  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  3  o 13.32707 9.621575 35.45076  360.0 -0.000000      0.000000 0.10 
1 1 1 -50 0  4  o 366.4051 5.221468 375.2144  180.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  5  o 261.9969 6.050023 349.9049  180.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  6  o 159.9203 5.688757 210.6004  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  7  o 165.0281 5.565209 164.2758  0.0   -0.000000      0.000000 1.00 
1 1 1 -50 0  8  o 100.2764 8.914754 178.4130  0.0   -0.000000      0.000000 1.00 
1 1 1 -50 0  9  o 46.84750 19.39147 94.02853  0.0   -0.000000      0.000000 0.67 
1 1 1 -50 0  10 o 185.4258 6.638118 202.7523  180.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  11 o 62.22893 17.97867 16.24232  180.0 -0.000000      0.000000 0.20 
1 1 1 -50 0  12 o 69.90104 16.26038 8.243950  180.0 -0.000000      0.000000 0.12 
1 1 1 -50 0  13 o 257.7759 5.837919 430.1763  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  14 o 176.8664 6.050183 276.7847  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  15 o 36.93495 17.88775 54.03688  360.0 -0.000000      0.000000 0.41 
1 1 1 -50 0  16 o 111.4599 6.836123 136.2691  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  17 o 21.52938 14.20837 15.91402  0.0   -0.000000      0.000000 0.08 
1 1 1 -50 0  18 o 172.4561 5.634885 335.5278  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  19 f 292.3925 5.540787 434.4338  360.0 -0.000000      0.000000 0.00 
1 1 1 -50 0  20 o 53.27938 17.08996 137.0856  360.0 -0.000000      0.000000 0.97 
1 1 1 -50 0  21 o 39.70024 18.38197 9.820878  180.0 -0.000000      0.000000 0.13 
1 1 1 -50 0  22 o 149.4386 5.852356 226.0051  360.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  23 o 148.8667 6.177010 290.9805  0.0   -0.000000      0.000000 1.00 
1 1 1 -50 0  24 o 32.94036 17.95929 151.7099  180.0 -0.000000      0.000000 0.86 
1 1 1 -50 0  25 o 88.58501 9.320494 129.5526  180.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  26 o 46.92701 17.12919 13.09549  180.0 -0.000000      0.000000 0.18 
1 1 1 -50 0  27 o 15.91566 11.36954 61.08148  360.0 -0.000000      0.000000 0.34 
1 1 1 -50 0  28 o 166.6494 6.263815 232.8327  180.0 -0.000000      0.000000 1.00 
1 1 1 -50 0  29 o 32.06310 17.54363 61.07500  360.0 -0.000000      0.000000 0.71 
1 1 1 -50 0  30 o 42.96788 18.91017 84.52422  0.0   -0.000000      0.000000 0.95 
1 1 1 -50 0  31 o 28.25870 19.39186 34.77742  180.0 -0.000000      0.000000 0.47 
1 1 1 -50 0  32 o 29.25625 18.10934 39.63763  0.0   -0.000000      0.000000 0.56 
1 1 1 -50 0  33 o 25.74380 16.26380 25.09546  180.0 -0.000000      0.000000 0.38 
1 1 1 -50 0  34 o 34.07429 19.32989 0.1790478 180.0 ?              ?        0.00 
1 1 1 -50 2  1  o 110.5170 5.199471 156.1221  56.2  22.13206       10.39894 0.94 
1 1 1 -50 2  2  o 210.5159 3.415166 280.9056  63.8  -37.12088      6.830332 0.98 
1 1 1 -50 2  3  f 150.2939 3.844393 193.8669  287.7 27.52975       7.688785 0.00 
1 1 1 -50 2  4  o 173.8276 3.829556 272.8407  217.3 -8.959396      7.659112 0.98 
1 1 1 -50 2  5  o 189.2204 3.839872 263.3195  238.7 4.758377       7.679744 0.98 
1 1 1 -50 2  6  o 109.9187 4.980696 144.5352  151.4 2.610626       9.961392 0.93 
1 1 1 -50 2  7  o 181.7216 3.682349 267.1707  29.4  20.31065       7.364699 0.98 
1 1 1 -50 2  8  o 188.1855 4.195473 259.1971  220.6 24.06326       8.390945 0.98 
1 1 1 -50 2  9  o 252.2813 4.294158 376.0580  205.2 26.23973       8.588315 0.99 
1 1 1 -50 2  10 o 39.87258 10.59793 99.12933  229.6 12.53719       21.19586 0.64 
1 1 1 -50 2  11 o 52.85075 10.29257 40.25959  110.1 -9.819927      20.58514 0.42 
1 1 1 -50 2  12 o 100.5945 6.130794 147.1526  264.2 23.25883       12.26159 0.92 
1 1 1 -50 2  13 o 54.62853 10.08024 43.24251  189.6 9.525177       20.16047 0.47 
1 1 1 -50 2  14 o 52.17593 8.481949 95.94788  97.0  -54.51345      16.96390 0.75 
1 1 1 -50 2  15 o 150.2208 4.648768 269.1486  140.0 -17.81941      9.297536 0.98 
1 1 1 -50 2  16 o 186.7959 3.736936 317.5463  138.4 5.286087       7.473872 0.98 
1 1 1 -50 2  17 o 138.5579 4.607561 225.2323  229.3 7.815079       9.215122 0.97 
1 1 1 -50 2  18 o 85.37400 6.667048 143.2142  182.0 -23.43719      13.33410 0.92 
1 1 1 -50 2  19 o 52.49129 9.187865 103.0898  7.6   -27.53573      18.37573 0.83 
1 1 1 -50 2  20 o 104.7793 5.314600 178.3383  337.0 -11.83160      10.62920 0.96 
1 1 1 -50 2  21 o 67.10497 7.478578 153.4342  183.7 9.043327       14.95716 0.94 
1 1 1 -50 2  22 o 137.5275 4.718691 237.1984  120.5 -7.724869      9.437383 0.98 
1 1 1 -50 2  23 o 86.76588 6.032240 170.0181  350.0 -7.278259      12.06448 0.94 
1 1 1 -50 2  24 o 64.40088 9.094798 59.68004  353.8 -40.28255      18.18960 0.72 
1 1 1 -50 2  25 o 33.18348 9.450626 49.95682  232.0 3.548992       18.90125 0.45 
1 1 1 -50 2  26 o 148.9250 4.510495 279.2416  281.4 1.976730       9.020989 0.98 
1 1 1 -50 2  27 o 98.45479 5.997535 137.4518  295.9 4.925781       11.99507 0.95 
1 1 1 -50 2  28 o 91.76553 6.659255 135.2117  230.8 31.94863       13.31851 0.96 
1 1 1 -50 2  29 o 45.29131 10.36768 41.65596  135.4 -5.725967      20.73536 0.69 
1 1 1 -50 2  30 o 42.94484 10.63413 35.96128  214.6 -9.751846      21.26826 0.67 
1 1 1 -50 2  31 f 37.95063 11.07717 74.36011  117.5 6.266434       22.15434 0.00 
1 1 1 -50 2  32 o 35.58589 10.38516 48.95052  93.1  7.985214       20.77031 0.72 
1 1 1 -50 2  33 o 47.34456 11.45559 42.30518  133.8 ?              ?        0.77 
1 1 1 -50 4  1  o 95.57073 5.596529 129.7681  276.7 -14.39102      11.19306 0.93 
1 1 1 -50 4  2  o 158.8873 3.969324 198.6434  223.3 -19.24246      7.938649 0.97 
1 1 1 -50 4  3  o 249.4048 3.537196 302.3853  201.3 -11.06880      7.074392 0.99 
1 1 1 -50 4  4  o 147.8846 4.222099 107.5393  272.4 -12.65318      8.444198 0.94 
1 1 1 -50 4  5  o 176.1772 4.012417 162.4401  49.3  19.39549       8.024835 0.96 
1 1 1 -50 4  6  o 307.9152 3.876748 440.2514  357.0 -20.99551      7.753497 0.99 
1 1 1 -50 4  7  o 223.5970 3.768866 271.8447  324.7 -14.84598      7.537733 0.98 
1 1 1 -50 4  8  o 209.0462 3.658931 301.3448  285.0 -3.288666      7.317861 0.98 
1 1 1 -50 4  9  f 258.9888 3.526448 354.3541  284.0 7.104080       7.052896 0.00 
1 1 1 -50 4  10 o 210.2018 3.673101 240.2067  274.6 -14.22670      7.346203 0.98 
1 1 1 -50 4  11 o 146.5313 4.754851 198.6430  39.3  32.21181       9.509703 0.97 
1 1 1 -50 4  12 f 81.02904 6.964163 79.99341  129.1 -27.60420      13.92833 0.00 
1 1 1 -50 4  13 o 31.95496 9.911429 12.28787  331.2 -7.057852      19.82286 0.10 
1 1 1 -50 4  14 o 132.0163 5.297578 136.1503  122.6 1.146393       10.59516 0.95 
1 1 1 -50 4  15 o 67.72746 8.489924 78.23198  81.2  8.332222       16.97985 0.80 
1 1 1 -50 4  16 o 182.5035 4.910544 298.2394  124.8 3.250870       9.821089 0.98 
1 1 1 -50 4  17 f 42.65637 10.18076 65.34178  345.3 -6.694679      20.36152 0.00 
1 1 1 -50 4  18 o 59.87562 10.23148 148.2199  303.9 7.658108       20.46295 0.91 
1 1 1 -50 4  19 o 102.8780 5.786156 127.9447  180.7 -17.78599      11.57231 0.95 
1 1 1 -50 4  20 o 90.60002 10.83713 152.8629  192.1 11.15479       21.67427 0.95 
1 1 1 -50 4  21 o 48.98849 8.224347 30.04350  97.8  38.49527       16.44869 0.43 
1 1 1 -50 4  22 o 36.50292 9.945170 37.94966  7.8   4.200367       19.89034 0.36 
1 1 1 -50 4  23 f 75.97575 6.505883 135.2141  29.6  15.31277       13.01177 0.00 
1 1 1 -50 4  24 o 49.32772 10.84650 50.52739  341.7 -10.32245      21.69300 0.60 
1 1 1 -50 4  25 o 167.8637 4.319286 258.0865  283.9 4.097473       8.638573 0.98 
1 1 1 -50 4  26 o 48.71480 9.688271 79.87218  340.1 -18.05112      19.37654 0.82 
1 1 1 -50 4  27 o 52.90860 10.09886 70.88055  344.7 -5.516563      20.19773 0.84 
1 1 1 -50 4  28 o 73.75917 8.444977 89.43063  100.1 -7.243988      16.88995 0.93 
1 1 1 -50 4  29 o 31.30930 9.622409 59.03781  6.7   -11.70426      19.24482 0.74 
1 1 1 -50 4  30 o 38.79484 10.00566 71.45583  164.0 -13.02386      20.01133 0.83 
1 1 1 -50 4  31 o 39.72961 11.48124 34.69654  222.1 7.080730       22.96248 0.63 
1 1 1 -50 4  32 o 52.87243 11.34642 64.26677  216.6 ?              ?        0.88 
1 1 1 -50 6  1  o 111.5428 5.131314 141.6562  177.6 7.722649       10.26263 0.95 
1 1 1 -50 6  2  o 206.9450 3.870261 273.8640  293.4 -30.91257      7.740523 0.99 
1 1 1 -50 6  3  o 219.4134 3.728147 263.6199  315.8 10.09514       7.456294 0.99 
1 1 1 -50 6  4  o 57.61997 8.606891 86.23205  53.7  -7.175625      17.21378 0.84 
1 1 1 -50 6  5  o 32.42832 8.587363 63.30649  109.1 -23.53300      17.17473 0.57 
1 1 1 -50 6  6  o 110.1853 5.193170 127.3274  82.7  18.72762       10.38634 0.95 
1 1 1 -50 6  7  o 163.9878 4.456694 173.9311  65.7  4.187225       8.913387 0.97 
1 1 1 -50 6  8  o 143.0278 4.238045 217.0940  53.4  2.346802       8.476089 0.98 
1 1 1 -50 6  9  o 157.2204 4.226470 239.6452  11.5  12.65573       8.452939 0.98 
1 1 1 -50 6  10 o 107.7843 5.616070 128.8777  20.4  10.51082       11.23214 0.94 
1 1 1 -50 6  11 o 133.7775 4.776634 189.3663  126.4 24.22155       9.553268 0.97 
1 1 1 -50 6  12 o 167.4461 4.013066 281.5257  70.7  6.802063       8.026133 0.99 
1 1 1 -50 6  13 o 183.6819 3.869108 308.8246  44.5  1.671127       7.738216 0.99 
1 1 1 -50 6  14 o 104.8601 10.62815 180.8226  83.9  44.08858       21.25629 0.96 
1 1 1 -50 6  15 o 122.5752 5.314141 105.6429  28.3  -30.53555      10.62828 0.95 
1 1 1 -50 6  16 o 52.66632 10.48725 26.11920  108.0 -5.572197      20.97449 0.44 
1 1 1 -50 6  17 o 74.19434 8.288693 127.4086  350.6 -1.757744      16.57739 0.92 
1 1 1 -50 6  18 o 134.3085 5.655925 172.1024  41.9  -44.26052      11.31185 0.97 
1 1 1 -50 6  19 o 79.35344 7.955580 71.59667  126.5 25.94782       15.91116 0.83 
1 1 1 -50 6  20 o 53.77365 10.21894 90.58849  350.7 -7.250626      20.43787 0.79 
1 1 1 -50 6  21 o 84.92548 7.195784 127.9048  226.5 -29.36192      14.39157 0.92 
1 1 1 -50 6  22 o 80.90880 8.207723 210.3275  179.3 50.26069       16.41545 0.96 
1 1 1 -50 6  23 o 77.58462 7.538887 93.68846  199.1 13.38936       15.07777 0.90 
1 1 1 -50 6  24 o 28.44444 9.128066 63.31644  251.8 -0.3394051     18.25613 0.60 
1 1 1 -50 6  25 o 108.5932 5.673543 176.6610  38.5  6.567085       11.34709 0.97 
1 1 1 -50 6  26 o 62.34415 8.986112 112.7609  132.9 13.71885       17.97222 0.93 
1 1 1 -50 6  27 o 85.95935 6.506475 138.0166  157.3 -1.798210      13.01295 0.97 
1 1 1 -50 6  28 o 52.82717 11.08153 63.66404  110.6 16.68874       22.16307 0.86 
1 1 1 -50 6  29 o 62.29192 10.17903 137.9088  124.4 -11.80883      20.35806 0.95 
1 1 1 -50 6  30 o 100.1077 8.162852 164.3336  163.1 -15.65237      16.32570 0.98 
1 1 1 -50 6  31 f 31.68641 10.10326 30.73401  303.3 ?              ?        0.00 
1 1 1 -50 8  1  o 55.74631 9.039518 113.7014  146.2 -26.98020      18.07904 0.85 
1 1 1 -50 8  2  o 35.08717 10.07311 68.77539  45.2  0.2016068E-01  20.14622 0.56 
1 1 1 -50 8  3  o 101.7682 5.511634 122.2067  61.6  -10.75762      11.02327 0.93 
1 1 1 -50 8  4  o 103.9266 8.097666 137.0478  118.8 -14.59695      16.19533 0.94 
1 1 1 -50 8  5  f 132.6035 5.086895 131.3113  260.5 18.34047       10.17379 0.00 
1 1 1 -50 8  6  o 74.04119 8.217656 105.9557  183.9 13.64732       16.43531 0.88 
1 1 1 -50 8  7  o 49.24697 9.839839 56.91595  122.1 -4.157326      19.67968 0.61 
1 1 1 -50 8  8  f 96.39259 6.917611 85.14568  164.0 1.503662       13.83522 0.00 
1 1 1 -50 8  9  o 45.73835 10.22188 51.12103  292.0 19.22630       20.44377 0.55 
1 1 1 -50 8  10 o 41.43309 10.59916 49.28522  195.3 6.769306       21.19833 0.50 
1 1 1 -50 8  11 o 96.50346 7.106959 118.2667  266.5 40.25398       14.21392 0.92 
1 1 1 -50 8  12 o 140.2694 4.687529 240.0786  354.7 19.31796       9.375058 0.97 
1 1 1 -50 8  13 o 158.2116 4.236808 259.3988  43.6  1.661499       8.473617 0.98 
1 1 1 -50 8  14 o 107.6687 5.606859 194.4767  125.2 30.41323       11.21372 0.96 
1 1 1 -50 8  15 o 157.6300 4.399714 221.1491  131.3 -21.77071      8.799429 0.98 
1 1 1 -50 8  16 o 168.9421 4.399430 263.8169  89.5  -23.53847      8.798860 0.98 
1 1 1 -50 8  17 o 145.5505 4.923119 245.7189  130.5 -24.76941      9.846238 0.98 
1 1 1 -50 8  18 o 39.16104 10.75023 64.19651  234.2 4.719357       21.50046 0.63 
1 1 1 -50 8  19 o 35.61116 10.38162 75.67518  167.3 -17.71733      20.76324 0.69 
1 1 1 -50 8  20 o 141.6809 5.051852 220.8266  170.9 -4.938873      10.10370 0.98 
1 1 1 -50 8  21 o 105.0844 6.787101 150.4343  228.6 -2.440834      13.57420 0.97 
1 1 1 -50 8  22 o 58.62423 10.47803 68.12662  320.4 10.08357       20.95606 0.86 
1 1 1 -50 8  23 o 43.97068 10.86799 34.06786  158.5 21.04041       21.73597 0.62 
1 1 1 -50 8  24 o 46.97467 10.99198 117.9591  190.5 8.990921       21.98395 0.92 
1 1 1 -50 8  25 o 34.61095 9.993711 31.64827  357.0 -9.168726      19.98742 0.56 
1 1 1 -50 8  26 o 32.01422 10.07980 36.22971  122.7 -0.3615837     20.15960 0.58 
1 1 1 -50 8  27 o 62.43280 9.763750 108.2984  143.6 -5.759460      19.52750 0.94 
1 1 1 -50 8  28 o 46.46477 10.86363 67.02798  41.0  ?              ?        0.87 
1 1 1 -50 8  29 o 32.06983 10.13473 15.23740  305.4 ?              ?        0.35 
1 1 1 -50 10 1  f 95.79797 9.164736 194.5401  143.8 -19.25918      18.32947 0.00 
1 1 1 -50 10 2  o 129.2447 7.088288 147.9744  87.1  8.547882       14.17658 0.97 
1 1 1 -50 10 3  o 108.9171 8.021253 166.8095  54.4  -39.68976      16.04251 0.97 
1 1 1 -50 10 4  o 37.99164 14.73096 42.00079  309.7 ?              ?        0.51 
1 1 1 -50 10 5  o 96.76271 6.508155 147.6289  212.5 3.253975       13.01631 0.96 
1 1 1 -50 10 6  o 26.01963 8.645345 29.24101  255.4 -3.150089      17.29069 0.30 
1 1 1 -50 10 7  o 79.99318 6.761683 121.0091  345.9 -1.796242      13.52337 0.94 
1 1 1 -50 10 8  o 75.78294 8.183714 68.75861  129.6 21.77268       16.36743 0.87 
1 1 1 -50 10 9  f 49.74522 9.684710 60.58090  10.7  -42.68259      19.36942 0.00 
1 1 1 -50 10 10 o 49.73455 9.757766 78.56157  122.5 29.88314       19.51553 0.82 
1 1 1 -50 10 11 f 147.5798 4.554844 184.3840  141.8 -18.45406      9.109688 0.00 
1 1 1 -50 10 12 o 104.9268 6.588597 178.8037  92.9  13.20434       13.17719 0.97 
1 1 1 -50 10 13 o 120.2979 5.496661 152.2219  118.6 11.09119       10.99332 0.97 
1 1 1 -50 10 14 o 52.69654 9.529312 49.29046  246.6 32.13706       19.05862 0.76 
1 1 1 -50 10 15 f 64.39561 9.284962 140.1034  36.2  -33.54472      18.56992 0.00 
1 1 1 -50 10 16 o 31.12676 9.902252 95.73672  301.4 -7.830149      19.80450 0.81 
1 1 1 -50 10 17 o 42.47596 10.53740 114.4252  263.9 8.642590       21.07479 0.90 
1 1 1 -50 10 18 o 108.8303 5.949536 146.7740  1.0   -8.807419      11.89907 0.98 
1 1 1 -50 10 19 o 88.93567 9.116010 160.1651  348.2 -35.21621      18.23202 0.97 
1 1 1 -50 10 20 o 75.79224 8.592441 139.5393  195.6 27.14920       17.18488 0.96 
1 1 1 -50 10 21 o 29.03220 9.357793 63.74886  273.7 -1.102856      18.71559 0.75 
1 1 1 -50 10 22 o 50.65099 10.60046 124.6197  3.2   -20.42461      21.20093 0.93 
1 1 1 -50 10 23 o 53.18190 10.04902 70.25775  25.4  43.48303       20.09803 0.89 
1 1 1 -50 10 24 o 32.08311 10.02872 16.16816  229.8 6.245920       20.05744 0.34 
1 1 1 -50 10 25 o 49.21992 10.39905 102.0323  14.6  ?              ?        0.93 
1 1 1 -50 12 1  o 44.85202 11.03440 74.11533  157.4 -18.89684      22.06879 0.87 
1 1 1 -50 12 2  o 77.73778 9.141489 125.8074  300.8 23.73020       18.28298 0.96 
1 1 1 -50 12 3  o 75.02132 10.02039 139.3822  329.6 0.3160858      20.04078 0.96 
1 1 1 -50 12 4  o 48.37606 11.02359 101.8540  66.6  26.15118       22.04717 0.91 
1 1 1 -50 12 5  o 48.30908 11.25088 91.90915  110.7 6.047665       22.50176 0.90 
1 1 1 -50 12 6  o 62.93364 10.83367 118.7385  352.5 -15.48450      21.66734 0.94 
1 1 1 -50 12 7  o 87.20599 8.371828 74.09784  305.1 -2.807907      16.74366 0.94 
1 1 1 -50 12 8  f 55.09293 11.05346 93.20764  240.4 7.384144       22.10693 0.00 
1 1 1 -50 12 9  o 63.43328 11.30527 95.08798  21.7  -10.89637      22.61055 0.93 
1 1 1 -50 12 10 o 65.49562 9.666551 129.6160  156.0 11.67425       19.33310 0.95 
1 1 1 -50 12 11 o 116.2639 6.669552 200.5616  211.0 -25.36073      13.33910 0.99 
1 1 1 -50 12 12 o 70.84174 10.54716 109.9507  319.9 22.80731       21.09431 0.95 
1 1 1 -50 12 13 o 42.39835 10.12562 128.3152  56.8  18.32710       20.25123 0.92 
1 1 1 -50 12 14 o 40.75628 11.06881 105.8781  123.6 13.29539       22.13763 0.90 
1 1 1 -50 12 15 o 44.22736 10.26743 63.13813  192.6 20.70760       20.53486 0.85 
1 1 1 -50 12 16 o 48.17503 12.82834 108.0161  139.9 -16.53518      25.65667 0.91 
1 1 1 -50 12 17 o 47.66017 11.57784 90.50533  240.8 5.399303       23.15568 0.90 
1 1 1 -50 12 18 o 43.34558 11.29237 84.08443  357.6 ?              ?        0.89 
1 1 1 -50 12 19 o 45.97306 11.81255 38.63988  338.7 ?              ?        0.75 
1 1 1 -50 12 20 o 41.26719 11.51091 72.10474  248.9 ?              ?        0.87 
1 1 1 -49 1  1  o 101.7823 4.877182 202.9542  79.7  -21.39986      9.754364 0.94 
1 1 1 -49 1  2  o 80.61174 6.118845 137.8251  61.7  38.31176       12.23769 0.89 
1 1 1 -49 1  3  o 130.3594 3.962464 221.9121  258.2 2.711868       7.924927 0.96 
1 1 1 -49 1  4  o 87.29243 6.241935 107.5546  348.8 33.55354       12.48387 0.84 
1 1 1 -49 1  5  o 222.1808 3.512633 286.2794  100.3 -24.83116      7.025266 0.98 
1 1 1 -49 1  6  o 74.60799 7.868340 142.6869  126.7 -10.46327      15.73668 0.86 
1 1 1 -49 1  7  o 336.1466 4.330837 434.1164  237.0 -10.57526      8.661674 0.99 
1 1 1 -49 1  8  o 161.2291 4.587664 224.3365  274.6 -40.20665      9.175327 0.96 
1 1 1 -49 1  9  o 123.2475 5.291176 232.0046  32.7  13.31579       10.58235 0.95 
1 1 1 -49 1  10 o 85.18361 7.174417 119.2704  302.4 9.731110       14.34883 0.84 
1 1 1 -49 1  11 o 165.5954 4.330486 216.3415  125.7 -17.12595      8.660973 0.96 
1 1 1 -49 1  12 o 121.6131 5.485230 196.3538  239.0 -58.80273      10.97046 0.94 
1 1 1 -49 1  13 o 122.0287 5.748526 209.5699  328.7 22.97668       11.49705 0.95 
1 1 1 -49 1  14 o 192.7798 4.134489 292.1644  323.9 30.64163       8.268978 0.98 
1 1 1 -49 1  15 o 264.1389 4.119113 339.0816  30.9  4.845978       8.238226 0.99 
1 1 1 -49 1  16 o 168.6249 4.863877 244.9576  128.9 -28.60469      9.727754 0.97 
1 1 1 -49 1  17 o 226.4352 4.080016 323.7624  193.7 -23.11565      8.160032 0.99 
1 1 1 -49 1  18 o 109.7563 5.072079 156.9067  329.2 -1.469261      10.14416 0.94 
1 1 1 -49 1  19 o 129.6033 4.708767 192.6404  340.5 -1.834457      9.417535 0.96 
1 1 1 -49 1  20 o 103.8461 5.098403 99.46803  269.8 21.32095       10.19681 0.92 
1 1 1 -49 1  21 o 33.97010 9.869569 64.69675  25.1  1.029953       19.73914 0.58 
1 1 1 -49 1  22 o 201.9168 3.503851 316.2977  15.8  5.522232       7.007703 0.99 
1 1 1 -49 1  23 o 61.92439 8.499691 47.35960  183.8 21.56672       16.99938 0.71 
1 1 1 -49 1  24 o 59.08306 8.376428 40.36816  165.7 8.074268       16.75286 0.58 
1 1 1 -49 1  25 o 112.5638 6.349334 133.6793  354.4 -14.34563      12.69867 0.94 
1 1 1 -49 1  26 o 88.98293 6.473979 102.1861  110.6 -1.728668      12.94796 0.91 
1 1 1 -49 1  27 f 124.1781 4.651364 226.0091  53.3  -1.902634      9.302729 0.00 
1 1 1 -49 1  28 o 53.82341 11.74339 73.66108  333.4 -23.82855      23.48677 0.81 
1 1 1 -49 1  29 o 62.89341 8.981554 111.8361  109.3 17.80384       17.96311 0.92 
1 1 1 -49 1  30 o 69.58350 10.45354 28.87918  298.2 27.39302       20.90708 0.73 
1 1 1 -49 1  31 o 40.01091 10.57130 44.78380  259.9 9.530495       21.14261 0.71 
1 1 1 -49 1  32 o 56.90386 10.78424 85.21982  67.3  -22.55310      21.56847 0.91 
1 1 1 -49 1  33 o 49.52713 12.22923 75.93710  348.5 -10.77826      24.45846 0.88 
1 1 1 -49 1  34 o 65.14537 11.00150 74.78759  352.1 ?              ?        0.92 
1 1 1 -49 3  1  o 275.8386 3.225865 341.1851  304.7 -14.32025      6.451729 0.99 
1 1 1 -49 3  2  o 78.63905 5.685523 61.44804  177.6 40.35162       11.37105 0.74 
1 1 1 -49 3  3  o 51.59958 8.258289 91.01537  345.0 -35.41255      16.51658 0.71 
1 1 1 -49 3  4  o 73.59537 7.143657 80.58148  120.1 44.85457       14.28731 0.78 
1 1 1 -49 3  5  o 164.3749 4.015387 235.9647  19.6  -13.20166      8.030774 0.97 
1 1 1 -49 3  6  o 109.1878 5.130010 200.7760  174.0 6.946877       10.26002 0.95 
1 1 1 -49 3  7  o 197.1738 3.632675 334.6008  48.9  -9.476761      7.265350 0.98 
1 1 1 -49 3  8  o 97.55992 5.373657 104.1035  346.6 -18.56461      10.74731 0.87 
1 1 1 -49 3  9  o 185.5490 3.867432 276.6039  103.0 -21.24948      7.734864 0.98 
1 1 1 -49 3  10 o 148.0183 4.755826 228.2289  26.9  18.07758       9.511653 0.97 
1 1 1 -49 3  11 o 114.6461 5.424803 220.1192  27.0  3.878700       10.84961 0.95 
1 1 1 -49 3  12 o 185.7390 4.320476 249.7189  177.6 50.03725       8.640951 0.98 
1 1 1 -49 3  13 o 60.76217 9.320475 44.78633  233.5 0.8326492      18.64095 0.53 
1 1 1 -49 3  14 o 56.72355 9.337171 132.2976  19.0  15.53555       18.67434 0.84 
1 1 1 -49 3  15 o 79.81760 7.102304 69.29619  256.3 -2.539284      14.20461 0.79 
1 1 1 -49 3  16 o 133.3596 4.678005 227.1913  79.1  -12.53748      9.356009 0.97 
1 1 1 -49 3  17 o 66.59231 8.046871 128.7634  26.8  15.15358       16.09374 0.88 
1 1 1 -49 3  18 o 55.72799 9.109759 101.6806  207.1 20.27958       18.21952 0.81 
1 1 1 -49 3  19 o 121.7991 4.865451 199.6080  20.4  -17.20292      9.730902 0.97 
1 1 1 -49 3  20 o 180.4772 4.068180 200.1620  213.3 -10.12729      8.136359 0.98 
1 1 1 -49 3  21 o 198.6280 3.775871 291.6614  218.5 1.183502       7.551742 0.99 
1 1 1 -49 3  22 o 51.52022 9.296911 50.77882  222.3 -14.98915      18.59382 0.67 
1 1 1 -49 3  23 o 84.53581 9.227773 132.8865  342.1 8.607208       18.45555 0.92 
1 1 1 -49 3  24 o 53.76692 9.184514 101.5777  200.4 -7.068359      18.36903 0.82 
1 1 1 -49 3  25 f 145.0110 4.350836 206.0819  99.3  -32.32899      8.701673 0.00 
1 1 1 -49 3  26 o 112.8750 4.786182 119.3362  304.9 20.44717       9.572364 0.95 
1 1 1 -49 3  27 o 192.6871 4.093814 222.5726  301.7 14.73306       8.187629 0.99 
1 1 1 -49 3  28 o 148.9988 5.179110 142.1226  64.2  -15.19028      10.35822 0.98 
1 1 1 -49 3  29 o 87.33140 6.574240 138.3485  66.9  -8.764282      13.14848 0.96 
1 1 1 -49 3  30 o 77.84026 8.612714 136.3470  128.9 -12.24812      17.22543 0.96 
1 1 1 -49 3  31 o 45.34770 10.86667 51.50051  230.5 17.27628       21.73334 0.79 
1 1 1 -49 3  32 o 85.62602 8.501197 108.0445  313.4 39.87510       17.00239 0.96 
1 1 1 -49 3  33 o 48.93867 11.10648 25.08824  240.4 ?              ?        0.63 
1 1 1 -49 5  1  o 94.92084 5.547540 132.3292  271.1 19.56902       11.09508 0.93 
1 1 1 -49 5  2  o 169.2936 3.884611 235.5957  301.0 31.16577       7.769221 0.98 
1 1 1 -49 5  3  o 135.4734 4.695758 236.2494  201.3 25.35876       9.391516 0.97 
1 1 1 -49 5  4  o 49.83346 9.295924 75.50198  178.6 21.41186       18.59185 0.67 
1 1 1 -49 5  5  o 88.11775 5.693987 131.9725  173.4 -11.35301      11.38797 0.91 
1 1 1 -49 5  6  f 183.8810 3.829476 341.6866  8.5   -21.17264      7.658951 0.00 
1 1 1 -49 5  7  o 211.5539 3.436046 305.2068  19.0  -25.14970      6.872091 0.98 
1 1 1 -49 5  8  o 37.08536 9.884840 79.66837  93.4  -5.967243      19.76968 0.58 
1 1 1 -49 5  9  o 140.0984 4.242853 240.8698  357.9 0.2674866E-01  8.485705 0.97 
1 1 1 -49 5  10 o 99.57670 5.563005 159.7633  55.1  -9.844986      11.12601 0.94 
1 1 1 -49 5  11 o 345.7752 4.099899 458.6863  156.4 25.02219       8.199799 0.99 
1 1 1 -49 5  12 o 212.1182 4.298272 331.7868  193.0 12.07152       8.596544 0.99 
1 1 1 -49 5  13 o 133.5220 4.658738 200.3624  101.4 -16.88664      9.317476 0.96 
1 1 1 -49 5  14 o 125.8429 5.685020 177.8492  119.6 32.27118       11.37004 0.96 
1 1 1 -49 5  15 o 153.8023 4.857036 225.2882  146.0 9.450806       9.714072 0.98 
1 1 1 -49 5  16 o 138.8801 5.091557 172.0983  124.0 2.458328       10.18311 0.97 
1 1 1 -49 5  17 o 81.64828 11.34766 144.4392  118.6 24.05692       22.69532 0.93 
1 1 1 -49 5  18 o 69.04659 8.769135 98.92523  129.5 16.40857       17.53827 0.90 
1 1 1 -49 5  19 o 36.90598 10.20591 67.31923  177.4 -16.17823      20.41182 0.68 
1 1 1 -49 5  20 o 120.4998 4.610201 165.0959  76.5  27.91880       9.220402 0.96 
1 1 1 -49 5  21 o 89.26753 6.361956 147.1301  48.8  35.42735       12.72391 0.94 
1 1 1 -49 5  22 o 95.09689 5.474830 160.5090  11.9  -34.23495      10.94966 0.94 
1 1 1 -49 5  23 o 152.5744 4.820448 243.7183  59.3  14.55133       9.640897 0.98 
1 1 1 -49 5  24 o 62.51620 8.234986 72.63210  319.3 7.802723       16.46997 0.81 
1 1 1 -49 5  25 o 123.6492 4.601169 163.9261  358.6 7.367729       9.202338 0.97 
1 1 1 -49 5  26 o 72.75049 9.374680 108.9641  305.8 -22.42012      18.74936 0.92 
1 1 1 -49 5  27 o 136.3294 5.098125 205.2817  237.4 -1.510910      10.19625 0.98 
1 1 1 -49 5  28 o 32.19212 9.435976 33.08886  116.4 -14.95089      18.87195 0.53 
1 1 1 -49 5  29 o 82.35503 9.104287 172.4913  39.5  -26.70197      18.20857 0.97 
1 1 1 -49 5  30 o 37.40871 10.14093 61.62835  191.3 -12.59062      20.28185 0.79 
1 1 1 -49 5  31 o 51.01288 10.27407 81.19376  300.6 -22.55450      20.54813 0.90 
1 1 1 -49 5  32 o 57.15937 11.21135 108.8477  289.7 ?              ?        0.94 
1 1 1 -49 7  1  o 60.43941 9.760877 77.55240  53.8  7.943745       19.52175 0.80 
1 1 1 -49 7  2  f 142.2864 4.119245 204.7411  278.4 0.3645325E-01  8.238489 0.00 
1 1 1 -49 7  3  f 114.5084 5.081083 150.5653  312.6 -20.41400      10.16217 0.00 
1 1 1 -49 7  4  o 136.8374 4.363979 128.4074  130.0 -13.25325      8.727959 0.96 
1 1 1 -49 7  5  o 103.5620 5.282513 140.1237  156.5 4.201469       10.56503 0.96 
1 1 1 -49 7  6  o 84.46928 6.527681 112.3168  16.7  24.21850       13.05536 0.93 
1 1 1 -49 7  7  o 99.17267 6.826368 135.1967  64.4  -10.66022      13.65274 0.95 
1 1 1 -49 7  8  o 57.18462 9.728921 127.3418  351.7 -0.2819977     19.45784 0.90 
1 1 1 -49 7  9  o 198.8617 3.718126 336.5474  327.3 -1.060898      7.436251 0.99 
1 1 1 -49 7  10 o 114.8928 5.252054 170.4528  37.7  11.07350       10.50411 0.97 
1 1 1 -49 7  11 o 180.5159 4.825082 259.3258  75.5  -3.824249      9.650164 0.99 
1 1 1 -49 7  12 o 174.5099 4.228848 291.6534  22.5  11.46629       8.457696 0.99 
1 1 1 -49 7  13 o 151.6984 4.346029 243.4016  327.1 7.877884       8.692058 0.98 
1 1 1 -49 7  14 o 101.8041 5.900965 206.4265  273.6 -2.468262      11.80193 0.97 
1 1 1 -49 7  15 o 199.3829 3.980218 268.1109  329.9 12.31230       7.960436 0.99 
1 1 1 -49 7  16 o 147.0131 4.792609 256.3332  265.0 -19.21875      9.585217 0.98 
1 1 1 -49 7  17 o 77.78928 7.860600 114.0666  218.3 -11.80621      15.72120 0.90 
1 1 1 -49 7  18 o 33.39573 9.820345 58.42535  316.7 7.596470       19.64069 0.48 
1 1 1 -49 7  19 o 42.17089 10.38301 88.25646  266.8 -7.352726      20.76601 0.72 
1 1 1 -49 7  20 o 43.19786 10.67431 48.61079  293.4 -4.035683      21.34863 0.54 
1 1 1 -49 7  21 o 89.04441 6.407898 152.7422  291.0 -4.128265      12.81580 0.95 
1 1 1 -49 7  22 o 122.1018 5.018896 169.4267  270.9 8.592758       10.03779 0.97 
1 1 1 -49 7  23 o 48.32515 10.41022 53.34318  246.6 -7.298088      20.82044 0.71 
1 1 1 -49 7  24 o 81.35127 7.551216 145.1889  193.4 -15.60778      15.10243 0.96 
1 1 1 -49 7  25 o 101.3612 6.428612 135.3450  102.8 -17.60658      12.85722 0.97 
1 1 1 -49 7  26 o 43.15000 10.63782 59.24191  86.8  7.189766       21.27565 0.81 
1 1 1 -49 7  27 o 83.29759 7.632562 134.5441  152.4 15.52231       15.26512 0.97 
1 1 1 -49 7  28 o 27.74649 9.204761 24.91837  357.7 6.821968       18.40952 0.40 
1 1 1 -49 7  29 o 38.28395 10.63602 57.44601  169.4 -3.378532      21.27204 0.80 
1 1 1 -49 7  30 o 73.67391 8.971623 101.9759  169.5 ?              ?        0.95 
1 1 1 -49 9  1  o 123.5410 7.576324 149.1741  202.6 -12.97980      15.15265 0.96 
1 1 1 -49 9  2  o 87.84460 10.18066 96.56022  293.8 32.22318       20.36131 0.90 
1 1 1 -49 9  3  o 178.1647 4.237211 267.6488  22.3  -1.218338      8.474422 0.98 
1 1 1 -49 9  4  o 36.00122 10.28425 85.39619  25.4  -7.001183      20.56849 0.67 
1 1 1 -49 9  5  o 37.80669 10.60764 15.13284  143.7 11.64118       21.21527 0.17 
1 1 1 -49 9  6  o 143.7617 5.817884 214.3344  341.8 -0.3506012     11.63577 0.97 
1 1 1 -49 9  7  o 52.75009 7.915348 117.7441  286.0 50.69452       15.83070 0.85 
1 1 1 -49 9  8  o 156.5473 4.410504 241.6282  181.8 5.087280       8.821008 0.98 
1 1 1 -49 9  9  o 44.95126 10.22581 104.7624  179.4 3.050461       20.45162 0.79 
1 1 1 -49 9  10 o 111.9106 5.198996 224.9798  139.0 -4.918777      10.39799 0.97 
1 1 1 -49 9  11 o 146.7876 4.626545 187.7617  143.6 5.679810       9.253090 0.97 
1 1 1 -49 9  12 o 34.55451 10.22087 52.44785  163.8 -2.674053      20.44173 0.48 
1 1 1 -49 9  13 o 137.5845 4.835248 141.9420  245.1 4.309357       9.670495 0.96 
1 1 1 -49 9  14 o 133.0971 5.117336 177.7978  282.1 -1.224655      10.23467 0.97 
1 1 1 -49 9  15 o 110.0492 5.777779 191.7950  2.6   -20.05663      11.55556 0.97 
1 1 1 -49 9  16 o 253.9980 3.948329 313.4440  52.3  -13.65230      7.896658 0.99 
1 1 1 -49 9  17 o 116.6242 5.849795 190.7290  84.3  -10.50803      11.69959 0.97 
1 1 1 -49 9  18 o 180.6538 4.032562 243.4871  6.3   19.67435       8.065124 0.99 
1 1 1 -49 9  19 o 110.3394 5.926712 151.1806  350.9 -4.597610      11.85342 0.97 
1 1 1 -49 9  20 o 55.06273 10.77069 88.01073  166.9 27.72459       21.54137 0.88 
1 1 1 -49 9  21 o 124.8508 5.652420 166.3929  205.5 -30.20361      11.30484 0.98 
1 1 1 -49 9  22 o 41.45161 10.74202 54.95709  224.8 -6.088932      21.48404 0.78 
1 1 1 -49 9  23 o 36.83539 10.54284 64.19997  87.3  -3.787067      21.08568 0.80 
1 1 1 -49 9  24 o 49.51651 10.43363 61.63252  343.5 12.11565       20.86725 0.85 
1 1 1 -49 9  25 o 85.43024 7.798723 178.1850  310.5 6.965347       15.59745 0.98 
1 1 1 -49 9  26 o 27.10626 9.018920 12.95121  337.6 7.900236       18.03784 0.24 
1 1 1 -49 9  27 o 60.20803 9.907858 88.01118  113.1 ?              ?        0.93 
1 1 1 -49 9  28 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -49 11 1  o 28.81154 9.376842 35.91764  98.1  15.90978       18.75368 0.54 
1 1 1 -49 11 2  o 53.78947 11.25460 72.12022  214.8 -5.579041      22.50919 0.87 
1 1 1 -49 11 3  f 43.17860 11.55809 75.12981  193.2 -6.233116      23.11618 0.00 
1 1 1 -49 11 4  o 34.24173 10.55412 42.45361  33.0  -4.049675      21.10825 0.60 
1 1 1 -49 11 5  o 36.17113 10.29768 55.61269  253.5 15.32263       20.59536 0.71 
1 1 1 -49 11 6  o 131.7797 6.163702 201.4050  295.6 -4.685211      12.32740 0.98 
1 1 1 -49 11 7  o 142.8747 4.815104 232.6831  312.2 10.43076       9.630208 0.99 
1 1 1 -49 11 8  o 95.32860 6.851986 195.9582  213.1 -10.20773      13.70397 0.98 
1 1 1 -49 11 9  o 36.53175 9.771404 84.34057  214.2 12.57799       19.54281 0.82 
1 1 1 -49 11 10 o 144.2156 4.873318 218.4465  354.4 31.26767       9.746636 0.99 
1 1 1 -49 11 11 o 155.1242 5.211216 223.1628  323.9 -6.662354      10.42243 0.99 
1 1 1 -49 11 12 o 112.2352 6.331887 188.2575  333.3 20.53534       12.66377 0.98 
1 1 1 -49 11 13 o 90.92508 7.514340 134.9691  4.4   5.097969       15.02868 0.97 
1 1 1 -49 11 14 o 66.33119 9.731988 127.3504  28.2  31.32223       19.46398 0.95 
1 1 1 -49 11 15 o 61.41184 10.36857 116.9916  58.3  -3.764973      20.73715 0.94 
1 1 1 -49 11 16 o 56.89553 10.85539 116.5800  313.6 -22.86465      21.71077 0.94 
1 1 1 -49 11 17 o 81.08708 8.681213 141.5171  240.7 12.39400       17.36243 0.97 
1 1 1 -49 11 18 o 39.83746 10.74091 76.80824  101.2 18.41379       21.48182 0.85 
1 1 1 -49 11 19 o 51.28690 9.753616 98.88907  351.0 -38.49578      19.50723 0.92 
1 1 1 -49 11 20 o 31.80143 9.997513 6.237683  209.1 2.396273       19.99503 0.13 
1 1 1 -49 11 21 o 28.21447 9.330232 63.34130  86.0  0.5852089      18.66046 0.76 
1 1 1 -49 11 22 o 52.20984 11.53782 101.6694  66.5  17.09385       23.07565 0.92 
1 1 1 -49 11 23 o 28.62309 9.349963 38.59143  81.5  ?              ?        0.64 
1 1 1 -49 11 24 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -49 13 1  o 45.08067 11.92056 79.85219  66.7  ?              ?        0.89 
1 1 1 -49 13 2  o 29.78011 9.298247 16.42389  287.9 ?              ?        0.35 
1 1 1 -49 13 3  o 34.05291 10.61322 19.60175  350.6 ?              ?        0.42 
1 1 1 -49 13 4  o 109.9455 7.348502 164.0987  20.4  ?              ?        0.98 
1 1 1 -49 13 5  o 41.16278 11.24364 65.78442  350.3 -7.860298      22.48729 0.84 
1 1 1 -49 13 6  o 65.39465 11.14807 108.3447  13.6  -33.26294      22.29613 0.94 
1 1 1 -49 13 7  o 54.80619 11.52241 74.86587  319.3 -7.232780      23.04482 0.90 
1 1 1 -49 13 8  o 65.69370 10.43745 122.0919  232.0 -4.516403      20.87490 0.95 
1 1 1 -49 13 9  o 75.95911 11.28693 117.6242  106.9 2.154877       22.57386 0.96 
1 1 1 -49 13 10 o 42.99392 11.29636 65.92017  116.5 -28.12450      22.59271 0.85 
1 1 1 -49 13 11 o 45.54113 12.25137 63.44913  173.2 11.34288       24.50274 0.84 
1 1 1 -49 13 12 o 44.58112 10.81151 58.03783  198.7 -34.67027      21.62302 0.84 
1 1 1 -49 13 13 o 28.03696 9.287224 49.50608  153.2 ?              ?        0.71 
1 1 1 -49 13 14 o 56.80579 11.72087 81.14306  246.1 ?              ?        0.91 
1 1 1 -49 13 15 o 65.03992 12.29338 108.0484  285.8 ?              ?        0.94 
1 1 1 -49 13 16 o 48.39515 11.88863 60.08413  263.7 ?              ?        0.86 
1 1 1 -49 13 17 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -48 0  1  o 98.30045 7.132795 154.3199  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  2  o 51.40203 14.59707 30.37674  0.0   -0.000000      0.000000 0.26 
1 1 1 -48 0  3  o 127.0732 5.977842 138.6327  360.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  4  o 500.0176 6.281469 604.4756  0.0   -0.000000      0.000000 1.00 
1 1 1 -48 0  5  o 222.9454 5.753383 374.0560  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  6  o 647.8542 9.312613 800.8167  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  7  o 58.07001 15.09635 58.86315  360.0 -0.000000      0.000000 0.47 
1 1 1 -48 0  8  o 218.3404 5.957342 243.7126  360.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  9  o 33.85134 17.11099 9.983373  360.0 -0.000000      0.000000 0.01 
1 1 1 -48 0  10 o 93.77895 8.873097 117.8581  180.0 -0.000000      0.000000 0.96 
1 1 1 -48 0  11 o 147.1417 6.311654 192.3602  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  12 o 27.33433 16.77331 92.83514  0.0   -0.000000      0.000000 0.37 
1 1 1 -48 0  13 o 198.8368 5.961207 300.8253  360.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  14 o 35.57006 18.56420 50.30345  180.0 -0.000000      0.000000 0.29 
1 1 1 -48 0  15 o 20.87213 13.77821 112.7967  180.0 -0.000000      0.000000 0.44 
1 1 1 -48 0  16 o 143.0993 6.681848 227.3906  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  17 o 196.4960 5.486543 350.1432  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  18 o 17.73695 12.19235 16.21001  180.0 -0.000000      0.000000 0.07 
1 1 1 -48 0  19 o 21.43189 14.31692 3.971557  360.0 -0.000000      0.000000 0.02 
1 1 1 -48 0  20 o 50.80140 15.11126 98.05596  180.0 -0.000000      0.000000 0.85 
1 1 1 -48 0  21 o 95.25732 7.370067 177.1358  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  22 o 29.05611 15.89139 29.66549  180.0 -0.000000      0.000000 0.27 
1 1 1 -48 0  23 o 64.13434 12.40378 96.57809  180.0 -0.000000      0.000000 0.99 
1 1 1 -48 0  24 o 78.12041 9.573416 41.85917  180.0 -0.000000      0.000000 0.81 
1 1 1 -48 0  25 o 59.05325 13.31700 141.6111  360.0 -0.000000      0.000000 0.98 
1 1 1 -48 0  26 o 32.00216 15.74629 19.69178  0.0   -0.000000      0.000000 0.18 
1 1 1 -48 0  27 o 26.12655 15.73783 17.31096  180.0 -0.000000      0.000000 0.14 
1 1 1 -48 0  28 o 29.67814 16.36240 68.91367  360.0 -0.000000      0.000000 0.61 
1 1 1 -48 0  29 o 48.86912 19.35271 133.3551  180.0 -0.000000      0.000000 0.99 
1 1 1 -48 0  30 o 48.70713 18.77469 105.3808  180.0 -0.000000      0.000000 0.98 
1 1 1 -48 0  31 o 33.25501 18.39318 35.67996  360.0 -0.000000      0.000000 0.56 
1 1 1 -48 0  32 o 27.83726 16.89021 67.97665  180.0 -0.000000      0.000000 0.78 
1 1 1 -48 0  33 o 65.17327 16.43336 125.4602  180.0 -0.000000      0.000000 1.00 
1 1 1 -48 0  34 o 56.30261 16.89087 145.5351  360.0 ?              ?        1.00 
1 1 1 -48 2  1  o 45.04955 8.868051 93.73670  182.4 -7.644951      17.73610 0.66 
1 1 1 -48 2  2  f 251.4196 3.404814 317.2170  102.4 51.59618       6.809628 0.00 
1 1 1 -48 2  3  o 85.21055 6.560467 118.1967  46.9  36.88092       13.12093 0.86 
1 1 1 -48 2  4  o 73.26512 7.120874 146.9244  304.7 -8.659554      14.24175 0.85 
1 1 1 -48 2  5  o 107.3932 5.267008 72.78852  220.0 10.65549       10.53402 0.77 
1 1 1 -48 2  6  o 203.9022 3.606387 170.2017  110.9 15.25331       7.212773 0.96 
1 1 1 -48 2  7  o 160.0916 4.271032 210.9756  268.9 -16.85262      8.542065 0.95 
1 1 1 -48 2  8  o 98.47758 5.946278 153.7889  0.9   -39.87198      11.89256 0.89 
1 1 1 -48 2  9  o 110.8010 5.716364 129.2698  37.2  -13.73782      11.43273 0.89 
1 1 1 -48 2  10 o 271.7703 4.236261 311.6192  254.2 -9.738068      8.472523 0.98 
1 1 1 -48 2  11 o 104.9946 6.192959 124.8487  164.3 -10.65816      12.38592 0.88 
1 1 1 -48 2  12 o 48.46114 10.21742 38.39305  60.3  -6.732910      20.43484 0.31 
1 1 1 -48 2  13 o 126.7929 5.086998 150.3917  321.4 -2.495308      10.17400 0.93 
1 1 1 -48 2  14 o 193.0976 3.904158 208.0296  271.5 -23.80013      7.808316 0.97 
1 1 1 -48 2  15 o 89.25992 6.293406 179.2156  40.7  -1.431908      12.58681 0.93 
1 1 1 -48 2  16 o 75.60622 7.377738 105.1170  57.4  22.55310       14.75548 0.85 
1 1 1 -48 2  17 o 42.56187 10.19925 78.60505  18.0  4.011005       20.39850 0.61 
1 1 1 -48 2  18 o 31.73180 8.734251 8.236160  58.0  -26.10918      17.46850 0.06 
1 1 1 -48 2  19 o 236.5710 3.616891 280.4326  10.3  7.293869       7.233783 0.99 
1 1 1 -48 2  20 o 39.60234 9.086164 47.99220  34.9  14.98783       18.17233 0.47 
1 1 1 -48 2  21 o 58.13070 8.519338 66.52961  137.4 19.79979       17.03868 0.76 
1 1 1 -48 2  22 o 171.5323 4.261567 235.0816  318.6 50.90067       8.523134 0.98 
1 1 1 -48 2  23 o 148.9553 4.106944 278.9396  249.6 -17.03018      8.213888 0.98 
1 1 1 -48 2  24 o 79.55579 6.083162 128.0978  74.4  -16.60413      12.16632 0.92 
1 1 1 -48 2  25 o 215.4605 3.851817 319.4213  44.7  11.75888       7.703635 0.99 
1 1 1 -48 2  26 o 56.57523 9.348764 94.47581  221.3 -35.94589      18.69753 0.83 
1 1 1 -48 2  27 o 90.14059 6.355992 126.3412  312.2 10.74294       12.71198 0.93 
1 1 1 -48 2  28 o 121.0819 5.480629 160.5222  356.9 -25.13470      10.96126 0.97 
1 1 1 -48 2  29 o 72.33372 9.549880 117.9515  196.7 -23.95045      19.09976 0.94 
1 1 1 -48 2  30 o 57.80049 9.560832 65.42197  152.2 31.63663       19.12166 0.87 
1 1 1 -48 2  31 o 44.71736 10.39974 65.71475  193.7 25.81126       20.79948 0.84 
1 1 1 -48 2  32 o 39.96381 10.92658 5.859983  269.0 -8.752758      21.85316 0.13 
1 1 1 -48 2  33 o 50.85217 10.26026 24.92994  341.0 35.42666       20.52051 0.63 
1 1 1 -48 2  34 o 74.39863 9.109561 121.7090  254.8 ?              ?        0.96 
1 1 1 -48 4  1  o 220.0383 3.432485 374.1275  313.0 -22.58691      6.864970 0.99 
1 1 1 -48 4  2  o 32.57464 8.722894 61.09127  345.4 24.75693       17.44579 0.41 
1 1 1 -48 4  3  o 241.4274 3.644689 307.0999  133.6 22.39555       7.289377 0.99 
1 1 1 -48 4  4  o 93.44904 5.824959 172.3154  135.9 1.351433       11.64992 0.93 
1 1 1 -48 4  5  f 75.67102 6.793194 136.4985  348.8 -27.08114      13.58639 0.00 
1 1 1 -48 4  6  o 62.68301 8.126335 74.21152  292.2 -17.15664      16.25267 0.70 
1 1 1 -48 4  7  o 190.3113 3.581538 344.3183  79.7  1.715973       7.163075 0.98 
1 1 1 -48 4  8  o 286.1274 3.566892 508.6267  91.0  -15.81192      7.133783 0.99 
1 1 1 -48 4  9  o 251.1549 3.436675 448.2219  129.7 4.114792       6.873350 0.99 
1 1 1 -48 4  10 o 80.52498 7.399995 82.04334  351.2 -11.81284      14.79999 0.80 
1 1 1 -48 4  11 o 52.24621 11.18831 53.88892  326.4 -7.816463      22.37663 0.52 
1 1 1 -48 4  12 f 64.66622 8.250424 205.9547  222.8 -14.82206      16.50085 0.00 
1 1 1 -48 4  13 o 211.3993 4.231327 364.8015  117.3 9.922699       8.462653 0.99 
1 1 1 -48 4  14 o 138.4707 4.756964 175.2264  70.7  -21.83220      9.513927 0.96 
1 1 1 -48 4  15 o 98.20390 5.819768 148.4429  274.2 39.45712       11.63954 0.93 
1 1 1 -48 4  16 o 113.7039 5.416464 189.9661  287.0 14.69344       10.83293 0.95 
1 1 1 -48 4  17 o 121.9495 5.087816 210.9956  78.9  -4.599289      10.17563 0.96 
1 1 1 -48 4  18 o 125.6927 4.701925 111.5274  125.1 -2.058014      9.403851 0.94 
1 1 1 -48 4  19 o 53.57664 7.715922 91.91975  52.7  -51.08924      15.43184 0.82 
1 1 1 -48 4  20 o 69.62252 10.81315 69.94189  161.0 30.78244       21.62630 0.83 
1 1 1 -48 4  21 o 187.7710 3.978789 291.2843  150.8 27.59369       7.957577 0.99 
1 1 1 -48 4  22 o 90.67932 5.491899 126.3289  157.4 23.62811       10.98380 0.94 
1 1 1 -48 4  23 o 228.8385 4.042192 291.1895  98.4  1.903915       8.084383 0.99 
1 1 1 -48 4  24 o 87.72339 6.019362 102.1423  179.4 29.11419       12.03872 0.90 
1 1 1 -48 4  25 o 132.7653 4.930039 173.6024  118.4 -7.990997      9.860078 0.97 
1 1 1 -48 4  26 o 49.45708 9.467454 53.49639  347.8 -28.01600      18.93491 0.66 
1 1 1 -48 4  27 o 38.10015 9.935256 24.31040  298.5 18.28739       19.87051 0.34 
1 1 1 -48 4  28 o 56.76453 9.723145 56.31299  31.7  27.42427       19.44629 0.81 
1 1 1 -48 4  29 o 91.96074 6.375776 139.5458  39.3  -20.74506      12.75155 0.97 
1 1 1 -48 4  30 o 39.54758 10.07534 26.23574  161.7 -10.84377      20.15067 0.53 
1 1 1 -48 4  31 o 39.94154 10.82790 70.69051  357.6 13.96547       21.65580 0.83 
1 1 1 -48 4  32 o 39.31920 11.44863 105.4266  346.9 18.35530       22.89727 0.89 
1 1 1 -48 4  33 o 65.80350 10.20558 93.34042  344.9 ?              ?        0.94 
1 1 1 -48 6  1  o 133.8327 4.479412 103.4191  170.0 22.11523       8.958824 0.94 
1 1 1 -48 6  2  o 73.66077 7.552227 78.25483  189.5 -22.22414      15.10445 0.84 
1 1 1 -48 6  3  o 86.93689 6.170336 156.3169  189.9 -6.719963      12.34067 0.93 
1 1 1 -48 6  4  o 117.2888 5.180033 166.2902  107.7 -9.213036      10.36007 0.95 
1 1 1 -48 6  5  o 78.29487 6.348172 67.87701  320.2 7.067383       12.69634 0.79 
1 1 1 -48 6  6  o 239.4799 3.685004 338.5139  277.4 7.456360       7.370009 0.99 
1 1 1 -48 6  7  o 150.0644 4.196314 217.5217  156.1 -12.88432      8.392628 0.97 
1 1 1 -48 6  8  o 132.3725 4.978065 220.4525  147.8 -18.53783      9.956129 0.97 
1 1 1 -48 6  9  o 199.9392 3.631266 246.8796  324.1 13.30078       7.262533 0.98 
1 1 1 -48 6  10 o 178.2594 3.921872 275.0138  283.4 6.064484       7.843744 0.98 
1 1 1 -48 6  11 o 169.1561 3.985423 279.3188  244.9 -18.40169      7.970846 0.98 
1 1 1 -48 6  12 o 28.65119 9.064373 113.5987  223.9 -4.431486      18.12875 0.65 
1 1 1 -48 6  13 o 116.4708 4.887318 197.9760  210.5 -10.61666      9.774636 0.96 
1 1 1 -48 6  14 o 137.3236 5.795203 217.8842  234.5 -16.61200      11.59041 0.97 
1 1 1 -48 6  15 f 85.30396 7.379991 142.5428  255.8 -7.512222      14.75998 0.00 
1 1 1 -48 6  16 o 94.80577 7.646653 174.2711  46.7  49.16305       15.29331 0.96 
1 1 1 -48 6  17 o 62.71403 8.786794 79.54977  71.7  6.112026       17.57359 0.86 
1 1 1 -48 6  18 o 37.75121 9.702247 47.55910  100.9 7.963909       19.40449 0.57 
1 1 1 -48 6  19 o 58.21715 9.443830 98.64606  311.8 30.47919       18.88766 0.86 
1 1 1 -48 6  20 o 74.33982 7.550450 130.1445  263.1 -21.95113      15.10090 0.92 
1 1 1 -48 6  21 o 117.7392 4.642416 238.9185  339.5 5.667824       9.284832 0.97 
1 1 1 -48 6  22 o 147.0193 4.518573 240.1747  332.1 14.88806       9.037146 0.98 
1 1 1 -48 6  23 o 59.03956 9.143827 65.82869  77.3  -6.476246      18.28765 0.77 
1 1 1 -48 6  24 o 40.60136 9.722475 69.24224  18.6  -21.29761      19.44495 0.69 
1 1 1 -48 6  25 o 126.1130 5.357877 168.2099  21.7  -7.106415      10.71575 0.97 
1 1 1 -48 6  26 o 161.6417 4.563529 241.1645  296.4 -1.495026      9.127059 0.99 
1 1 1 -48 6  27 o 102.3617 7.101848 154.2464  234.0 -30.68071      14.20370 0.97 
1 1 1 -48 6  28 o 39.84163 10.68332 82.13161  19.2  5.759365       21.36664 0.86 
1 1 1 -48 6  29 o 30.11026 9.630917 30.50455  14.1  2.818640       19.26183 0.49 
1 1 1 -48 6  30 o 67.82142 10.42698 82.72679  258.8 -9.601360      20.85396 0.92 
1 1 1 -48 6  31 o 77.99260 9.475046 138.8764  9.7   ?              ?        0.97 
1 1 1 -48 6  32 o 39.15547 11.08839 67.83562  313.4 ?              ?        0.86 
1 1 1 -48 8  1  o 137.4774 4.753316 152.7063  190.4 -22.74015      9.506633 0.96 
1 1 1 -48 8  2  o 151.7287 4.399730 203.5973  240.5 -12.41847      8.799459 0.97 
1 1 1 -48 8  3  o 186.4097 4.579061 313.9148  4.2   -8.468445      9.158122 0.99 
1 1 1 -48 8  4  o 104.4742 6.589626 153.0402  52.5  16.02473       13.17925 0.95 
1 1 1 -48 8  5  o 36.70065 9.916705 41.29254  13.8  4.984318       19.83341 0.46 
1 1 1 -48 8  6  o 168.4570 3.822711 283.6675  328.6 -5.045135      7.645422 0.99 
1 1 1 -48 8  7  o 38.24400 7.825895 58.48189  261.6 31.23070       15.65179 0.64 
1 1 1 -48 8  8  o 144.7638 4.844073 170.2180  104.5 -6.744751      9.688146 0.97 
1 1 1 -48 8  9  o 90.79079 6.420717 91.72320  138.7 11.62680       12.84143 0.92 
1 1 1 -48 8  10 o 141.3641 4.532078 231.5677  186.9 6.212418       9.064156 0.98 
1 1 1 -48 8  11 o 73.39558 8.227283 125.3142  299.3 -20.68745      16.45457 0.92 
1 1 1 -48 8  12 o 215.7612 3.745655 317.7735  324.3 3.075592       7.491310 0.99 
1 1 1 -48 8  13 o 106.7022 5.331280 163.2272  271.9 -13.20562      10.66256 0.96 
1 1 1 -48 8  14 o 200.3133 3.959854 323.7883  227.2 -10.47598      7.919708 0.99 
1 1 1 -48 8  15 o 88.31949 7.507727 176.5875  316.8 -48.02161      15.01545 0.95 
1 1 1 -48 8  16 o 229.4671 4.005622 346.6636  310.0 -5.979233      8.011245 0.99 
1 1 1 -48 8  17 o 29.11214 9.098116 54.24022  157.5 2.425201       18.19623 0.42 
1 1 1 -48 8  18 o 40.39101 10.88819 24.60824  304.4 -6.208652      21.77637 0.29 
1 1 1 -48 8  19 o 45.10376 10.74846 83.29948  337.3 -29.91934      21.49692 0.75 
1 1 1 -48 8  20 o 161.7634 4.563381 206.7218  52.4  -17.29132      9.126762 0.98 
1 1 1 -48 8  21 f 23.09552 7.904027 77.94278  225.2 -4.621099      15.80805 0.00 
1 1 1 -48 8  22 o 124.5540 5.224598 213.3399  283.3 -4.878090      10.44920 0.98 
1 1 1 -48 8  23 o 84.95441 6.824850 150.6701  339.4 -3.933464      13.64970 0.96 
1 1 1 -48 8  24 o 71.55780 8.907702 126.3566  220.8 -1.908546      17.81540 0.95 
1 1 1 -48 8  25 o 80.21073 9.292434 122.1966  189.7 0.1438904      18.58487 0.96 
1 1 1 -48 8  26 o 49.86127 9.752100 74.63422  318.2 -15.49994      19.50420 0.89 
1 1 1 -48 8  27 o 44.92377 10.79844 38.28590  255.0 0.3755493      21.59688 0.71 
1 1 1 -48 8  28 o 26.91469 8.684239 44.29379  129.0 -3.345583      17.36848 0.64 
1 1 1 -48 8  29 o 37.82816 10.58864 82.11192  326.4 ?              ?        0.87 
1 1 1 -48 10 1  o 86.98507 8.925842 135.6687  328.5 -14.48900      17.85168 0.95 
1 1 1 -48 10 2  o 66.51055 9.997438 60.43245  226.7 -3.888168      19.99488 0.81 
1 1 1 -48 10 3  o 62.68829 11.51449 60.63602  123.4 -2.252579      23.02897 0.78 
1 1 1 -48 10 4  o 32.25336 9.880729 70.70377  36.0  2.383154       19.76146 0.62 
1 1 1 -48 10 5  o 52.16142 10.05129 42.39511  283.2 -41.29045      20.10258 0.59 
1 1 1 -48 10 6  o 160.4790 4.220950 203.9466  301.7 8.730469       8.441899 0.98 
1 1 1 -48 10 7  o 194.7780 4.293125 254.8677  269.0 -9.165588      8.586249 0.99 
1 1 1 -48 10 8  o 75.88386 8.925727 120.4702  221.9 30.11438       17.85145 0.91 
1 1 1 -48 10 9  o 50.20939 11.12538 63.75954  194.7 -15.61183      22.25077 0.71 
1 1 1 -48 10 10 o 118.7530 5.757434 164.8329  278.1 1.568222       11.51487 0.96 
1 1 1 -48 10 11 o 41.56893 10.50073 57.15971  311.5 7.298512       21.00147 0.62 
1 1 1 -48 10 12 o 122.6286 5.335856 182.6336  72.2  -7.846848      10.67171 0.97 
1 1 1 -48 10 13 o 88.25981 6.989587 113.9891  22.9  31.79474       13.97917 0.93 
1 1 1 -48 10 14 o 43.67667 10.50730 86.34700  352.6 17.24725       21.01460 0.80 
1 1 1 -48 10 15 o 61.08141 9.298221 30.77390  180.5 -30.77567      18.59644 0.61 
1 1 1 -48 10 16 o 29.18393 9.449419 50.15817  313.9 2.204702       18.89884 0.54 
1 1 1 -48 10 17 o 48.47663 10.65904 39.29214  338.3 -34.15978      21.31809 0.65 
1 1 1 -48 10 18 o 53.32231 10.42625 88.92677  63.1  -19.56592      20.85250 0.89 
1 1 1 -48 10 19 o 138.1590 4.825713 210.8103  211.0 23.69349       9.651426 0.99 
1 1 1 -48 10 20 o 114.6604 6.141036 185.7061  212.6 7.898079       12.28207 0.98 
1 1 1 -48 10 21 o 42.00857 10.44941 65.69425  219.8 24.73305       20.89882 0.84 
1 1 1 -48 10 22 o 45.11920 10.82964 110.7940  130.2 -2.951622      21.65928 0.91 
1 1 1 -48 10 23 o 51.91000 10.83092 33.88409  106.3 -8.807976      21.66184 0.72 
1 1 1 -48 10 24 o 43.14678 10.02330 57.36874  136.5 -23.88531      20.04660 0.83 
1 1 1 -48 10 25 o 42.88857 11.27992 100.0519  213.0 4.568275       22.55984 0.91 
1 1 1 -48 10 26 o 33.66235 9.648756 89.60384  184.0 ?              ?        0.88 
1 1 1 -48 12 1  o 36.32545 10.48212 44.93045  57.0  -6.943375      20.96425 0.69 
1 1 1 -48 12 2  o 91.74889 7.088565 133.9514  162.9 7.732079       14.17713 0.97 
1 1 1 -48 12 3  o 33.88694 10.33008 90.76469  231.1 -5.265209      20.66017 0.85 
1 1 1 -48 12 4  o 92.17503 8.067017 163.5622  319.6 -3.684807      16.13403 0.98 
1 1 1 -48 12 5  o 48.06400 11.06150 77.78957  182.2 9.159801       22.12300 0.88 
1 1 1 -48 12 6  o 33.44346 10.36788 71.21785  237.5 -1.938831      20.73576 0.81 
1 1 1 -48 12 7  o 134.4603 5.991243 168.1827  24.5  17.35162       11.98249 0.98 
1 1 1 -48 12 8  o 45.45576 10.74671 97.64423  39.5  -17.66470      21.49343 0.90 
1 1 1 -48 12 9  o 39.90120 10.38141 115.8121  244.4 21.12277       20.76282 0.91 
1 1 1 -48 12 10 o 53.15839 10.60084 22.68666  292.3 5.191410       21.20168 0.60 
1 1 1 -48 12 11 o 38.53159 10.55501 58.42799  201.6 1.637501       21.11002 0.80 
1 1 1 -48 12 12 o 108.4281 7.604196 158.4537  250.9 -14.22952      15.20839 0.98 
1 1 1 -48 12 13 o 104.5049 6.630968 178.4179  303.1 -18.62308      13.26194 0.98 
1 1 1 -48 12 14 o 84.79270 8.383042 96.81231  349.2 12.35156       16.76608 0.95 
1 1 1 -48 12 15 o 44.68158 11.07560 74.02411  278.5 -21.56381      22.15120 0.86 
1 1 1 -48 12 16 o 104.0497 6.584920 178.8820  281.7 -21.80377      13.16984 0.98 
1 1 1 -48 12 17 o 83.37802 8.738138 138.5421  334.6 -12.03358      17.47628 0.97 
1 1 1 -48 12 18 o 88.46609 7.554206 138.6717  61.6  20.32952       15.10841 0.97 
1 1 1 -48 12 19 o 42.53590 11.48298 80.33150  348.1 19.12897       22.96596 0.88 
1 1 1 -48 12 20 o 33.38228 10.12369 26.77221  30.7  ?              ?        0.54 
1 1 1 -48 12 21 o 30.98152 9.373733 44.49575  295.3 ?              ?        0.73 
1 1 1 -47 1  1  o 131.4319 3.939744 193.4389  292.3 -37.59223      7.879489 0.94 
1 1 1 -47 1  2  o 52.08156 9.175066 84.20876  62.1  -10.08067      18.35013 0.57 
1 1 1 -47 1  3  o 208.4498 3.370433 306.7188  147.5 44.07793       6.740867 0.97 
1 1 1 -47 1  4  o 59.35703 8.354793 68.68800  301.3 -51.25012      16.70959 0.49 
1 1 1 -47 1  5  o 84.41554 6.554407 145.6188  325.9 22.37041       13.10881 0.84 
1 1 1 -47 1  6  o 120.6457 5.163381 204.4766  173.6 -22.10892      10.32676 0.92 
1 1 1 -47 1  7  o 97.95305 6.341771 201.9587  230.6 10.41135       12.68354 0.90 
1 1 1 -47 1  8  o 269.6851 3.975021 341.3950  185.3 40.48943       7.950042 0.98 
1 1 1 -47 1  9  o 219.4946 4.050618 243.5663  224.9 16.18163       8.101235 0.97 
1 1 1 -47 1  10 o 69.99969 8.448968 172.9125  346.9 -55.90133      16.89794 0.85 
1 1 1 -47 1  11 o 212.9449 3.980303 268.7734  234.3 23.26218       7.960607 0.97 
1 1 1 -47 1  12 o 50.29694 9.445886 91.43400  258.4 17.78312       18.89177 0.58 
1 1 1 -47 1  13 o 166.9039 3.918724 269.8527  108.6 -3.729599      7.837449 0.97 
1 1 1 -47 1  14 o 181.8046 4.027429 278.6336  84.7  43.19293       8.054858 0.97 
1 1 1 -47 1  15 o 39.50208 10.06707 86.52333  310.1 -14.75677      20.13414 0.51 
1 1 1 -47 1  16 o 80.58517 8.275993 61.84328  259.7 -43.15464      16.55199 0.69 
1 1 1 -47 1  17 o 55.28500 8.268401 59.71796  217.9 6.154667       16.53680 0.58 
1 1 1 -47 1  18 f 331.5989 4.317317 459.9846  194.1 -22.26227      8.634635 0.00 
1 1 1 -47 1  19 o 91.38174 5.545510 127.3142  204.5 -20.72180      11.09102 0.91 
1 1 1 -47 1  20 o 91.62813 5.719010 156.5392  321.9 -14.13859      11.43802 0.93 
1 1 1 -47 1  21 o 24.24964 7.894598 22.33168  189.4 2.177803       15.78920 0.15 
1 1 1 -47 1  22 o 150.7173 3.974292 182.5650  302.0 29.42958       7.948585 0.97 
1 1 1 -47 1  23 o 66.82689 7.498558 139.8732  196.3 -23.88950      14.99712 0.93 
1 1 1 -47 1  24 o 151.6891 3.853618 223.2258  201.5 -17.61374      7.707235 0.98 
1 1 1 -47 1  25 o 94.84042 5.960718 120.5763  177.7 -22.88686      11.92144 0.93 
1 1 1 -47 1  26 o 120.2708 4.797665 148.8498  222.2 -19.17345      9.595329 0.95 
1 1 1 -47 1  27 o 120.3429 4.807564 244.9456  242.7 12.59174       9.615129 0.97 
1 1 1 -47 1  28 o 150.3840 6.361682 189.8492  353.3 37.01816       12.72336 0.98 
1 1 1 -47 1  29 o 50.45947 9.949565 86.29761  215.0 -7.267723      19.89913 0.85 
1 1 1 -47 1  30 o 142.2483 5.361377 193.9803  142.9 -17.97919      10.72275 0.98 
1 1 1 -47 1  31 o 87.64841 7.045043 136.5919  46.6  28.68789       14.09009 0.97 
1 1 1 -47 1  32 o 71.79271 8.982946 79.91805  258.3 4.932274       17.96589 0.93 
1 1 1 -47 1  33 o 99.56581 8.687467 128.4819  189.6 -16.28146      17.37493 0.97 
1 1 1 -47 1  34 o 58.90266 10.76819 87.88764  278.2 ?              ?        0.92 
1 1 1 -47 3  1  f 31.89934 9.545479 84.01639  245.0 -1.089930      19.09096 0.00 
1 1 1 -47 3  2  o 124.7654 4.556744 199.7225  14.9  -4.588715      9.113488 0.95 
1 1 1 -47 3  3  o 156.0968 3.508374 250.1558  120.6 5.496063       7.016748 0.96 
1 1 1 -47 3  4  o 110.6469 4.404387 154.1647  220.9 -12.28750      8.808775 0.91 
1 1 1 -47 3  5  o 202.2395 3.432586 216.3734  187.0 -19.35106      6.865173 0.97 
1 1 1 -47 3  6  o 142.2905 4.289992 123.4761  133.6 -43.82592      8.579985 0.91 
1 1 1 -47 3  7  o 160.7710 3.695342 240.0760  257.4 19.94527       7.390684 0.96 
1 1 1 -47 3  8  o 126.5476 4.326545 313.7398  2.8   3.848198       8.653090 0.96 
1 1 1 -47 3  9  o 66.55109 8.591960 40.22546  225.2 17.35976       17.18392 0.47 
1 1 1 -47 3  10 o 203.3981 4.211939 337.0309  243.4 -1.968903      8.423879 0.98 
1 1 1 -47 3  11 o 113.1293 5.467316 214.9514  236.2 2.793297       10.93463 0.94 
1 1 1 -47 3  12 o 166.8863 4.233137 216.1439  97.9  -0.6658478     8.466274 0.96 
1 1 1 -47 3  13 o 160.2583 4.268761 331.9280  74.2  5.546387       8.537522 0.97 
1 1 1 -47 3  14 o 258.4455 3.939358 330.7503  230.9 9.545624       7.878716 0.99 
1 1 1 -47 3  15 o 162.0819 4.082453 128.8385  244.9 29.24377       8.164907 0.94 
1 1 1 -47 3  16 o 73.65527 8.359250 52.47129  120.2 16.78423       16.71850 0.66 
1 1 1 -47 3  17 o 106.8015 4.857405 178.2819  48.6  -10.90038      9.714809 0.95 
1 1 1 -47 3  18 o 160.7988 4.340856 180.8158  60.1  7.209641       8.681712 0.97 
1 1 1 -47 3  19 o 60.89748 7.803318 38.32844  232.6 15.33868       15.60664 0.52 
1 1 1 -47 3  20 o 47.69585 9.202055 45.26087  52.8  18.02577       18.40411 0.51 
1 1 1 -47 3  21 o 137.3875 4.417585 182.2168  107.2 2.332703       8.835170 0.97 
1 1 1 -47 3  22 o 130.1907 4.157444 136.1655  20.8  31.72108       8.314887 0.96 
1 1 1 -47 3  23 o 73.36034 10.33972 181.4732  315.3 -2.673447      20.67945 0.95 
1 1 1 -47 3  24 o 135.6907 4.218781 212.1934  237.2 1.173370       8.437562 0.97 
1 1 1 -47 3  25 o 53.73281 8.927937 28.80663  84.1  -21.14654      17.85587 0.40 
1 1 1 -47 3  26 o 65.42088 9.124898 71.93720  312.0 -15.90643      18.24980 0.80 
1 1 1 -47 3  27 o 63.42816 8.636356 82.11265  183.4 27.13208       17.27271 0.84 
1 1 1 -47 3  28 o 160.7884 4.366602 190.6027  229.0 5.382126       8.733204 0.98 
1 1 1 -47 3  29 o 94.96198 6.720187 72.38788  193.3 22.96130       13.44037 0.93 
1 1 1 -47 3  30 o 97.99767 6.447907 148.9129  197.9 6.865242       12.89581 0.97 
1 1 1 -47 3  31 o 60.47692 10.27566 90.72152  160.6 15.36975       20.55133 0.92 
1 1 1 -47 3  32 o 53.61842 11.03159 31.64763  99.0  -1.507736      22.06318 0.69 
1 1 1 -47 3  33 o 55.41628 9.352746 80.43057  357.0 -40.13397      18.70549 0.91 
1 1 1 -47 3  34 o 48.42998 10.40257 97.61881  278.9 ?              ?        0.92 
1 1 1 -47 5  1  o 117.3642 4.290814 190.9661  160.7 5.683861       8.581628 0.95 
1 1 1 -47 5  2  o 205.8510 3.680017 286.5469  215.3 -8.201981      7.360033 0.98 
1 1 1 -47 5  3  o 73.32747 6.388247 59.28773  221.4 10.28011       12.77649 0.71 
1 1 1 -47 5  4  f 192.8632 3.614192 198.8257  55.1  -5.571198      7.228383 0.00 
1 1 1 -47 5  5  o 149.7145 4.025558 236.6750  195.2 -9.309845      8.051115 0.97 
1 1 1 -47 5  6  o 129.9996 4.140218 200.7967  242.4 -38.40851      8.280436 0.96 
1 1 1 -47 5  7  o 61.76338 8.161767 108.0930  343.0 9.587482       16.32353 0.81 
1 1 1 -47 5  8  o 31.84720 9.152412 55.57665  359.5 -9.254436      18.30482 0.37 
1 1 1 -47 5  9  o 187.6635 3.602648 285.2142  241.3 10.01105       7.205296 0.98 
1 1 1 -47 5  10 o 46.93961 10.00973 58.13096  231.7 -10.32266      20.01945 0.52 
1 1 1 -47 5  11 o 125.6040 4.527972 198.9185  55.2  20.28437       9.055944 0.96 
1 1 1 -47 5  12 o 104.6187 5.633313 154.9282  313.0 19.82750       11.26663 0.93 
1 1 1 -47 5  13 o 93.45544 6.352892 129.5899  236.2 5.432785       12.70578 0.91 
1 1 1 -47 5  14 f 105.9035 5.482803 224.5483  30.0  -22.06574      10.96561 0.00 
1 1 1 -47 5  15 o 189.3564 4.628907 317.2748  305.6 8.865829       9.257813 0.98 
1 1 1 -47 5  16 o 167.5151 4.337894 224.5052  312.4 17.08504       8.675789 0.98 
1 1 1 -47 5  17 o 80.53613 10.83722 92.47169  126.0 50.70720       21.67445 0.86 
1 1 1 -47 5  18 o 30.73875 9.125291 36.25732  341.5 11.82859       18.25058 0.32 
1 1 1 -47 5  19 o 165.7363 4.121174 299.2927  83.4  -28.45473      8.242349 0.99 
1 1 1 -47 5  20 o 154.5758 4.160413 180.2551  172.5 -21.24879      8.320826 0.98 
1 1 1 -47 5  21 o 115.6810 5.003218 235.7271  211.3 -0.2120819     10.00644 0.98 
1 1 1 -47 5  22 o 109.5514 4.902474 163.5645  202.4 11.54742       9.804949 0.96 
1 1 1 -47 5  23 o 135.3964 4.418100 261.3053  148.1 -7.620255      8.836200 0.98 
1 1 1 -47 5  24 o 143.4784 4.578454 246.1489  79.2  12.71869       9.156907 0.98 
1 1 1 -47 5  25 o 143.5155 4.292824 268.4876  95.0  10.17072       8.585648 0.98 
1 1 1 -47 5  26 o 77.61590 6.965861 49.33472  245.5 37.76026       13.93172 0.81 
1 1 1 -47 5  27 o 28.96301 9.052811 49.91576  60.4  7.159939       18.10562 0.53 
1 1 1 -47 5  28 o 29.42845 9.148728 80.50606  18.7  -0.1590824     18.29746 0.76 
1 1 1 -47 5  29 o 31.51429 9.576733 27.64400  282.4 -3.972078      19.15347 0.47 
1 1 1 -47 5  30 o 32.30754 10.01352 75.14262  317.9 8.705593       20.02704 0.81 
1 1 1 -47 5  31 o 34.46204 10.64196 40.07505  16.7  21.23817       21.28392 0.63 
1 1 1 -47 5  32 o 32.33394 10.23187 27.54823  100.4 5.980928       20.46374 0.51 
1 1 1 -47 5  33 o 39.73421 10.43082 32.43241  167.4 ?              ?        0.68 
1 1 1 -47 7  1  o 68.61269 8.187479 130.6380  96.9  -15.78185      16.37496 0.92 
1 1 1 -47 7  2  o 124.1850 4.105727 164.9398  112.3 -12.09482      8.211453 0.97 
1 1 1 -47 7  3  o 89.40822 5.662901 105.3282  290.3 -6.000786      11.32580 0.92 
1 1 1 -47 7  4  o 169.9550 3.870352 216.8754  211.7 -9.147858      7.740705 0.98 
1 1 1 -47 7  5  o 70.70132 6.616021 169.4853  4.2   -9.678490      13.23204 0.93 
1 1 1 -47 7  6  o 75.01831 7.459012 143.8340  352.6 -16.94569      14.91802 0.92 
1 1 1 -47 7  7  o 172.6606 4.126438 247.4567  168.5 -12.94040      8.252876 0.98 
1 1 1 -47 7  8  o 89.43037 6.675752 144.2486  118.1 -33.62097      13.35150 0.93 
1 1 1 -47 7  9  o 80.55225 6.323591 151.3629  264.5 -5.425743      12.64718 0.93 
1 1 1 -47 7  10 o 269.1146 3.855502 304.8147  255.3 16.50723       7.711003 0.99 
1 1 1 -47 7  11 o 246.5579 3.949602 324.1247  228.3 -3.605194      7.899203 0.99 
1 1 1 -47 7  12 o 153.1661 4.187819 240.2064  210.7 -4.810486      8.375637 0.98 
1 1 1 -47 7  13 o 133.2926 4.482344 192.2301  180.8 -3.126373      8.964687 0.97 
1 1 1 -47 7  14 o 193.0787 4.006135 257.0131  156.0 -10.91309      8.012270 0.99 
1 1 1 -47 7  15 o 96.28491 6.043184 156.3077  118.3 -2.845230      12.08637 0.96 
1 1 1 -47 7  16 o 56.77353 10.47030 70.41953  6.4   18.89096       20.94060 0.82 
1 1 1 -47 7  17 o 53.16458 10.27642 62.66247  125.3 -2.070774      20.55285 0.76 
1 1 1 -47 7  18 o 135.4785 4.886926 172.7545  176.9 11.68413       9.773851 0.97 
1 1 1 -47 7  19 o 53.63284 10.60443 105.0254  324.8 -2.007298      21.20887 0.84 
1 1 1 -47 7  20 o 41.72342 9.017500 97.26598  257.9 -30.54760      18.03500 0.75 
1 1 1 -47 7  21 o 98.60426 5.554404 199.4081  173.4 -2.156487      11.10881 0.96 
1 1 1 -47 7  22 o 86.18298 6.189286 155.2076  20.7  32.59790       12.37857 0.94 
1 1 1 -47 7  23 o 107.4693 6.112632 158.2247  304.4 -29.64069      12.22526 0.96 
1 1 1 -47 7  24 o 153.1680 4.778008 255.1936  237.1 -14.56390      9.556017 0.99 
1 1 1 -47 7  25 o 36.63244 10.58947 71.92533  237.8 13.37439       21.17893 0.76 
1 1 1 -47 7  26 o 68.38446 9.243639 88.71994  325.4 0.6253662      18.48728 0.92 
1 1 1 -47 7  27 o 69.55561 9.697803 73.86221  251.4 -9.521332      19.39561 0.92 
1 1 1 -47 7  28 o 26.26082 8.726965 9.420089  237.9 15.14568       17.45393 0.16 
1 1 1 -47 7  29 o 79.39664 9.394135 178.3372  282.5 -33.81499      18.78827 0.97 
1 1 1 -47 7  30 o 41.13769 10.87479 74.58450  10.5  -3.430931      21.74959 0.86 
1 1 1 -47 7  31 o 99.78733 6.721838 148.7950  70.4  ?              ?        0.98 
1 1 1 -47 9  1  o 62.44827 11.11394 86.86781  272.7 -12.01374      22.22788 0.81 
1 1 1 -47 9  2  o 124.1998 6.656926 198.9514  166.4 -26.63248      13.31385 0.96 
1 1 1 -47 9  3  o 114.8500 4.827053 121.9595  171.1 -20.58875      9.654106 0.94 
1 1 1 -47 9  4  o 39.15225 9.600183 52.76864  128.4 17.08137       19.20037 0.50 
1 1 1 -47 9  5  o 25.01874 8.416377 57.39881  335.0 -5.363588      16.83275 0.39 
1 1 1 -47 9  6  o 72.64723 8.717159 113.8309  289.2 -31.99307      17.43432 0.89 
1 1 1 -47 9  7  f 53.60535 8.771057 51.14631  319.7 -45.34531      17.54211 0.00 
1 1 1 -47 9  8  o 136.2967 4.732625 178.9238  353.6 4.582581       9.465251 0.97 
1 1 1 -47 9  9  o 111.1706 5.351690 169.1504  135.4 -0.2518768     10.70338 0.96 
1 1 1 -47 9  10 o 91.01309 6.049660 124.2992  216.1 -40.13244      12.09932 0.93 
1 1 1 -47 9  11 o 133.7922 5.027384 238.9381  347.8 -8.779266      10.05477 0.98 
1 1 1 -47 9  12 o 96.15948 6.335215 153.0939  71.4  12.78020       12.67043 0.94 
1 1 1 -47 9  13 o 183.5674 3.940941 222.3858  186.1 -0.9305420     7.881882 0.98 
1 1 1 -47 9  14 o 255.1848 4.117589 409.3059  223.9 -29.55119      8.235179 0.99 
1 1 1 -47 9  15 o 189.0156 4.144224 304.1402  200.9 -2.892731      8.288447 0.99 
1 1 1 -47 9  16 o 114.3069 5.691314 198.3356  268.4 18.89703       11.38263 0.97 
1 1 1 -47 9  17 o 92.11782 6.352494 169.1046  261.0 -11.22697      12.70499 0.95 
1 1 1 -47 9  18 o 58.73177 10.27069 97.93175  152.2 1.391281       20.54139 0.86 
1 1 1 -47 9  19 f 100.1383 6.281395 171.7056  183.2 15.16087       12.56279 0.00 
1 1 1 -47 9  20 o 42.15266 10.01622 36.90691  198.9 25.79668       20.03244 0.54 
1 1 1 -47 9  21 o 108.0800 5.973689 148.1731  328.5 -15.61452      11.94738 0.97 
1 1 1 -47 9  22 o 62.32570 9.755916 140.0975  1.1   -38.21825      19.51183 0.94 
1 1 1 -47 9  23 o 45.65858 10.08957 53.75073  208.5 -22.18473      20.17915 0.80 
1 1 1 -47 9  24 o 89.41417 6.938458 122.5505  176.1 31.35844       13.87692 0.97 
1 1 1 -47 9  25 o 46.35512 10.92007 92.35136  164.9 11.07921       21.84014 0.90 
1 1 1 -47 9  26 o 50.31987 9.214098 85.69286  303.3 -28.22198      18.42820 0.91 
1 1 1 -47 9  27 o 48.98815 10.45544 73.64241  334.3 38.62298       20.91087 0.89 
1 1 1 -47 9  28 o 49.64202 8.156594 94.12555  153.9 ?              ?        0.93 
1 1 1 -47 11 1  o 119.0193 5.699393 124.6194  148.2 12.32256       11.39879 0.97 
1 1 1 -47 11 2  o 44.10738 11.17761 75.87884  261.9 2.471348       22.35521 0.82 
1 1 1 -47 11 3  o 46.92854 10.38273 36.24572  297.2 -1.155468      20.76547 0.61 
1 1 1 -47 11 4  o 40.41655 11.51432 25.72438  121.9 9.170341       23.02864 0.40 
1 1 1 -47 11 5  o 118.5222 5.855895 166.1617  94.2  -0.9130020     11.71179 0.97 
1 1 1 -47 11 6  o 80.81199 8.740976 129.5085  96.4  -32.91975      17.48195 0.94 
1 1 1 -47 11 7  o 34.25098 10.38970 54.16055  212.8 -1.916668      20.77939 0.60 
1 1 1 -47 11 8  o 92.93160 7.763108 123.9225  141.1 14.02956       15.52622 0.95 
1 1 1 -47 11 9  o 212.3829 3.502795 336.1307  168.8 -1.401886      7.005589 0.99 
1 1 1 -47 11 10 o 54.05634 10.85173 129.6579  154.2 -13.73206      21.70346 0.91 
1 1 1 -47 11 11 o 36.15113 9.801253 69.31626  319.1 -22.98991      19.60251 0.73 
1 1 1 -47 11 12 o 49.86169 10.68338 81.32010  124.8 -17.56738      21.36676 0.84 
1 1 1 -47 11 13 o 26.60081 8.900992 73.69056  126.5 -13.82221      17.80198 0.68 
1 1 1 -47 11 14 o 61.53831 10.01341 95.40725  87.6  -20.99646      20.02682 0.91 
1 1 1 -47 11 15 o 31.13522 9.737031 80.88160  213.7 -6.754517      19.47406 0.78 
1 1 1 -47 11 16 o 50.56051 10.79462 124.8032  264.9 19.81738       21.58924 0.92 
1 1 1 -47 11 17 o 44.78101 9.871724 77.12852  299.0 -25.82883      19.74345 0.87 
1 1 1 -47 11 18 o 25.88401 8.793970 17.04951  171.7 -4.108538      17.58794 0.28 
1 1 1 -47 11 19 o 48.02603 11.15938 91.81669  219.2 -19.92050      22.31876 0.90 
1 1 1 -47 11 20 o 33.47348 9.886176 32.46620  346.3 18.09839       19.77235 0.57 
1 1 1 -47 11 21 o 33.72712 10.12400 70.49091  341.3 -0.5228348     20.24800 0.81 
1 1 1 -47 11 22 o 24.69732 8.369489 43.54033  356.4 0.3829002E-01  16.73898 0.60 
1 1 1 -47 11 23 o 51.07127 11.24704 114.4690  15.8  -5.203789      22.49408 0.93 
1 1 1 -47 11 24 o 39.51500 11.08069 66.62326  14.3  ?              ?        0.85 
1 1 1 -47 11 25 x ?        ?        113.0701  225.6 ?              ?        0.00 
1 1 1 -47 13 1  o 42.28441 10.19498 78.16054  76.5  -26.52989      20.38997 0.88 
1 1 1 -47 13 2  o 62.88065 9.938943 115.4796  210.5 21.59929       19.87789 0.95 
1 1 1 -47 13 3  o 41.99337 11.54636 59.78830  142.8 -8.648201      23.09272 0.81 
1 1 1 -47 13 4  o 28.27296 9.163875 46.23996  107.2 -12.98882      18.32775 0.65 
1 1 1 -47 13 5  o 39.02964 11.11017 46.15790  172.3 -7.407604      22.22034 0.73 
1 1 1 -47 13 6  f 38.10551 11.48674 57.40717  12.1  7.730373       22.97347 0.00 
1 1 1 -47 13 7  f 66.40897 9.960660 124.1013  42.0  -45.23806      19.92132 0.00 
1 1 1 -47 13 8  o 53.82006 10.41321 117.0475  82.8  34.40006       20.82643 0.93 
1 1 1 -47 13 9  o 36.12204 11.24194 56.25344  298.0 5.098442       22.48387 0.76 
1 1 1 -47 13 10 o 59.01973 11.26603 111.4294  51.6  5.541695       22.53206 0.93 
1 1 1 -47 13 11 o 31.62437 10.25321 58.62170  124.1 10.43751       20.50643 0.75 
1 1 1 -47 13 12 f 49.58360 11.13912 73.88689  125.0 -29.71312      22.27824 0.00 
1 1 1 -47 13 13 o 54.41021 11.66177 118.6879  75.8  16.28463       23.32353 0.93 
1 1 1 -47 13 14 o 34.39804 10.48673 82.01212  37.1  2.749123       20.97345 0.85 
1 1 1 -47 13 15 o 40.05846 11.91239 49.92818  98.9  -5.495644      23.82478 0.77 
1 1 1 -47 13 16 o 32.44392 10.25502 51.06980  246.4 -10.79127      20.51003 0.75 
1 1 1 -47 13 17 o 32.31500 10.19620 44.82335  122.8 ?              ?        0.72 
1 1 1 -47 13 18 o 29.77287 9.706863 24.92069  133.8 ?              ?        0.50 
1 1 1 -47 13 19 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -46 0  1  o 404.1417 5.394163 543.7595  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  2  o 269.7400 4.784605 378.6790  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  3  o 184.2877 5.173237 363.4161  360.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  4  o 76.49153 8.680520 20.86718  180.0 -0.000000      0.000000 0.27 
1 1 1 -46 0  5  o 163.9914 5.928771 167.2375  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  6  o 209.7822 5.648046 335.1075  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  7  o 289.7387 5.991840 375.2157  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  8  o 302.4349 5.916340 382.9411  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  9  o 92.55775 9.198513 113.6981  180.0 -0.000000      0.000000 0.81 
1 1 1 -46 0  10 o 36.52928 18.11955 47.63112  360.0 -0.000000      0.000000 0.18 
1 1 1 -46 0  11 o 101.9658 7.855468 289.3907  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  12 o 73.54841 9.569995 46.87101  0.0   -0.000000      0.000000 0.53 
1 1 1 -46 0  13 o 184.6381 5.405511 355.6623  360.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  14 o 157.2573 6.185795 320.9926  360.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  15 o 151.8529 5.876399 272.3799  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  16 o 105.8764 6.090644 256.6288  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  17 o 190.6173 5.187893 417.7757  0.0   -0.000000      0.000000 1.00 
1 1 1 -46 0  18 o 192.4396 5.184895 346.4482  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  19 o 62.27007 11.34710 1.940941  180.0 -0.000000      0.000000 0.03 
1 1 1 -46 0  20 o 225.1053 5.023627 371.0892  0.0   -0.000000      0.000000 1.00 
1 1 1 -46 0  21 o 132.6883 5.381785 214.6013  360.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  22 o 340.7592 5.589149 449.0356  360.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  23 o 105.8455 5.835485 79.21958  0.0   -0.000000      0.000000 0.99 
1 1 1 -46 0  24 o 266.3301 5.281240 347.5107  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  25 o 129.7644 6.616612 231.6552  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  26 o 98.98557 8.195834 71.41107  360.0 -0.000000      0.000000 0.97 
1 1 1 -46 0  27 o 19.57776 13.01319 112.3580  180.0 -0.000000      0.000000 0.57 
1 1 1 -46 0  28 o 68.75074 13.30916 110.2014  360.0 -0.000000      0.000000 0.99 
1 1 1 -46 0  29 o 29.65756 17.30472 146.7632  360.0 -0.000000      0.000000 0.91 
1 1 1 -46 0  30 o 26.03625 16.06752 49.67646  180.0 -0.000000      0.000000 0.52 
1 1 1 -46 0  31 f 110.1230 8.834018 164.1292  360.0 -0.000000      0.000000 0.00 
1 1 1 -46 0  32 o 84.74278 11.11374 220.5498  360.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  33 o 19.74214 13.25196 15.66976  180.0 -0.000000      0.000000 0.19 
1 1 1 -46 0  34 o 112.5497 10.02915 193.8365  180.0 -0.000000      0.000000 1.00 
1 1 1 -46 0  35 o 39.84554 21.19534 47.12685  0.0   ?              ?        0.78 
1 1 1 -46 2  1  o 292.5348 2.985473 391.7994  324.0 28.23059       5.970945 0.99 
1 1 1 -46 2  2  o 50.82161 8.281013 100.3751  353.8 33.07514       16.56203 0.61 
1 1 1 -46 2  3  o 156.8662 3.522903 289.8393  115.7 17.47562       7.045807 0.96 
1 1 1 -46 2  4  o 85.45564 5.843423 31.56008  244.3 -15.75371      11.68685 0.42 
1 1 1 -46 2  5  o 111.2096 4.624042 180.8939  230.5 -25.21310      9.248084 0.91 
1 1 1 -46 2  6  o 183.4482 3.565130 131.2328  250.2 5.443726       7.130259 0.93 
1 1 1 -46 2  7  o 151.3892 4.368724 197.0471  275.4 33.04471       8.737448 0.94 
1 1 1 -46 2  8  o 174.8612 4.153133 261.1812  18.0  -8.509216      8.306267 0.96 
1 1 1 -46 2  9  o 172.0041 4.111017 222.9829  316.5 -12.15544      8.222034 0.95 
1 1 1 -46 2  10 o 239.2118 3.994591 394.4116  62.2  -18.56081      7.989182 0.98 
1 1 1 -46 2  11 o 271.7186 4.004403 363.8793  233.2 7.011475       8.008806 0.98 
1 1 1 -46 2  12 o 248.5780 4.313012 324.8288  85.2  -18.00328      8.626023 0.98 
1 1 1 -46 2  13 o 306.8154 4.475802 500.1305  81.4  9.478424       8.951605 0.99 
1 1 1 -46 2  14 o 92.65652 5.872147 185.7693  113.2 -20.06265      11.74429 0.90 
1 1 1 -46 2  15 o 124.4630 4.798862 129.6950  254.4 -19.87514      9.597723 0.91 
1 1 1 -46 2  16 o 130.0155 4.471318 209.1793  191.0 36.31638       8.942636 0.95 
1 1 1 -46 2  17 o 178.7757 3.915908 227.2816  207.7 19.86929       7.831815 0.97 
1 1 1 -46 2  18 o 206.7060 3.833946 318.2617  218.0 -2.581772      7.667892 0.98 
1 1 1 -46 2  19 o 247.2278 3.761246 351.4679  175.8 25.46738       7.522492 0.99 
1 1 1 -46 2  20 o 89.98198 5.880571 168.9852  298.8 -28.56673      11.76114 0.93 
1 1 1 -46 2  21 f 64.10001 7.676731 7.707952  161.7 33.28035       15.35346 0.00 
1 1 1 -46 2  22 o 77.32083 6.742993 66.73774  145.0 9.423622       13.48599 0.83 
1 1 1 -46 2  23 o 99.24588 5.240313 130.5270  200.2 5.514854       10.48063 0.95 
1 1 1 -46 2  24 o 110.1135 4.579531 141.5126  213.8 24.14659       9.159062 0.96 
1 1 1 -46 2  25 o 56.84249 9.057642 71.06632  184.0 14.77021       18.11528 0.77 
1 1 1 -46 2  26 o 96.84470 5.734835 130.1881  16.1  -18.27739      11.46967 0.93 
1 1 1 -46 2  27 o 32.59127 9.496291 76.76331  234.6 1.979279       18.99258 0.60 
1 1 1 -46 2  28 o 40.33265 10.27012 71.34148  163.1 18.51079       20.54024 0.69 
1 1 1 -46 2  29 o 98.28368 6.477411 180.2432  293.2 -2.789742      12.95482 0.97 
1 1 1 -46 2  30 o 142.3053 4.894542 216.7279  197.4 -11.16270      9.789083 0.99 
1 1 1 -46 2  31 o 88.10907 7.516594 144.3374  40.0  -13.82327      15.03319 0.97 
1 1 1 -46 2  32 o 63.69468 9.129253 131.1228  285.7 -33.04047      18.25851 0.95 
1 1 1 -46 2  33 o 69.68533 9.145425 136.9997  197.9 -10.27657      18.29085 0.96 
1 1 1 -46 2  34 o 37.81908 10.91511 44.84368  146.4 ?              ?        0.73 
1 1 1 -46 4  1  o 65.44744 7.577271 81.85224  195.4 45.80880       15.15454 0.74 
1 1 1 -46 4  2  o 157.4299 3.930500 211.3515  319.8 -1.140503      7.861001 0.96 
1 1 1 -46 4  3  o 74.91785 6.170840 113.5654  253.1 -1.888466      12.34168 0.81 
1 1 1 -46 4  4  o 79.00349 6.510717 115.5591  132.8 -19.13906      13.02143 0.82 
1 1 1 -46 4  5  o 33.30410 8.957143 4.125857  131.2 -18.06434      17.91429 0.05 
1 1 1 -46 4  6  o 105.4854 5.273863 164.5612  292.1 6.813225       10.54773 0.91 
1 1 1 -46 4  7  o 146.9307 4.150322 158.3676  249.9 9.040848       8.300645 0.93 
1 1 1 -46 4  8  o 48.12578 9.260153 136.5938  51.5  19.81768       18.52031 0.72 
1 1 1 -46 4  9  o 64.88982 8.439857 93.45419  307.9 -16.90795      16.87971 0.73 
1 1 1 -46 4  10 o 58.99512 10.20295 85.04070  335.2 -1.516064      20.40590 0.62 
1 1 1 -46 4  11 o 161.4159 4.262482 304.8925  345.3 5.807968       8.524963 0.97 
1 1 1 -46 4  12 o 147.6987 4.526794 207.3041  275.3 -6.417633      9.053589 0.96 
1 1 1 -46 4  13 o 50.58432 9.063721 61.33403  242.3 22.19850       18.12744 0.49 
1 1 1 -46 4  14 o 128.6472 4.409345 209.3914  56.3  31.77805       8.818689 0.95 
1 1 1 -46 4  15 o 137.1669 4.653428 182.7454  160.3 -11.22728      9.306855 0.96 
1 1 1 -46 4  16 o 178.0260 3.905645 257.5469  190.3 -4.490051      7.811291 0.98 
1 1 1 -46 4  17 o 172.9098 4.223318 304.9878  283.3 -28.89857      8.446636 0.98 
1 1 1 -46 4  18 o 123.1167 4.836154 193.5678  348.3 19.77988       9.672308 0.96 
1 1 1 -46 4  19 o 141.9604 4.055153 192.6130  332.0 0.1427002      8.110306 0.97 
1 1 1 -46 4  20 o 35.36881 10.47276 63.06926  149.0 -13.59293      20.94552 0.53 
1 1 1 -46 4  21 o 24.87773 7.991590 51.35184  322.6 -2.347246      15.98318 0.40 
1 1 1 -46 4  22 o 134.1854 4.054723 168.5377  355.6 -5.863358      8.109446 0.97 
1 1 1 -46 4  23 o 59.84733 8.582585 110.2630  275.4 -24.75082      17.16517 0.89 
1 1 1 -46 4  24 o 53.17413 8.216426 141.4052  250.5 -27.68760      16.43285 0.88 
1 1 1 -46 4  25 o 85.54243 6.634176 119.5831  213.9 9.421982       13.26835 0.91 
1 1 1 -46 4  26 o 111.2759 5.763317 139.5405  193.2 45.18088       11.52663 0.95 
1 1 1 -46 4  27 o 169.7947 4.217774 230.0728  145.0 -7.926041      8.435548 0.98 
1 1 1 -46 4  28 o 60.76871 9.577056 62.11864  195.8 -21.71115      19.15411 0.82 
1 1 1 -46 4  29 o 68.99545 8.962661 103.7527  180.5 -13.15412      17.92532 0.93 
1 1 1 -46 4  30 o 34.42861 10.01714 52.52261  147.7 20.02442       20.03428 0.71 
1 1 1 -46 4  31 o 35.19395 9.945513 53.92360  89.8  -1.474670      19.89103 0.74 
1 1 1 -46 4  32 o 35.03758 10.44221 25.76912  117.3 11.14112       20.88442 0.48 
1 1 1 -46 4  33 o 45.08720 11.26169 88.05901  87.9  18.73741       22.52337 0.89 
1 1 1 -46 4  34 o 32.32844 10.36369 32.02127  284.7 ?              ?        0.60 
1 1 1 -46 6  1  o 132.6527 4.056205 177.3968  293.9 -8.689575      8.112411 0.96 
1 1 1 -46 6  2  f 115.8533 4.559735 145.8348  199.0 4.414780       9.119471 0.00 
1 1 1 -46 6  3  o 72.01052 7.312625 80.03541  167.9 -34.18347      14.62525 0.80 
1 1 1 -46 6  4  o 242.3152 3.596011 271.0959  82.3  -15.99269      7.192022 0.98 
1 1 1 -46 6  5  o 141.9077 4.058963 199.4054  323.2 -2.348663      8.117926 0.96 
1 1 1 -46 6  6  o 139.3403 4.017835 223.5028  333.6 -3.000122      8.035669 0.97 
1 1 1 -46 6  7  o 109.1977 4.325453 202.6326  183.5 0.1718445      8.650906 0.95 
1 1 1 -46 6  8  o 172.7978 3.646442 261.1070  180.4 1.540436       7.292885 0.98 
1 1 1 -46 6  9  o 251.1701 3.739448 394.4306  165.4 -6.870804      7.478895 0.99 
1 1 1 -46 6  10 o 111.4498 5.487682 139.5457  224.8 47.81494       10.97536 0.93 
1 1 1 -46 6  11 o 123.2297 4.759561 194.4855  32.5  -20.25224      9.519122 0.96 
1 1 1 -46 6  12 f 181.7784 4.003004 188.3365  190.8 20.14732       8.006008 0.00 
1 1 1 -46 6  13 o 92.64991 7.276082 154.0881  199.8 27.14482       14.55216 0.93 
1 1 1 -46 6  14 o 44.23061 11.09163 86.28785  102.0 5.080494       22.18327 0.68 
1 1 1 -46 6  15 o 214.0601 3.894141 278.4369  237.8 22.31293       7.788282 0.98 
1 1 1 -46 6  16 o 191.8892 4.401007 367.4351  234.1 10.96956       8.802014 0.99 
1 1 1 -46 6  17 o 60.58171 9.381848 121.6067  87.3  8.351063       18.76370 0.88 
1 1 1 -46 6  18 o 88.58578 6.351410 116.7270  39.2  -16.48711      12.70282 0.93 
1 1 1 -46 6  19 o 71.56625 7.855844 163.0916  164.4 -16.55981      15.71169 0.94 
1 1 1 -46 6  20 o 88.09636 5.975698 113.8647  160.1 10.81852       11.95140 0.94 
1 1 1 -46 6  21 o 214.7140 3.966219 363.0961  173.4 16.29555       7.932438 0.99 
1 1 1 -46 6  22 o 156.8232 3.932076 169.9278  185.5 12.79358       7.864152 0.97 
1 1 1 -46 6  23 o 105.7817 5.385745 180.0609  180.0 -12.62902      10.77149 0.96 
1 1 1 -46 6  24 o 246.0060 3.858847 369.1179  120.3 25.02415       7.717693 0.99 
1 1 1 -46 6  25 o 166.1917 3.943973 262.0672  41.3  3.492950       7.887946 0.98 
1 1 1 -46 6  26 o 154.9444 4.375467 249.9196  0.9   8.183823       8.750934 0.99 
1 1 1 -46 6  27 o 31.16741 9.582665 32.24815  22.4  4.953785       19.16533 0.44 
1 1 1 -46 6  28 o 90.71295 6.725666 67.82542  89.4  35.07302       13.45133 0.93 
1 1 1 -46 6  29 o 54.39672 11.85239 74.31702  330.3 8.893105       23.70479 0.88 
1 1 1 -46 6  30 o 83.53253 7.869546 165.2712  36.1  12.90685       15.73909 0.97 
1 1 1 -46 6  31 o 35.46654 10.83077 14.37722  161.9 7.669893       21.66154 0.30 
1 1 1 -46 6  32 f 35.37914 10.67275 31.03548  318.7 ?              ?        0.00 
1 1 1 -46 8  1  o 82.05772 5.778019 105.4944  208.9 19.71711       11.55604 0.92 
1 1 1 -46 8  2  o 158.6345 3.822845 206.7170  161.4 24.42854       7.645690 0.98 
1 1 1 -46 8  3  o 32.34778 9.391104 41.00974  215.9 1.221502       18.78221 0.45 
1 1 1 -46 8  4  o 107.0479 6.278476 154.2236  250.4 -7.302353      12.55695 0.96 
1 1 1 -46 8  5  o 93.55609 5.685639 118.0051  97.3  -16.22134      11.37128 0.94 
1 1 1 -46 8  6  o 118.9990 4.623883 156.2822  250.6 -4.162369      9.247766 0.96 
1 1 1 -46 8  7  o 118.3540 4.304576 280.6755  301.2 -14.82620      8.609152 0.98 
1 1 1 -46 8  8  o 183.9048 4.233527 260.6676  16.5  -8.292282      8.467054 0.99 
1 1 1 -46 8  9  o 140.3077 4.534717 204.7565  73.3  1.086380       9.069434 0.98 
1 1 1 -46 8  10 o 133.9776 4.418125 287.6393  154.3 5.868805       8.836250 0.98 
1 1 1 -46 8  11 o 216.2577 4.190711 300.2369  203.4 1.039063       8.381423 0.99 
1 1 1 -46 8  12 o 78.10825 7.021622 106.6178  260.8 16.11911       14.04324 0.92 
1 1 1 -46 8  13 o 161.2956 4.161228 232.3787  267.4 2.065643       8.322455 0.98 
1 1 1 -46 8  14 o 117.2337 4.863130 164.3106  176.5 -8.302483      9.726259 0.97 
1 1 1 -46 8  15 o 155.8173 3.902551 207.0083  140.4 -0.8227081     7.805102 0.98 
1 1 1 -46 8  16 o 112.1105 5.536814 211.1832  280.8 4.607872       11.07363 0.97 
1 1 1 -46 8  17 o 57.33496 8.751688 128.9563  253.8 4.260830       17.50338 0.89 
1 1 1 -46 8  18 o 89.36570 7.522434 155.0314  186.7 -22.96669      15.04487 0.94 
1 1 1 -46 8  19 o 49.63568 10.08520 24.34785  99.0  7.447105       20.17039 0.34 
1 1 1 -46 8  20 o 52.55059 10.47463 114.8098  26.2  -7.830994      20.94926 0.85 
1 1 1 -46 8  21 o 89.22252 6.552975 96.97211  66.7  -22.38909      13.10595 0.91 
1 1 1 -46 8  22 o 131.8739 5.283272 213.8182  91.8  8.855057       10.56654 0.98 
1 1 1 -46 8  23 o 72.87706 8.523663 135.1216  221.2 -41.85437      17.04733 0.94 
1 1 1 -46 8  24 o 99.10703 6.863768 130.1221  228.1 -1.855675      13.72754 0.96 
1 1 1 -46 8  25 o 34.17633 9.899594 5.994655  164.2 20.71524       19.79919 0.11 
1 1 1 -46 8  26 o 48.83190 9.494558 108.5750  160.8 -25.55690      18.98912 0.92 
1 1 1 -46 8  27 o 98.17931 6.809913 133.9772  182.7 10.78253       13.61983 0.97 
1 1 1 -46 8  28 o 100.6772 6.792499 165.8714  167.4 1.227142       13.58500 0.98 
1 1 1 -46 8  29 o 32.32898 10.25629 59.49092  85.1  14.82864       20.51258 0.77 
1 1 1 -46 8  30 o 40.22213 11.50124 87.41576  15.5  ?              ?        0.89 
1 1 1 -46 10 1  o 76.40804 8.296451 109.5000  116.0 -0.9093246     16.59290 0.91 
1 1 1 -46 10 2  o 80.63560 7.904232 133.5219  167.8 -17.02373      15.80846 0.93 
1 1 1 -46 10 3  f 58.65848 10.84816 108.3417  236.1 -9.761406      21.69631 0.00 
1 1 1 -46 10 4  o 51.82638 8.825258 51.23754  106.9 44.54391       17.65052 0.63 
1 1 1 -46 10 5  o 68.52292 9.289137 54.69896  78.2  -35.19228      18.57827 0.74 
1 1 1 -46 10 6  o 74.54898 7.346497 143.8717  125.0 5.132187       14.69299 0.92 
1 1 1 -46 10 7  o 124.0917 5.149487 167.8461  168.9 -2.673920      10.29897 0.96 
1 1 1 -46 10 8  o 98.12912 6.355761 177.3228  9.4   42.76058       12.71152 0.95 
1 1 1 -46 10 9  o 42.85582 10.99848 135.4729  231.9 -6.523048      21.99695 0.84 
1 1 1 -46 10 10 o 39.78417 10.16768 63.36054  150.0 3.317795       20.33537 0.60 
1 1 1 -46 10 11 o 62.31927 8.345147 71.01915  257.4 -35.10286      16.69029 0.80 
1 1 1 -46 10 12 o 76.00199 6.764827 65.67648  230.8 -5.969940      13.52965 0.83 
1 1 1 -46 10 13 o 52.52926 10.26509 136.0437  113.4 0.3265076      20.53019 0.88 
1 1 1 -46 10 14 o 72.12111 9.257669 150.8414  109.9 29.82159       18.51534 0.93 
1 1 1 -46 10 15 o 226.2410 4.240200 330.1562  158.5 -3.385132      8.480399 0.99 
1 1 1 -46 10 16 o 185.3375 3.837570 294.0287  142.7 2.501007       7.675139 0.99 
1 1 1 -46 10 17 o 36.31361 10.10128 69.33648  27.5  6.311634       20.20257 0.69 
1 1 1 -46 10 18 o 87.86838 8.019561 158.6129  326.4 -28.60655      16.03912 0.96 
1 1 1 -46 10 19 o 36.92147 10.23574 121.1320  358.3 -3.581131      20.47149 0.87 
1 1 1 -46 10 20 o 35.19004 10.08986 40.33473  317.6 1.341187       20.17971 0.59 
1 1 1 -46 10 21 o 32.78255 9.856805 85.79552  327.6 13.90543       19.71361 0.82 
1 1 1 -46 10 22 o 116.7894 6.170305 186.8603  2.8   -11.15626      12.34061 0.98 
1 1 1 -46 10 23 o 75.19093 9.488300 141.1196  1.8   -26.09289      18.97660 0.96 
1 1 1 -46 10 24 o 43.01257 11.22452 80.50159  25.3  13.88997       22.44905 0.87 
1 1 1 -46 10 25 o 54.02058 10.41181 76.19314  90.8  -2.419468      20.82361 0.90 
1 1 1 -46 10 26 o 36.24344 10.21094 42.04580  88.8  -1.636387      20.42187 0.71 
1 1 1 -46 10 27 o 61.91026 10.40358 118.7741  291.2 ?              ?        0.95 
1 1 1 -46 12 1  o 72.42967 9.409571 96.50859  236.3 28.08989       18.81914 0.94 
1 1 1 -46 12 2  o 90.47377 7.315542 156.9584  51.7  -17.25056      14.63108 0.97 
1 1 1 -46 12 3  o 120.0784 5.732843 209.8014  84.6  8.221115       11.46569 0.99 
1 1 1 -46 12 4  o 36.21507 10.45850 59.33451  199.7 4.801506       20.91699 0.75 
1 1 1 -46 12 5  o 29.65161 9.514556 18.86312  55.0  8.246723       19.02911 0.30 
1 1 1 -46 12 6  o 48.99978 11.47329 79.81438  164.9 13.71766       22.94658 0.86 
1 1 1 -46 12 7  o 36.67528 10.79365 50.28007  222.6 -1.980839      21.58731 0.69 
1 1 1 -46 12 8  o 152.2634 5.047944 208.3423  41.3  -13.37662      10.09589 0.99 
1 1 1 -46 12 9  o 83.68756 8.357965 132.5054  149.2 12.72660       16.71593 0.96 
1 1 1 -46 12 10 o 62.75537 10.96431 87.20129  126.0 12.15907       21.92861 0.91 
1 1 1 -46 12 11 o 103.4964 6.121473 170.4688  98.4  -10.27625      12.24295 0.98 
1 1 1 -46 12 12 o 137.6202 4.959933 212.6822  124.5 11.61606       9.919867 0.99 
1 1 1 -46 12 13 o 108.0580 5.928354 132.9193  175.6 10.78516       11.85671 0.97 
1 1 1 -46 12 14 o 35.34352 10.12000 77.34519  245.9 18.64347       20.24000 0.84 
1 1 1 -46 12 15 o 60.06168 8.532319 65.02952  123.9 -62.72375      17.06464 0.90 
1 1 1 -46 12 16 o 89.44440 7.875940 152.3260  146.5 11.79528       15.75188 0.97 
1 1 1 -46 12 17 o 78.83821 9.413546 121.4016  144.1 24.49794       18.82709 0.96 
1 1 1 -46 12 18 o 42.35291 10.59705 70.39915  161.7 -19.75468      21.19410 0.85 
1 1 1 -46 12 19 f 39.89207 10.70391 61.96773  220.9 4.291866       21.40782 0.00 
1 1 1 -46 12 20 o 50.48048 10.73011 86.08243  84.2  -17.04366      21.46021 0.91 
1 1 1 -46 12 21 o 33.61610 10.47061 29.90065  323.9 6.522284       20.94122 0.57 
1 1 1 -46 12 22 o 29.20968 9.762762 52.42753  269.4 ?              ?        0.75 
1 1 1 -46 12 23 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -46 14 2  x ?        ?        48.77560  182.5 ?              ?        0.00 
1 1 1 -46 14 3  o 104.4878 7.103574 151.7416  158.9 ?              ?        0.98 
1 1 1 -46 14 4  o 45.89265 11.80299 23.63101  112.3 ?              ?        0.59 
1 1 1 -46 14 5  o 26.63246 8.998051 44.95267  76.5  ?              ?        0.68 
1 1 1 -46 14 6  o 32.74249 10.35370 20.27965  167.5 ?              ?        0.43 
1 1 1 -46 14 7  o 39.52837 11.73266 59.56373  53.9  ?              ?        0.82 
1 1 1 -46 14 8  o 34.32172 10.83193 84.08867  73.2  ?              ?        0.87 
1 1 1 -46 14 9  o 31.29068 9.874012 37.09168  274.4 ?              ?        0.65 
1 1 1 -46 14 10 o 33.63247 10.63004 25.36641  287.0 ?              ?        0.52 
1 1 1 -46 14 11 o 37.03254 11.78458 80.13487  321.2 ?              ?        0.86 
1 1 1 -46 14 12 f 29.35539 9.793851 20.32809  10.3  ?              ?        0.00 
1 1 1 -46 14 13 o 36.43671 11.18224 35.34082  10.0  ?              ?        0.67 
1 1 1 -46 14 14 x ?        ?        71.04675  332.9 ?              ?        0.00 
1 1 1 -45 1  1  o 69.35629 5.973356 67.53543  105.5 -17.07798      11.94671 0.56 
1 1 1 -45 1  2  o 99.57849 4.478580 64.89019  290.1 55.02972       8.957161 0.70 
1 1 1 -45 1  3  o 244.0122 3.501577 284.9918  46.1  -0.3763275     7.003154 0.97 
1 1 1 -45 1  4  o 128.2352 3.796841 242.4765  258.2 14.79112       7.593682 0.94 
1 1 1 -45 1  5  o 133.4449 4.673989 169.4965  156.4 -10.31863      9.347978 0.93 
1 1 1 -45 1  6  o 44.31893 10.27336 77.28488  61.2  4.397175       20.54671 0.42 
1 1 1 -45 1  7  o 127.0640 4.727217 242.2960  116.5 0.6357040      9.454433 0.94 
1 1 1 -45 1  8  o 164.4712 4.022413 202.5687  55.7  -25.52158      8.044826 0.95 
1 1 1 -45 1  9  o 175.6644 4.285391 259.1204  111.9 12.60869       8.570783 0.96 
1 1 1 -45 1  10 o 363.7562 4.521334 611.0079  51.1  -11.52182      9.042668 0.99 
1 1 1 -45 1  11 o 289.2288 4.044513 455.7414  345.2 -4.345428      8.089026 0.99 
1 1 1 -45 1  12 o 183.4402 3.946422 298.5075  214.5 6.993347       7.892844 0.97 
1 1 1 -45 1  13 o 215.4152 4.101757 347.1102  233.6 15.95042       8.203514 0.98 
1 1 1 -45 1  14 o 56.45914 7.489701 96.13559  102.0 -58.50884      14.97940 0.65 
1 1 1 -45 1  15 o 79.21048 6.396462 121.7197  104.9 8.798630       12.79292 0.80 
1 1 1 -45 1  16 o 63.25903 7.764131 107.9884  162.7 -25.53206      15.52826 0.72 
1 1 1 -45 1  17 o 199.2389 3.582710 271.2430  346.8 -11.87540      7.165420 0.97 
1 1 1 -45 1  18 o 221.6252 3.662267 327.8146  271.9 33.22960       7.324534 0.98 
1 1 1 -45 1  19 o 104.3581 5.107596 132.3566  144.3 5.171585       10.21519 0.92 
1 1 1 -45 1  20 o 141.0294 4.206466 178.4532  79.0  -22.06630      8.412932 0.96 
1 1 1 -45 1  21 f 60.81453 7.646783 73.90450  359.5 -6.306999      15.29357 0.00 
1 1 1 -45 1  22 o 132.6985 4.045307 228.2679  0.5   -35.42361      8.090613 0.97 
1 1 1 -45 1  23 o 181.2587 3.802809 280.0098  339.0 -12.28587      7.605618 0.98 
1 1 1 -45 1  24 o 61.43185 8.055828 71.74782  229.0 32.88901       16.11166 0.83 
1 1 1 -45 1  25 o 219.2706 3.901141 318.1591  156.1 39.03212       7.802283 0.99 
1 1 1 -45 1  26 o 164.8384 3.911650 254.4643  45.1  -1.007660      7.823299 0.98 
1 1 1 -45 1  27 o 39.10884 9.360695 63.79311  355.0 -11.96501      18.72139 0.58 
1 1 1 -45 1  28 o 109.9504 6.900044 110.6952  230.1 23.91821       13.80009 0.94 
1 1 1 -45 1  29 o 133.3704 4.897746 174.4015  335.4 -1.509384      9.795491 0.97 
1 1 1 -45 1  30 o 62.15553 10.48460 62.30458  346.9 16.73212       20.96921 0.83 
1 1 1 -45 1  31 o 64.97601 9.548842 111.9080  20.7  -32.90446      19.09768 0.93 
1 1 1 -45 1  32 o 69.08684 9.293711 139.8159  1.4   -40.55168      18.58742 0.96 
1 1 1 -45 1  33 o 65.36916 10.15983 82.93417  356.2 -45.43443      20.31966 0.92 
1 1 1 -45 1  34 o 79.46504 7.118446 114.9832  114.9 -7.722328      14.23689 0.96 
1 1 1 -45 1  35 o 32.76577 10.31802 42.43346  331.9 ?              ?        0.70 
1 1 1 -45 3  1  o 206.3917 3.589718 232.2585  141.6 -23.25255      7.179435 0.97 
1 1 1 -45 3  2  o 170.4967 3.602202 173.0010  282.6 -22.42014      7.204405 0.94 
1 1 1 -45 3  3  o 287.3717 3.606431 370.6363  338.1 -7.278046      7.212862 0.98 
1 1 1 -45 3  4  o 329.1270 3.776555 394.9297  51.1  -5.702484      7.553110 0.99 
1 1 1 -45 3  5  o 83.89777 5.968633 108.5139  32.1  3.315720       11.93727 0.75 
1 1 1 -45 3  6  o 67.96295 7.078994 30.82134  106.9 -6.071457      14.15799 0.34 
1 1 1 -45 3  7  o 127.3409 3.906595 203.9457  105.9 -15.96341      7.813190 0.93 
1 1 1 -45 3  8  o 147.1758 4.195408 163.5106  92.3  18.98285       8.390817 0.92 
1 1 1 -45 3  9  o 78.56440 6.660846 106.7324  281.1 -25.69856      13.32169 0.77 
1 1 1 -45 3  10 o 44.74445 10.32968 67.03331  171.8 0.2226257      20.65937 0.36 
1 1 1 -45 3  11 o 274.7722 4.155655 304.0326  311.7 -44.04604      8.311311 0.98 
1 1 1 -45 3  12 o 41.48972 9.822072 53.87255  164.4 -0.8265800     19.64414 0.28 
1 1 1 -45 3  13 o 294.3443 4.205645 366.1487  70.0  43.16077       8.411290 0.98 
1 1 1 -45 3  14 o 367.0036 4.807810 539.4724  23.8  26.61032       9.615620 0.99 
1 1 1 -45 3  15 o 175.8184 4.203327 300.8590  225.8 -9.321030      8.406654 0.97 
1 1 1 -45 3  16 o 274.6697 4.349636 356.3256  209.4 20.84882       8.699271 0.99 
1 1 1 -45 3  17 o 85.46857 5.592757 176.5897  316.7 18.93303       11.18551 0.92 
1 1 1 -45 3  18 o 155.7386 4.002904 207.0093  296.4 8.909378       8.005809 0.97 
1 1 1 -45 3  19 f 100.0527 5.773129 125.5120  207.1 -6.092133      11.54626 0.00 
1 1 1 -45 3  20 o 201.0005 3.768952 322.2438  341.6 13.72083       7.537904 0.99 
1 1 1 -45 3  21 f 126.2044 4.184232 219.2498  280.9 7.513786       8.368464 0.00 
1 1 1 -45 3  22 o 97.13459 4.867531 170.8794  141.9 32.87296       9.735062 0.95 
1 1 1 -45 3  23 o 197.8407 4.874819 222.2513  118.7 -23.91264      9.749638 0.99 
1 1 1 -45 3  24 o 32.85813 9.052716 96.86994  139.5 20.61333       18.10543 0.75 
1 1 1 -45 3  25 o 58.64076 9.338563 123.0609  264.7 -2.344090      18.67713 0.88 
1 1 1 -45 3  26 o 111.0770 5.138770 221.6934  50.2  -18.40153      10.27754 0.97 
1 1 1 -45 3  27 o 36.41383 10.05273 17.66881  210.5 5.558254       20.10546 0.19 
1 1 1 -45 3  28 o 31.03052 9.100162 77.94688  191.0 -10.48085      18.20032 0.64 
1 1 1 -45 3  29 o 117.3972 5.328842 198.5239  357.1 -0.7738800     10.65768 0.98 
1 1 1 -45 3  30 o 119.0760 6.008985 133.6584  273.0 29.42773       12.01797 0.97 
1 1 1 -45 3  31 o 97.20266 6.222374 108.5889  247.4 14.18372       12.44475 0.96 
1 1 1 -45 3  32 o 132.3380 4.825786 173.8780  248.1 26.67941       9.651572 0.98 
1 1 1 -45 3  33 o 31.95789 9.783087 34.59463  219.2 -0.4729099     19.56617 0.57 
1 1 1 -45 3  34 o 29.41698 9.755713 29.44347  37.9  ?              ?        0.52 
1 1 1 -45 5  1  o 68.36875 6.746629 113.4361  321.9 25.43885       13.49326 0.84 
1 1 1 -45 5  2  o 199.1434 3.582229 186.1171  110.5 0.2957001      7.164458 0.97 
1 1 1 -45 5  3  o 183.9578 3.519691 240.4941  285.5 11.75142       7.039382 0.97 
1 1 1 -45 5  4  o 136.1333 4.367090 145.4890  46.8  1.709290       8.734179 0.93 
1 1 1 -45 5  5  o 224.3624 3.723995 323.7232  27.7  -18.57857      7.447991 0.98 
1 1 1 -45 5  6  o 217.2603 3.671542 390.5611  173.2 10.11697       7.343084 0.98 
1 1 1 -45 5  7  o 144.6088 3.931801 303.8249  182.9 -14.51567      7.863601 0.97 
1 1 1 -45 5  8  f 74.97641 6.685945 120.7570  208.1 -21.10467      13.37189 0.00 
1 1 1 -45 5  9  o 31.59074 8.520569 87.96260  248.7 -16.70247      17.04114 0.43 
1 1 1 -45 5  10 o 274.3813 3.752749 360.7403  253.3 3.297638       7.505498 0.99 
1 1 1 -45 5  11 o 167.1409 4.070828 259.4092  319.7 26.56859       8.141657 0.97 
1 1 1 -45 5  12 o 59.22736 8.826708 97.40536  182.2 -13.89220      17.65342 0.72 
1 1 1 -45 5  13 o 128.2505 4.535192 191.6539  196.3 -45.36007      9.070385 0.95 
1 1 1 -45 5  14 o 85.52517 6.679337 167.1545  129.7 2.882431       13.35867 0.92 
1 1 1 -45 5  15 o 90.17238 5.926395 55.75398  23.1  -6.015450      11.85279 0.76 
1 1 1 -45 5  16 o 159.3600 4.038011 166.4995  224.8 -0.9423370     8.076022 0.96 
1 1 1 -45 5  17 o 138.1796 5.785785 175.6454  335.7 -3.703918      11.57157 0.96 
1 1 1 -45 5  18 o 44.76264 9.331174 31.05547  342.2 1.552719       18.66235 0.34 
1 1 1 -45 5  19 o 120.0898 5.025504 197.8189  251.9 -7.505547      10.05101 0.96 
1 1 1 -45 5  20 o 76.75406 8.068377 59.42554  46.6  44.45610       16.13675 0.80 
1 1 1 -45 5  21 o 171.7596 3.608226 257.7285  110.6 2.415176       7.216452 0.99 
1 1 1 -45 5  22 o 106.5506 4.432060 201.7388  260.1 30.24016       8.864120 0.97 
1 1 1 -45 5  23 o 265.9964 3.672549 357.2548  279.6 -15.42679      7.345097 0.99 
1 1 1 -45 5  24 o 39.91087 10.07861 63.43453  317.0 -2.557026      20.15722 0.58 
1 1 1 -45 5  25 o 39.91140 10.18785 85.89676  323.0 5.184723       20.37570 0.70 
1 1 1 -45 5  26 o 105.8551 5.114507 120.1698  105.2 29.50179       10.22901 0.94 
1 1 1 -45 5  27 o 189.5590 3.932104 276.6533  146.6 15.15881       7.864209 0.99 
1 1 1 -45 5  28 o 114.0893 5.279466 134.8878  41.1  15.89375       10.55893 0.97 
1 1 1 -45 5  29 o 71.24427 8.671824 95.08141  0.5   -6.703796      17.34365 0.93 
1 1 1 -45 5  30 o 95.87865 6.909597 123.7741  88.3  22.52391       13.81919 0.97 
1 1 1 -45 5  31 o 78.01421 8.976205 95.32830  37.1  -0.7849121E-01 17.95241 0.95 
1 1 1 -45 5  32 o 46.93277 11.68445 25.34280  94.3  9.640697       23.36890 0.57 
1 1 1 -45 5  33 o 38.08267 10.41804 55.52020  169.9 ?              ?        0.80 
1 1 1 -45 7  1  o 30.59421 9.126333 35.05125  234.0 13.26800       18.25267 0.28 
1 1 1 -45 7  2  f 66.13057 8.025936 61.41312  77.6  51.92062       16.05187 0.00 
1 1 1 -45 7  3  o 72.21181 7.058328 124.0566  5.3   4.063667       14.11666 0.89 
1 1 1 -45 7  4  o 45.03371 9.514380 141.0271  28.9  -9.418083      19.02876 0.82 
1 1 1 -45 7  5  o 68.74820 6.801770 93.69138  309.6 -4.225090      13.60354 0.83 
1 1 1 -45 7  6  o 135.0675 4.007185 206.4053  242.3 18.82516       8.014371 0.97 
1 1 1 -45 7  7  o 131.5561 5.872164 100.9940  342.5 -25.80978      11.74433 0.92 
1 1 1 -45 7  8  o 274.7970 3.766671 424.4716  20.9  -1.277161      7.533342 0.99 
1 1 1 -45 7  9  o 129.9159 4.272863 206.6299  83.4  -4.473747      8.545727 0.96 
1 1 1 -45 7  10 o 141.5349 3.816080 257.5898  102.5 -18.53520      7.632160 0.97 
1 1 1 -45 7  11 o 104.8831 5.644581 156.5956  174.4 26.57779       11.28916 0.94 
1 1 1 -45 7  12 o 132.9254 4.367060 164.4225  243.5 8.278549       8.734120 0.96 
1 1 1 -45 7  13 o 40.02361 10.44878 45.28102  221.8 -7.588963      20.89757 0.43 
1 1 1 -45 7  14 o 92.96478 5.473526 168.0355  65.4  2.463348       10.94705 0.94 
1 1 1 -45 7  15 o 82.95796 6.337878 134.7214  146.8 -6.525856      12.67576 0.93 
1 1 1 -45 7  16 o 91.56885 6.517967 157.4743  91.8  -2.058380      13.03593 0.95 
1 1 1 -45 7  17 o 124.8948 5.059168 254.0221  58.7  -31.56889      10.11834 0.98 
1 1 1 -45 7  18 o 171.1332 4.325259 242.9007  281.8 4.974060       8.650517 0.99 
1 1 1 -45 7  19 o 128.5211 4.955411 175.3286  235.3 -4.456993      9.910823 0.97 
1 1 1 -45 7  20 o 51.04543 9.923166 90.02879  6.2   -0.4623375     19.84633 0.81 
1 1 1 -45 7  21 o 44.40852 10.24714 110.1609  213.8 -22.60582      20.49428 0.80 
1 1 1 -45 7  22 o 197.5796 4.297758 367.7520  117.9 -16.90425      8.595515 0.99 
1 1 1 -45 7  23 f 228.3242 4.070878 320.5101  144.6 -11.35683      8.141755 0.00 
1 1 1 -45 7  24 o 171.9541 4.271538 287.7848  132.3 14.71413       8.543076 0.99 
1 1 1 -45 7  25 o 183.0142 4.073856 298.2126  17.6  10.09154       8.147712 0.99 
1 1 1 -45 7  26 o 157.3646 4.892416 221.7997  24.8  -4.061493      9.784832 0.99 
1 1 1 -45 7  27 o 40.52982 10.13335 40.85241  132.2 16.30550       20.26670 0.66 
1 1 1 -45 7  28 o 107.4786 6.130362 152.1594  190.5 -2.017212      12.26072 0.98 
1 1 1 -45 7  29 o 50.05987 10.78835 54.73026  256.3 -7.629871      21.57669 0.83 
1 1 1 -45 7  30 o 33.10188 9.543566 28.58038  211.9 -8.797865      19.08713 0.52 
1 1 1 -45 7  31 f 34.15235 10.39202 18.13286  349.8 ?              ?        0.00 
1 1 1 -45 7  32 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -45 9  1  o 104.1711 7.634063 126.4189  321.6 7.010185       15.26813 0.94 
1 1 1 -45 9  2  o 61.62431 8.989963 64.59021  57.9  20.69790       17.97993 0.77 
1 1 1 -45 9  3  o 64.66602 8.336531 158.2436  185.3 15.43162       16.67306 0.93 
1 1 1 -45 9  4  o 28.59245 8.824012 45.85485  289.2 4.505007       17.64802 0.43 
1 1 1 -45 9  5  o 114.1044 6.542609 108.9654  270.8 35.10082       13.08522 0.95 
1 1 1 -45 9  6  o 96.02951 5.250652 139.4317  221.0 16.75382       10.50130 0.95 
1 1 1 -45 9  7  o 35.75195 9.723040 53.12932  106.0 15.08065       19.44608 0.59 
1 1 1 -45 9  8  o 93.56422 5.893436 98.78551  262.1 19.93556       11.78687 0.93 
1 1 1 -45 9  9  f 114.9270 4.700096 238.5645  265.4 13.93253       9.400191 0.00 
1 1 1 -45 9  10 o 75.50192 8.092920 49.98894  346.2 23.72262       16.18584 0.81 
1 1 1 -45 9  11 o 91.18015 5.672076 109.3408  74.8  -16.88545      11.34415 0.94 
1 1 1 -45 9  12 o 37.51650 9.822205 95.53899  308.2 -11.57418      19.64441 0.77 
1 1 1 -45 9  13 o 118.5731 4.831148 187.8197  295.1 -1.425468      9.662296 0.97 
1 1 1 -45 9  14 f 111.9142 5.362215 194.8161  159.5 14.54531       10.72443 0.00 
1 1 1 -45 9  15 o 132.8612 4.854430 213.1647  113.0 -6.934509      9.708860 0.97 
1 1 1 -45 9  16 o 48.48499 9.733382 104.6987  339.3 10.00047       19.46676 0.81 
1 1 1 -45 9  17 o 73.43222 7.665302 133.4802  260.2 -2.217720      15.33060 0.91 
1 1 1 -45 9  18 f 39.03742 10.06976 84.42112  193.7 3.743961       20.13951 0.00 
1 1 1 -45 9  19 o 68.32545 8.050448 159.5693  31.8  -5.089195      16.10090 0.93 
1 1 1 -45 9  20 o 77.29726 8.209546 101.8924  89.5  -6.432037      16.41909 0.91 
1 1 1 -45 9  21 f 83.67582 7.144345 103.5128  71.3  2.797287       14.28869 0.00 
1 1 1 -45 9  22 o 114.4050 5.718824 236.4439  14.7  -8.627777      11.43765 0.98 
1 1 1 -45 9  23 o 88.04936 7.335426 159.7737  337.4 -5.056808      14.67085 0.97 
1 1 1 -45 9  24 o 37.98276 10.25992 35.50736  251.5 23.60169       20.51984 0.60 
1 1 1 -45 9  25 o 58.21254 9.365641 127.5503  51.6  -12.33407      18.73128 0.95 
1 1 1 -45 9  26 o 109.2181 6.798294 210.4335  62.8  2.204163       13.59659 0.98 
1 1 1 -45 9  27 f 38.74800 9.605315 35.12584  159.6 -13.23720      19.21063 0.00 
1 1 1 -45 9  28 o 34.26892 10.07079 25.04664  303.9 8.341061       20.14158 0.50 
1 1 1 -45 9  29 f 34.99700 10.22381 76.51038  79.8  ?              ?        0.00 
1 1 1 -45 11 1  o 29.41956 9.324317 15.92921  355.5 10.68746       18.64863 0.19 
1 1 1 -45 11 2  o 77.75600 7.698696 94.18441  358.6 14.78705       15.39739 0.91 
1 1 1 -45 11 3  o 30.87348 9.288184 9.403832  152.9 1.008636       18.57637 0.11 
1 1 1 -45 11 4  o 202.7241 4.609677 251.3204  248.2 12.44524       9.219354 0.99 
1 1 1 -45 11 5  o 102.6294 5.765596 144.6601  290.2 13.44753       11.53119 0.95 
1 1 1 -45 11 6  o 101.6171 6.967998 196.5412  23.2  32.13472       13.93600 0.97 
1 1 1 -45 11 7  o 53.34518 10.72653 79.14498  355.0 -3.951271      21.45306 0.80 
1 1 1 -45 11 8  o 226.2417 4.684359 352.3304  349.5 8.303726       9.368717 0.99 
1 1 1 -45 11 9  o 38.39348 10.45035 21.88265  5.3   17.61909       20.90071 0.28 
1 1 1 -45 11 10 o 130.0960 4.930244 189.7170  147.0 -22.46454      9.860489 0.97 
1 1 1 -45 11 11 o 33.91877 10.08119 43.18732  254.7 2.552715       20.16239 0.47 
1 1 1 -45 11 12 f 45.97251 10.97846 60.15786  234.4 -24.78878      21.95691 0.00 
1 1 1 -45 11 13 o 144.9163 4.631389 244.9753  187.2 -2.284439      9.262777 0.98 
1 1 1 -45 11 14 o 104.9310 5.525853 178.7097  185.2 5.798134       11.05171 0.97 
1 1 1 -45 11 15 o 46.02660 10.89766 24.84641  57.2  7.915146       21.79533 0.44 
1 1 1 -45 11 16 o 45.90155 10.82421 75.85081  84.4  14.81435       21.64841 0.82 
1 1 1 -45 11 17 o 29.82166 9.263026 11.96080  1.6   -8.992769      18.52605 0.18 
1 1 1 -45 11 18 o 56.66150 9.490977 43.16666  278.1 -44.06373      18.98195 0.79 
1 1 1 -45 11 19 o 36.29340 10.79961 48.53128  134.0 2.516140       21.59922 0.70 
1 1 1 -45 11 20 o 35.37429 10.59219 80.55484  359.8 5.265831       21.18438 0.85 
1 1 1 -45 11 21 o 44.90248 10.75698 73.54956  196.3 -7.229111      21.51396 0.87 
1 1 1 -45 11 22 o 55.35139 10.21839 83.92325  190.8 -19.92482      20.43678 0.91 
1 1 1 -45 11 23 o 41.99916 10.44882 62.27668  208.9 -7.937988      20.89764 0.83 
1 1 1 -45 11 24 o 34.91514 10.12560 57.54485  93.4  5.227837       20.25119 0.79 
1 1 1 -45 11 25 o 34.77902 10.10571 26.51027  110.1 ?              ?        0.56 
1 1 1 -45 11 26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -45 13 1  o 44.03145 11.04761 38.07349  190.8 19.53656       22.09522 0.70 
1 1 1 -45 13 2  f 46.04309 10.78924 54.91477  23.2  -6.314148      21.57847 0.00 
1 1 1 -45 13 3  o 43.89655 9.829042 46.79013  48.7  41.28592       19.65808 0.78 
1 1 1 -45 13 4  o 94.24191 7.064407 124.8017  289.6 -10.75958      14.12881 0.97 
1 1 1 -45 13 5  o 40.55828 11.01393 49.27674  358.0 17.80045       22.02787 0.76 
1 1 1 -45 13 6  o 98.96529 7.029735 183.3631  142.3 7.905846       14.05947 0.98 
1 1 1 -45 13 7  o 108.8198 7.184707 167.5101  160.0 -5.278770      14.36941 0.98 
1 1 1 -45 13 8  o 54.14074 11.93784 49.85742  62.8  -9.955570      23.87568 0.82 
1 1 1 -45 13 9  o 89.68314 8.532670 145.3190  250.9 27.41563       17.06534 0.97 
1 1 1 -45 13 10 o 124.1652 6.029660 178.8475  254.8 -10.28764      12.05932 0.99 
1 1 1 -45 13 11 o 45.95155 11.75526 19.89722  205.1 15.15653       23.51052 0.48 
1 1 1 -45 13 12 o 54.74323 12.09146 93.65727  52.8  -10.87423      24.18293 0.91 
1 1 1 -45 13 13 o 32.17165 10.19988 44.64682  248.6 -3.036314      20.39975 0.67 
1 1 1 -45 13 14 o 44.93946 11.49928 26.15244  276.7 10.47114       22.99856 0.58 
1 1 1 -45 13 15 o 46.83046 10.50257 124.4614  144.1 32.43951       21.00514 0.93 
1 1 1 -45 13 16 o 39.58794 11.10562 33.32987  130.9 7.444500       22.21125 0.64 
1 1 1 -45 13 17 o 63.84852 10.00529 105.3261  198.3 33.66943       20.01057 0.94 
1 1 1 -45 13 18 o 46.66444 11.76736 98.35934  171.4 12.34502       23.53471 0.91 
1 1 1 -45 13 19 o 45.21704 12.53930 67.70229  143.1 ?              ?        0.86 
1 1 1 -45 13 20 o 43.08595 11.48353 91.44115  257.2 ?              ?        0.91 
1 1 1 -44 0  1  o 165.9370 4.456016 384.1273  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  2  o 99.72864 5.929863 63.34420  0.0   -0.000000      0.000000 0.77 
1 1 1 -44 0  3  o 145.0869 5.040253 117.4731  180.0 -0.000000      0.000000 0.99 
1 1 1 -44 0  4  o 26.06473 15.51180 53.19759  0.0   -0.000000      0.000000 0.18 
1 1 1 -44 0  5  o 231.7301 5.611181 340.2652  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  6  o 122.8107 6.705039 206.5027  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  7  o 234.4828 5.240456 317.8710  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  8  o 289.6268 5.840187 355.0928  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  9  o 172.4019 5.480852 91.47500  360.0 -0.000000      0.000000 0.99 
1 1 1 -44 0  10 o 169.8146 6.145718 201.9878  0.0   -0.000000      0.000000 1.00 
1 1 1 -44 0  11 o 45.17817 19.26415 65.86564  360.0 -0.000000      0.000000 0.46 
1 1 1 -44 0  12 o 599.6379 8.547698 910.7134  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  13 o 297.2047 5.720776 340.3784  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  14 o 231.1766 5.663311 380.2210  0.0   -0.000000      0.000000 1.00 
1 1 1 -44 0  15 o 184.4035 5.412439 261.4464  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  16 o 82.17339 8.383512 75.90386  360.0 -0.000000      0.000000 0.70 
1 1 1 -44 0  17 f 35.72362 17.53437 64.99830  180.0 -0.000000      0.000000 0.00 
1 1 1 -44 0  18 o 291.7087 5.553817 496.9582  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  19 o 34.93026 15.39941 28.72149  180.0 -0.000000      0.000000 0.17 
1 1 1 -44 0  20 o 51.51361 13.41492 64.94563  0.0   -0.000000      0.000000 0.63 
1 1 1 -44 0  21 o 120.6198 5.854830 137.9764  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  22 o 260.5562 5.296006 428.2435  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  23 o 126.2369 5.661131 150.1354  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  24 o 31.41038 15.29939 13.26149  180.0 -0.000000      0.000000 0.13 
1 1 1 -44 0  25 o 93.35938 7.034028 210.3005  180.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  26 o 77.67343 8.176941 65.91303  0.0   -0.000000      0.000000 0.95 
1 1 1 -44 0  27 o 40.66476 15.73044 4.795315  180.0 -0.000000      0.000000 0.05 
1 1 1 -44 0  28 o 26.97880 15.86526 7.523994  180.0 -0.000000      0.000000 0.06 
1 1 1 -44 0  29 o 147.3463 5.814618 199.6887  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  30 o 154.5228 6.238592 154.7074  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  31 o 39.15161 18.64062 30.06476  0.0   -0.000000      0.000000 0.48 
1 1 1 -44 0  32 o 94.82854 8.867394 159.6971  360.0 -0.000000      0.000000 1.00 
1 1 1 -44 0  33 o 58.22443 17.86539 92.65932  360.0 -0.000000      0.000000 0.99 
1 1 1 -44 0  34 o 36.30407 19.54324 92.42480  180.0 -0.000000      0.000000 0.94 
1 1 1 -44 0  35 o 67.35812 14.44723 110.1787  180.0 ?              ?        1.00 
1 1 1 -44 2  1  o 81.26340 5.746116 110.3202  114.0 12.31241       11.49223 0.77 
1 1 1 -44 2  2  o 188.3689 3.369696 217.5439  227.5 0.4723053      6.739392 0.96 
1 1 1 -44 2  3  o 279.1473 3.449134 398.2375  82.3  -0.3327637     6.898268 0.98 
1 1 1 -44 2  4  o 174.4036 3.846679 192.0588  34.5  -18.46204      7.693359 0.94 
1 1 1 -44 2  5  o 163.8976 3.436153 224.9250  43.9  19.12083       6.872306 0.95 
1 1 1 -44 2  6  o 294.3341 3.716941 495.7113  244.3 -14.70889      7.433882 0.99 
1 1 1 -44 2  7  o 380.2565 4.475247 548.8008  168.8 6.036102       8.950495 0.99 
1 1 1 -44 2  8  o 265.6735 3.967879 317.1524  122.7 -4.382874      7.935758 0.98 
1 1 1 -44 2  9  o 117.7652 4.883734 219.9384  232.6 -8.701202      9.767468 0.93 
1 1 1 -44 2  10 o 138.3070 4.454475 182.1646  204.4 -9.531082      8.908950 0.93 
1 1 1 -44 2  11 o 150.8970 4.255321 295.3739  32.8  2.211548       8.510641 0.96 
1 1 1 -44 2  12 o 164.8588 4.121697 239.1552  191.8 -26.50716      8.243394 0.95 
1 1 1 -44 2  13 o 77.10857 6.800878 129.9976  282.5 11.49602       13.60176 0.82 
1 1 1 -44 2  14 o 313.5368 4.040122 453.2162  33.9  18.84686       8.080243 0.99 
1 1 1 -44 2  15 o 80.04800 6.496324 159.7365  345.9 -17.50739      12.99265 0.85 
1 1 1 -44 2  16 o 47.83025 9.413528 209.1615  293.1 -9.187260      18.82706 0.80 
1 1 1 -44 2  17 o 151.6634 4.002539 205.9297  19.5  4.567505       8.005077 0.95 
1 1 1 -44 2  18 o 68.20277 6.039433 126.9796  5.2   4.771759       12.07887 0.83 
1 1 1 -44 2  19 o 104.8561 5.187507 137.9407  55.8  40.65617       10.37501 0.92 
1 1 1 -44 2  20 o 31.13260 8.640733 147.1186  32.2  -9.503633      17.28147 0.72 
1 1 1 -44 2  21 o 175.1165 3.837597 258.5351  349.3 -13.23058      7.675195 0.98 
1 1 1 -44 2  22 o 183.7403 3.975032 225.9246  347.3 -34.46681      7.950064 0.98 
1 1 1 -44 2  23 o 87.83707 5.280244 196.4006  352.0 -4.524193      10.56049 0.95 
1 1 1 -44 2  24 o 117.6327 4.579481 180.2072  214.0 -3.850578      9.158962 0.97 
1 1 1 -44 2  25 o 131.2301 4.368075 221.2462  186.2 -8.472168      8.736151 0.98 
1 1 1 -44 2  26 o 86.55365 6.828896 146.3005  94.1  -5.980377      13.65779 0.94 
1 1 1 -44 2  27 o 151.3967 4.117816 258.0010  126.7 28.25218       8.235632 0.98 
1 1 1 -44 2  28 o 55.26865 8.964578 56.40388  236.0 -23.38023      17.92916 0.69 
1 1 1 -44 2  29 o 75.84809 7.917653 133.5974  30.2  14.85732       15.83531 0.93 
1 1 1 -44 2  30 o 58.90288 10.46035 50.63765  141.4 5.314762       20.92071 0.77 
1 1 1 -44 2  31 o 84.95348 6.688058 136.6690  222.6 -5.483490      13.37612 0.96 
1 1 1 -44 2  32 o 37.44896 10.03805 57.04729  261.0 28.85543       20.07611 0.77 
1 1 1 -44 2  33 f 90.28540 6.797482 80.33982  43.3  -4.860191      13.59496 0.00 
1 1 1 -44 2  34 o 33.08974 10.02248 98.37762  112.8 2.959747       20.04497 0.87 
1 1 1 -44 2  35 o 46.87378 11.39719 83.77460  111.2 ?              ?        0.90 
1 1 1 -44 4  1  o 91.00977 5.223575 190.7881  216.6 24.96184       10.44715 0.90 
1 1 1 -44 4  2  o 219.8726 3.581699 226.7471  70.0  19.18571       7.163397 0.97 
1 1 1 -44 4  3  o 324.5052 3.639176 366.6158  295.3 -5.261108      7.278353 0.99 
1 1 1 -44 4  4  o 79.90941 5.509213 125.1843  204.3 18.22128       11.01843 0.80 
1 1 1 -44 4  5  f 142.4689 3.827828 131.1976  319.6 -31.93272      7.655655 0.00 
1 1 1 -44 4  6  o 67.26955 7.295535 53.21098  138.8 29.33755       14.59107 0.39 
1 1 1 -44 4  7  o 185.2466 3.502898 328.3803  350.9 4.783249       7.005797 0.97 
1 1 1 -44 4  8  o 69.92610 6.470494 192.6572  96.3  -23.87836      12.94099 0.86 
1 1 1 -44 4  9  o 99.92845 5.000722 133.8894  173.1 -35.72276      10.00144 0.86 
1 1 1 -44 4  10 o 51.29731 7.055666 74.86642  206.4 -59.55609      14.11133 0.51 
1 1 1 -44 4  11 o 122.7211 4.719705 302.3249  47.8  -29.29182      9.439410 0.95 
1 1 1 -44 4  12 o 149.4036 4.382640 235.2794  257.5 1.100433       8.765280 0.95 
1 1 1 -44 4  13 f 90.66914 5.672017 159.1340  282.7 -2.004051      11.34403 0.00 
1 1 1 -44 4  14 o 233.8780 3.948983 411.8255  35.8  17.57657       7.897965 0.98 
1 1 1 -44 4  15 o 54.61344 9.697378 56.20905  282.3 -10.93516      19.39476 0.48 
1 1 1 -44 4  16 o 143.0265 4.518323 240.6449  213.5 9.216476       9.036646 0.96 
1 1 1 -44 4  17 o 98.41389 5.028582 191.7785  128.2 5.820007       10.05716 0.94 
1 1 1 -44 4  18 o 70.12857 7.373499 75.78267  193.7 10.53757       14.74700 0.77 
1 1 1 -44 4  19 o 154.4570 3.861889 209.3655  216.8 -12.00276      7.723778 0.97 
1 1 1 -44 4  20 o 184.1261 5.168740 314.4074  318.2 -2.795059      10.33748 0.98 
1 1 1 -44 4  21 o 63.72279 7.684127 111.0302  112.9 -5.481052      15.36825 0.86 
1 1 1 -44 4  22 o 124.9896 4.008926 172.4154  148.6 33.58585       8.017852 0.97 
1 1 1 -44 4  23 o 42.40597 9.615682 37.80450  275.9 2.089912       19.23136 0.52 
1 1 1 -44 4  24 o 61.60705 7.330474 62.48189  44.5  10.09000       14.66095 0.80 
1 1 1 -44 4  25 o 103.3443 5.724384 136.0884  335.5 6.466209       11.44877 0.94 
1 1 1 -44 4  26 o 164.0294 4.221684 225.0824  35.2  -6.565765      8.443367 0.98 
1 1 1 -44 4  27 f 123.6137 5.057079 142.5323  275.1 -3.628647      10.11416 0.00 
1 1 1 -44 4  28 o 91.31119 7.624467 135.2448  303.0 -14.51983      15.24893 0.94 
1 1 1 -44 4  29 o 59.17247 9.829804 68.33009  336.4 13.88633       19.65961 0.84 
1 1 1 -44 4  30 f 48.36286 10.66398 77.16692  260.2 -8.575512      21.32796 0.00 
1 1 1 -44 4  31 o 137.9254 4.994818 202.6466  285.4 -3.705643      9.989635 0.99 
1 1 1 -44 4  32 o 39.87448 10.14641 26.99996  239.7 -12.62204      20.29281 0.54 
1 1 1 -44 4  33 o 51.88554 10.97376 89.93092  172.7 -18.37992      21.94753 0.91 
1 1 1 -44 4  34 f 56.60329 10.96449 22.40097  221.5 ?              ?        0.00 
1 1 1 -44 6  1  o 249.0959 3.430701 312.7601  38.4  -4.542099      6.861403 0.99 
1 1 1 -44 6  2  o 45.67875 9.076717 56.67364  116.2 19.60816       18.15343 0.50 
1 1 1 -44 6  3  o 160.9334 3.648345 234.8164  342.9 -38.34810      7.296690 0.97 
1 1 1 -44 6  4  o 133.5184 3.840404 185.8904  63.3  0.4933624      7.680808 0.95 
1 1 1 -44 6  5  o 308.2599 3.568680 388.1758  67.2  -16.58142      7.137360 0.99 
1 1 1 -44 6  6  f 160.3974 3.733518 174.9926  76.5  -35.41249      7.467036 0.00 
1 1 1 -44 6  7  o 147.1604 3.934794 210.3360  304.2 -13.67688      7.869588 0.96 
1 1 1 -44 6  8  o 64.57963 6.786013 212.9049  271.5 -10.10557      13.57203 0.90 
1 1 1 -44 6  9  o 309.3304 3.814176 472.4290  116.8 11.57690       7.628351 0.99 
1 1 1 -44 6  10 o 95.17308 6.422794 130.9511  90.5  -8.978432      12.84559 0.90 
1 1 1 -44 6  11 o 33.29706 8.637011 10.65937  57.8  -24.37754      17.27402 0.07 
1 1 1 -44 6  12 o 95.20285 5.289474 172.3316  119.8 -2.947350      10.57895 0.93 
1 1 1 -44 6  13 o 175.9856 4.046963 307.4681  101.9 32.93584       8.093925 0.98 
1 1 1 -44 6  14 o 157.3802 5.486486 236.4243  25.9  6.244171       10.97297 0.97 
1 1 1 -44 6  15 o 227.2776 4.087315 414.7082  6.3   42.33455       8.174629 0.99 
1 1 1 -44 6  16 o 260.7862 4.217619 394.5897  212.2 5.468384       8.435239 0.99 
1 1 1 -44 6  17 o 107.9097 5.419643 206.4861  137.3 -11.04999      10.83929 0.96 
1 1 1 -44 6  18 o 67.14696 7.243272 105.3622  336.2 29.63842       14.48654 0.87 
1 1 1 -44 6  19 o 74.25801 7.477800 130.5264  296.7 -17.58266      14.95560 0.92 
1 1 1 -44 6  20 o 47.93404 9.539862 86.10673  353.5 10.50524       19.07972 0.81 
1 1 1 -44 6  21 o 43.73946 9.012089 101.1356  238.3 16.01437       18.02418 0.85 
1 1 1 -44 6  22 o 43.87611 9.257812 80.20985  314.9 29.81389       18.51562 0.76 
1 1 1 -44 6  23 o 58.26254 8.555781 101.9474  151.4 11.44773       17.11156 0.85 
1 1 1 -44 6  24 o 83.23500 6.074278 147.9545  209.7 -5.348846      12.14856 0.93 
1 1 1 -44 6  25 o 109.5629 5.200456 199.9145  278.7 3.738380       10.40091 0.97 
1 1 1 -44 6  26 o 27.73297 8.880083 75.05389  29.9  10.89265       17.76017 0.60 
1 1 1 -44 6  27 o 85.71149 6.493442 149.8719  176.7 6.902756       12.98688 0.96 
1 1 1 -44 6  28 o 81.90376 7.899218 140.8095  175.1 4.351944       15.79844 0.96 
1 1 1 -44 6  29 o 28.96817 9.420881 40.76460  148.9 19.64994       18.84176 0.58 
1 1 1 -44 6  30 o 46.53045 10.42860 68.10349  232.7 36.67592       20.85719 0.86 
1 1 1 -44 6  31 o 50.33928 11.39052 60.90135  325.4 23.55480       22.78104 0.84 
1 1 1 -44 6  32 o 38.47179 10.01044 38.08042  245.9 -8.395069      20.02088 0.69 
1 1 1 -44 6  33 o 45.60361 12.36534 73.85510  175.0 ?              ?        0.88 
1 1 1 -44 8  1  o 128.4466 3.992087 146.5693  3.7   -0.4250336     7.984175 0.96 
1 1 1 -44 8  2  o 104.3794 5.247749 118.7286  323.7 14.85223       10.49550 0.94 
1 1 1 -44 8  3  o 106.8379 4.593768 187.0044  244.3 15.38972       9.187536 0.96 
1 1 1 -44 8  4  o 146.8803 4.863810 228.3038  148.7 6.333450       9.727619 0.97 
1 1 1 -44 8  5  o 63.75568 8.331453 139.8254  176.0 44.43079       16.66291 0.89 
1 1 1 -44 8  6  o 50.53496 8.259147 52.44444  299.4 37.06077       16.51829 0.58 
1 1 1 -44 8  7  o 146.4702 4.084225 251.0239  92.3  -1.108627      8.168449 0.98 
1 1 1 -44 8  8  o 51.39870 10.41258 142.7215  200.1 5.821598       20.82516 0.86 
1 1 1 -44 8  9  o 115.4442 4.409068 179.3401  303.6 -9.561852      8.818136 0.96 
1 1 1 -44 8  10 o 263.0519 3.505224 401.9179  337.8 -12.80646      7.010449 0.99 
1 1 1 -44 8  11 o 57.22786 8.874994 74.74007  27.7  4.027836       17.74999 0.76 
1 1 1 -44 8  12 o 209.0465 3.761446 351.3032  121.3 3.818008       7.522891 0.99 
1 1 1 -44 8  13 o 56.88693 8.861328 87.78529  158.4 5.514767       17.72266 0.82 
1 1 1 -44 8  14 o 72.15662 7.327166 134.0178  183.6 11.01621       14.65433 0.92 
1 1 1 -44 8  15 o 70.56055 6.956385 88.58234  244.8 2.563118       13.91277 0.89 
1 1 1 -44 8  16 o 138.6982 4.432364 197.5412  108.5 12.60895       8.864729 0.98 
1 1 1 -44 8  17 o 30.05890 9.277591 74.19246  73.7  -5.886534      18.55518 0.65 
1 1 1 -44 8  18 o 222.2291 4.121030 311.9721  309.2 -12.81197      8.242060 0.99 
1 1 1 -44 8  19 o 141.9510 4.812171 196.1559  224.7 4.932144       9.624343 0.97 
1 1 1 -44 8  20 o 21.95997 7.448578 23.46606  45.0  8.698416       14.89716 0.15 
1 1 1 -44 8  21 o 47.06960 9.282118 119.4885  12.1  -25.56865      18.56424 0.84 
1 1 1 -44 8  22 o 61.62261 9.011456 89.19395  264.5 -10.39048      18.02291 0.85 
1 1 1 -44 8  23 f 156.7104 4.852406 176.0623  194.7 14.87808       9.704811 0.00 
1 1 1 -44 8  24 o 152.3292 4.428329 232.9290  138.0 14.19559       8.856657 0.98 
1 1 1 -44 8  25 o 150.5793 4.397411 249.1183  21.1  -7.667923      8.794822 0.99 
1 1 1 -44 8  26 o 201.4660 4.435557 322.5591  17.0  -15.41577      8.871114 0.99 
1 1 1 -44 8  27 o 53.13573 10.71766 96.24155  10.0  8.802567       21.43533 0.92 
1 1 1 -44 8  28 o 34.17270 10.07797 88.31032  314.0 -0.6282310     20.15593 0.85 
1 1 1 -44 8  29 o 29.77449 9.503745 17.32636  311.8 2.403570       19.00749 0.32 
1 1 1 -44 8  30 o 48.32629 11.24270 75.26939  230.9 -1.434376      22.48541 0.89 
1 1 1 -44 8  31 o 44.87870 10.43796 95.90763  333.0 ?              ?        0.92 
1 1 1 -44 10 1  o 30.38184 9.271199 15.40686  263.7 -3.258446      18.54240 0.14 
1 1 1 -44 10 2  o 59.14142 10.57225 77.93048  215.6 9.446072       21.14450 0.78 
1 1 1 -44 10 3  o 100.3907 6.008097 195.7839  73.8  -0.2853317     12.01619 0.96 
1 1 1 -44 10 4  o 50.28529 10.48869 34.29166  324.6 27.65760       20.97738 0.44 
1 1 1 -44 10 5  o 75.50906 8.756842 86.48903  272.5 -10.64019      17.51368 0.86 
1 1 1 -44 10 6  o 200.6813 3.763896 245.3913  270.5 1.808578       7.527791 0.98 
1 1 1 -44 10 7  o 97.47719 5.265121 170.2018  351.0 9.130379       10.53024 0.95 
1 1 1 -44 10 8  o 60.75640 8.165204 77.04961  3.1   2.028877       16.33041 0.81 
1 1 1 -44 10 9  o 78.72242 7.256677 109.5721  324.5 -9.941437      14.51335 0.91 
1 1 1 -44 10 10 o 57.99195 9.215879 89.45679  124.4 -2.015663      18.43176 0.83 
1 1 1 -44 10 11 o 42.19316 10.44743 53.88844  173.4 -13.38729      20.89485 0.56 
1 1 1 -44 10 12 o 59.26971 8.369658 110.3070  307.2 44.80857       16.73932 0.86 
1 1 1 -44 10 13 o 229.6109 3.564086 377.4910  283.5 6.831680       7.128173 0.99 
1 1 1 -44 10 14 o 167.0358 4.560686 265.4731  264.7 -12.66029      9.121371 0.98 
1 1 1 -44 10 15 o 130.4664 5.056608 190.7359  261.6 -11.72559      10.11322 0.97 
1 1 1 -44 10 16 o 104.4174 5.492788 154.9975  295.0 36.90485       10.98558 0.96 
1 1 1 -44 10 17 o 33.81031 9.993417 13.50506  127.7 -4.022482      19.98683 0.15 
1 1 1 -44 10 18 o 127.6988 4.819509 209.5139  272.6 13.99441       9.639018 0.98 
1 1 1 -44 10 19 o 134.7838 4.594023 181.9496  291.6 10.89908       9.188046 0.98 
1 1 1 -44 10 20 o 31.82122 9.756322 69.58000  108.0 3.998816       19.51264 0.70 
1 1 1 -44 10 21 o 120.4306 5.945264 194.8820  131.3 -26.10543      11.89053 0.98 
1 1 1 -44 10 22 o 131.1797 5.054173 188.0323  220.3 -4.548187      10.10835 0.98 
1 1 1 -44 10 23 o 56.56367 9.841543 108.1511  249.5 1.003689       19.68309 0.93 
1 1 1 -44 10 24 o 35.68279 8.957401 73.05190  286.8 -18.92724      17.91480 0.84 
1 1 1 -44 10 25 o 33.38082 9.686913 36.66368  194.7 -2.509121      19.37383 0.61 
1 1 1 -44 10 26 o 95.40015 15.01049 155.3472  103.3 ?              ?        0.97 
1 1 1 -44 10 27 o 39.64061 10.90774 95.02979  102.0 0.6707802      21.81548 0.90 
1 1 1 -44 10 28 o 41.86365 11.24434 70.95164  269.6 ?              ?        0.87 
1 1 1 -44 12 1  o 59.57618 10.18148 41.70815  325.0 -0.3081703     20.36296 0.78 
1 1 1 -44 12 2  o 80.20900 7.845631 115.9044  317.3 2.608444       15.69126 0.95 
1 1 1 -44 12 3  f 67.12282 9.049191 65.61417  236.8 0.3074646E-02  18.09838 0.00 
1 1 1 -44 12 4  o 47.84834 11.57466 22.48933  147.1 2.738541       23.14931 0.44 
1 1 1 -44 12 5  o 83.88647 6.762789 96.24709  66.9  15.30120       13.52558 0.94 
1 1 1 -44 12 6  o 89.18294 7.802645 168.6461  125.2 14.65614       15.60529 0.97 
1 1 1 -44 12 7  o 133.3189 6.122241 216.6508  208.9 -6.134171      12.24448 0.98 
1 1 1 -44 12 8  o 175.3957 4.736457 252.4401  312.4 6.414917       9.472915 0.99 
1 1 1 -44 12 9  f 65.40884 10.50229 123.7624  358.7 -14.69458      21.00458 0.00 
1 1 1 -44 12 10 o 59.62025 10.27844 107.6926  232.4 8.079777       20.55688 0.91 
1 1 1 -44 12 11 o 61.09406 11.58805 58.81985  277.1 -1.975819      23.17610 0.83 
1 1 1 -44 12 12 o 74.22117 8.260658 103.1522  347.0 -21.06074      16.52132 0.94 
1 1 1 -44 12 13 o 63.63563 9.623315 79.81594  237.0 -6.442551      19.24663 0.90 
1 1 1 -44 12 14 o 106.4743 6.759768 164.7768  278.4 -7.770187      13.51954 0.98 
1 1 1 -44 12 15 o 35.03704 10.72288 24.02121  54.3  -4.344124      21.44576 0.42 
1 1 1 -44 12 16 o 55.73058 11.21587 142.3433  301.0 16.27215       22.43175 0.94 
1 1 1 -44 12 17 o 33.07298 9.987819 75.08067  282.8 12.23359       19.97564 0.83 
1 1 1 -44 12 18 o 66.50439 10.20640 133.4275  204.8 -8.132637      20.41281 0.96 
1 1 1 -44 12 19 o 35.05309 10.19975 59.33143  186.2 -13.02761      20.39949 0.78 
1 1 1 -44 12 20 o 44.45880 10.40816 87.55229  359.0 -19.16010      20.81631 0.89 
1 1 1 -44 12 21 o 44.94682 11.46006 39.54057  128.3 24.29011       22.92011 0.73 
1 1 1 -44 12 22 o 33.69527 9.806443 22.57828  11.8  -9.270498      19.61289 0.48 
1 1 1 -44 12 23 o 42.52099 9.953349 76.96733  337.0 ?              ?        0.89 
1 1 1 -44 12 24 x ?        ?        127.6250  125.5 ?              ?        0.00 
1 1 1 -44 14 1  o 62.20380 11.03955 82.87130  36.8  ?              ?        0.93 
1 1 1 -44 14 2  o 41.01539 10.89634 60.34069  39.2  -3.802586      21.79269 0.83 
1 1 1 -44 14 3  o 33.37800 10.31059 13.16718  173.0 9.081408       20.62118 0.29 
1 1 1 -44 14 4  o 47.59835 11.79323 43.21014  274.2 -16.26342      23.58645 0.77 
1 1 1 -44 14 5  o 52.59264 10.85876 84.57059  286.8 -23.18895      21.71751 0.91 
1 1 1 -44 14 6  o 33.02743 10.49217 49.08236  267.5 -7.973923      20.98434 0.72 
1 1 1 -44 14 7  o 98.25888 7.438316 138.6548  268.1 15.68172       14.87663 0.98 
1 1 1 -44 14 8  o 28.59942 9.450695 31.85042  22.4  3.108685       18.90139 0.54 
1 1 1 -44 14 9  o 85.81482 10.73572 158.0608  128.8 23.05785       21.47145 0.97 
1 1 1 -44 14 10 o 55.11163 12.45197 117.3287  200.5 -13.76246      24.90393 0.93 
1 1 1 -44 14 11 o 34.18184 10.77135 30.61272  193.8 6.415983       21.54271 0.57 
1 1 1 -44 14 12 o 43.07786 12.14653 108.9836  108.8 7.170578       24.29306 0.91 
1 1 1 -44 14 13 o 33.09995 10.53586 63.59975  177.0 -6.800350      21.07172 0.81 
1 1 1 -44 14 14 o 42.44290 12.48410 4.487370  146.4 ?              ?        0.12 
1 1 1 -44 14 15 o 46.45726 12.09421 19.56176  117.3 ?              ?        0.52 
1 1 1 -44 14 16 o 50.80659 12.55011 64.41789  140.4 ?              ?        0.88 
1 1 1 -44 14 17 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -43 1  1  o 199.2197 3.140677 278.0732  335.0 -7.206467      6.281353 0.97 
1 1 1 -43 1  2  o 62.99211 7.338230 82.62794  186.7 -46.37729      14.67646 0.61 
1 1 1 -43 1  3  o 203.9380 3.560884 380.1006  177.8 -0.7187042     7.121769 0.97 
1 1 1 -43 1  4  o 290.7355 3.595929 388.9590  175.7 20.26810       7.191857 0.98 
1 1 1 -43 1  5  o 62.28855 7.508106 112.8643  1.0   -7.370380      15.01621 0.53 
1 1 1 -43 1  6  o 170.8981 3.916925 158.4900  19.5  -9.766495      7.833850 0.91 
1 1 1 -43 1  7  o 171.1435 3.967740 170.4810  272.7 8.167953       7.935480 0.92 
1 1 1 -43 1  8  o 86.49777 6.295630 63.13683  294.7 0.6578827      12.59126 0.45 
1 1 1 -43 1  9  o 387.9833 4.541440 558.6959  187.0 -15.06155      9.082879 0.99 
1 1 1 -43 1  10 o 168.9968 4.000967 301.7444  124.7 6.417435       8.001934 0.96 
1 1 1 -43 1  11 o 605.6312 6.028248 822.4341  27.2  -7.735474      12.05650 1.00 
1 1 1 -43 1  12 o 170.6198 4.182342 169.1220  19.3  22.04251       8.364684 0.94 
1 1 1 -43 1  13 o 210.2818 3.887417 318.4362  220.0 17.51955       7.774834 0.98 
1 1 1 -43 1  14 o 246.7213 3.928127 375.1285  316.9 2.344803       7.856253 0.98 
1 1 1 -43 1  15 o 155.1770 3.628010 246.8106  64.3  -26.57802      7.256020 0.96 
1 1 1 -43 1  16 o 401.7260 4.757710 590.7025  122.2 21.22757       9.515419 0.99 
1 1 1 -43 1  17 o 97.30713 4.807491 115.0404  343.9 -14.59886      9.614982 0.84 
1 1 1 -43 1  18 o 75.04192 6.625771 99.94949  252.4 -4.600677      13.25154 0.74 
1 1 1 -43 1  19 o 145.1400 3.822904 213.6632  208.8 -21.45621      7.645809 0.96 
1 1 1 -43 1  20 o 249.6998 3.830802 340.0334  159.8 19.67168       7.661604 0.99 
1 1 1 -43 1  21 o 76.51883 5.065360 71.12204  48.7  1.912697       10.13072 0.78 
1 1 1 -43 1  22 o 200.7881 3.582719 319.7333  185.5 -19.03407      7.165439 0.99 
1 1 1 -43 1  23 o 75.78706 5.639990 82.00311  194.6 5.296074       11.27998 0.84 
1 1 1 -43 1  24 o 35.21530 9.519246 49.35250  244.8 0.1395836      19.03849 0.47 
1 1 1 -43 1  25 o 53.45830 8.294143 114.1975  189.2 -27.63965      16.58829 0.89 
1 1 1 -43 1  26 o 165.0284 3.985395 157.4491  169.8 -23.61223      7.970789 0.97 
1 1 1 -43 1  27 o 148.8357 4.192084 209.2053  94.0  -11.05560      8.384169 0.97 
1 1 1 -43 1  28 o 34.74081 10.39211 30.33443  9.8   -7.962116      20.78421 0.29 
1 1 1 -43 1  29 o 99.07035 5.806242 142.8837  111.1 -20.23264      11.61248 0.95 
1 1 1 -43 1  30 o 34.92727 10.90961 11.95673  100.0 -4.752129      21.81922 0.16 
1 1 1 -43 1  31 o 38.86265 9.816522 83.19470  232.9 16.68081       19.63304 0.82 
1 1 1 -43 1  32 o 102.9606 5.986633 124.6608  121.0 -6.652550      11.97327 0.97 
1 1 1 -43 1  33 o 73.20357 9.196861 109.4259  152.9 2.486427       18.39372 0.95 
1 1 1 -43 1  34 o 68.63660 8.970104 90.44307  206.5 -14.46428      17.94021 0.94 
1 1 1 -43 1  35 o 93.41536 7.670523 118.3581  152.3 ?              ?        0.97 
1 1 1 -43 3  1  f 242.5181 3.244238 258.2480  32.4  -36.05026      6.488476 0.00 
1 1 1 -43 3  2  o 117.3081 3.876277 128.1918  157.7 -23.01096      7.752553 0.86 
1 1 1 -43 3  3  o 254.5965 3.539786 381.3392  224.6 8.119324       7.079572 0.98 
1 1 1 -43 3  4  o 232.3769 3.254197 325.5250  313.5 31.85664       6.508394 0.98 
1 1 1 -43 3  5  o 467.7399 4.550792 598.8916  17.7  -5.255341      9.101583 0.99 
1 1 1 -43 3  6  o 174.3230 3.523432 190.8395  311.8 53.03033       7.046864 0.95 
1 1 1 -43 3  7  o 406.3897 4.120880 573.8572  210.2 47.03522       8.241760 0.99 
1 1 1 -43 3  8  o 251.7277 3.959424 362.2758  127.0 -18.28233      7.918849 0.98 
1 1 1 -43 3  9  o 179.2768 3.991521 248.8955  81.6  -3.877457      7.983041 0.96 
1 1 1 -43 3  10 f 247.8143 3.826432 305.2305  186.6 -27.42693      7.652864 0.00 
1 1 1 -43 3  11 f 368.9160 4.501331 571.9435  143.3 17.41714       9.002663 0.00 
1 1 1 -43 3  12 o 176.1211 3.806230 210.1044  184.7 -31.17847      7.612460 0.95 
1 1 1 -43 3  13 o 95.85912 5.545082 233.2536  178.4 -12.99706      11.09016 0.92 
1 1 1 -43 3  14 o 259.5034 4.052976 336.2982  40.9  -4.817474      8.105951 0.98 
1 1 1 -43 3  15 o 86.06493 5.626369 89.86955  346.6 -19.98591      11.25274 0.74 
1 1 1 -43 3  16 o 171.8399 4.003758 203.5179  177.4 -19.24919      8.007517 0.95 
1 1 1 -43 3  17 o 68.82320 6.900434 57.86064  152.7 -23.03540      13.80087 0.55 
1 1 1 -43 3  18 o 138.7701 4.396498 226.4500  316.0 -46.32072      8.792996 0.96 
1 1 1 -43 3  19 o 28.58115 8.941858 65.34157  133.5 13.12736       17.88372 0.37 
1 1 1 -43 3  20 o 200.3515 3.481904 287.0736  328.6 15.40700       6.963808 0.98 
1 1 1 -43 3  21 o 236.4738 3.743385 312.1290  34.1  -19.68497      7.486770 0.99 
1 1 1 -43 3  22 o 91.51001 5.033469 127.0740  273.3 -12.00737      10.06694 0.92 
1 1 1 -43 3  23 o 91.10681 6.761650 145.4914  271.9 -4.319931      13.52330 0.94 
1 1 1 -43 3  24 o 61.61983 7.150392 117.8221  267.1 -2.510799      14.30078 0.90 
1 1 1 -43 3  25 o 57.59219 8.757633 92.39558  202.1 -33.51918      17.51527 0.86 
1 1 1 -43 3  26 o 95.80367 5.723876 155.5714  328.7 23.10357       11.44775 0.95 
1 1 1 -43 3  27 o 157.9468 4.295953 190.4735  114.2 14.49715       8.591906 0.97 
1 1 1 -43 3  28 o 141.5464 4.658859 231.6666  34.0  -3.249985      9.317718 0.98 
1 1 1 -43 3  29 o 69.53843 9.180338 107.7986  28.5  -16.79512      18.36068 0.90 
1 1 1 -43 3  30 o 37.39722 10.41787 98.24310  93.9  5.338188       20.83574 0.83 
1 1 1 -43 3  31 o 122.1967 5.340067 159.3748  241.4 -4.279137      10.68013 0.98 
1 1 1 -43 3  32 o 84.88849 6.573594 133.1211  122.9 23.73123       13.14719 0.97 
1 1 1 -43 3  33 o 167.3396 4.847039 199.2570  92.1  12.97183       9.694077 0.99 
1 1 1 -43 3  34 o 49.25967 11.72869 50.73793  359.6 0.6677513      23.45738 0.81 
1 1 1 -43 3  35 o 62.26456 14.14469 134.8160  298.1 ?              ?        0.95 
1 1 1 -43 5  1  o 206.0956 3.183099 323.5828  106.2 -23.24609      6.366199 0.98 
1 1 1 -43 5  2  o 243.5458 3.446466 337.8771  106.0 46.87041       6.892933 0.98 
1 1 1 -43 5  3  o 228.9190 3.570797 340.2106  0.6   -23.28046      7.141594 0.98 
1 1 1 -43 5  4  o 34.44959 9.502462 48.91859  86.2  2.759514       19.00492 0.24 
1 1 1 -43 5  5  o 54.04218 8.584422 108.2258  153.4 -3.555134      17.16884 0.66 
1 1 1 -43 5  6  o 171.4042 3.657301 252.5249  20.8  -27.21547      7.314602 0.96 
1 1 1 -43 5  7  f 344.4710 3.748183 440.6077  100.6 -8.801147      7.496367 0.00 
1 1 1 -43 5  8  o 266.9007 3.482202 397.3579  117.4 -4.706390      6.964403 0.98 
1 1 1 -43 5  9  o 150.8112 3.639490 271.0695  8.2   -20.92494      7.278980 0.96 
1 1 1 -43 5  10 o 46.53485 8.336234 51.85471  205.1 6.712269       16.67247 0.37 
1 1 1 -43 5  11 o 81.94289 6.119127 141.3603  175.5 27.72523       12.23825 0.84 
1 1 1 -43 5  12 o 218.1192 3.900687 299.0849  244.5 -2.076355      7.801375 0.98 
1 1 1 -43 5  13 o 58.53169 8.870373 40.66203  97.1  42.15496       17.74075 0.33 
1 1 1 -43 5  14 o 140.6792 4.444417 98.59909  174.8 -17.19226      8.888835 0.89 
1 1 1 -43 5  15 o 49.68235 8.825811 144.8602  0.0   9.000740       17.65162 0.79 
1 1 1 -43 5  16 o 174.0488 3.897512 257.5802  3.7   3.833633       7.795024 0.97 
1 1 1 -43 5  17 o 93.00389 7.709632 181.2846  293.9 -23.29251      15.41926 0.94 
1 1 1 -43 5  18 o 45.83131 10.11272 96.11240  285.9 3.902401       20.22543 0.72 
1 1 1 -43 5  19 o 59.26044 8.166402 121.6445  135.7 20.11419       16.33280 0.85 
1 1 1 -43 5  20 o 184.4492 3.580215 334.7968  287.5 2.250031       7.160431 0.99 
1 1 1 -43 5  21 o 84.25255 5.326268 122.1126  340.0 24.34024       10.65254 0.92 
1 1 1 -43 5  22 o 175.0563 3.562154 306.3482  43.0  -11.07635      7.124308 0.99 
1 1 1 -43 5  23 o 80.00829 5.592481 84.59762  96.3  -22.61074      11.18496 0.91 
1 1 1 -43 5  24 o 114.7961 4.803864 206.7592  214.8 -15.03733      9.607727 0.97 
1 1 1 -43 5  25 o 70.92919 7.996798 109.6396  292.8 20.34873       15.99360 0.88 
1 1 1 -43 5  26 o 47.05991 8.898535 20.70322  237.2 -24.07874      17.79707 0.29 
1 1 1 -43 5  27 o 147.0349 4.342304 225.8719  222.1 11.71135       8.684608 0.98 
1 1 1 -43 5  28 o 65.64716 8.589598 94.20511  231.5 42.57856       17.17920 0.89 
1 1 1 -43 5  29 o 38.61490 9.426657 93.95769  192.9 -10.76793      18.85331 0.84 
1 1 1 -43 5  30 f 157.8717 4.738549 268.3794  249.9 -12.62679      9.477098 0.00 
1 1 1 -43 5  31 o 72.11763 9.618882 108.0412  252.0 -2.560493      19.23776 0.95 
1 1 1 -43 5  32 f 45.16497 11.08776 57.19494  222.2 -1.723274      22.17553 0.00 
1 1 1 -43 5  33 f 63.10552 10.56006 112.0822  193.0 -16.32882      21.12011 0.00 
1 1 1 -43 5  34 o 70.02053 10.38069 110.4876  150.7 ?              ?        0.95 
1 1 1 -43 7  1  o 166.6520 3.507258 227.0763  168.5 -20.92290      7.014515 0.97 
1 1 1 -43 7  2  f 156.5294 3.660164 266.1078  147.2 -44.64957      7.320328 0.00 
1 1 1 -43 7  3  o 84.58301 5.359850 140.8964  73.6  -25.70123      10.71970 0.91 
1 1 1 -43 7  4  f 120.1183 4.274786 245.7171  174.0 -44.73227      8.549572 0.00 
1 1 1 -43 7  5  o 64.37682 7.452391 78.18915  123.9 21.89265       14.90478 0.75 
1 1 1 -43 7  6  o 233.5055 3.356441 412.1822  256.3 40.70135       6.712881 0.99 
1 1 1 -43 7  7  o 61.06899 8.791381 100.1179  290.4 43.39655       17.58276 0.79 
1 1 1 -43 7  8  o 135.0242 4.285963 215.9786  182.9 -33.50365      8.571925 0.96 
1 1 1 -43 7  9  o 96.60036 5.247699 111.7971  126.4 29.81454       10.49540 0.90 
1 1 1 -43 7  10 o 209.6196 3.630691 361.7126  298.3 5.056931       7.261382 0.99 
1 1 1 -43 7  11 o 100.6275 5.463291 125.3940  346.2 22.33968       10.92658 0.92 
1 1 1 -43 7  12 o 147.9901 3.854479 208.1580  75.7  -35.96747      7.708957 0.97 
1 1 1 -43 7  13 f 55.17274 8.914506 134.6124  250.8 33.64033       17.82901 0.00 
1 1 1 -43 7  14 o 48.12435 9.625618 73.72686  151.0 6.075508       19.25124 0.66 
1 1 1 -43 7  15 o 29.90521 8.681781 86.15833  162.0 16.36329       17.36356 0.56 
1 1 1 -43 7  16 o 176.7329 4.293514 258.7687  196.7 20.82080       8.587029 0.98 
1 1 1 -43 7  17 o 170.7751 4.196712 362.3874  106.4 -9.820038      8.393424 0.99 
1 1 1 -43 7  18 o 100.0190 5.293532 141.5239  325.5 6.077202       10.58706 0.95 
1 1 1 -43 7  19 o 47.90023 9.465303 135.5248  151.8 -3.003952      18.93061 0.89 
1 1 1 -43 7  20 o 40.89384 9.543417 88.62215  111.4 -4.212917      19.08683 0.80 
1 1 1 -43 7  21 o 65.50135 8.400484 88.27865  273.5 -28.16676      16.80097 0.87 
1 1 1 -43 7  22 o 110.0953 5.137569 200.9508  237.1 -4.538887      10.27514 0.96 
1 1 1 -43 7  23 o 90.66910 5.846726 180.6684  123.0 2.720291       11.69345 0.95 
1 1 1 -43 7  24 o 26.92851 8.725582 75.88537  15.2  4.962563       17.45116 0.55 
1 1 1 -43 7  25 o 64.22895 11.94461 44.44933  246.7 -7.380016      23.88922 0.68 
1 1 1 -43 7  26 o 30.03035 9.360557 103.9193  53.0  4.292847       18.72111 0.78 
1 1 1 -43 7  27 o 42.55458 10.95775 78.61671  5.7   8.297577       21.91549 0.82 
1 1 1 -43 7  28 o 108.4933 7.327581 140.6763  333.5 -16.83537      14.65516 0.97 
1 1 1 -43 7  29 o 37.34511 10.50082 68.88221  41.8  16.54305       21.00164 0.82 
1 1 1 -43 7  30 o 39.09297 10.41444 38.91681  153.6 -9.420338      20.82889 0.67 
1 1 1 -43 7  31 o 37.69114 10.02544 79.55634  32.6  -14.82848      20.05088 0.86 
1 1 1 -43 7  32 o 51.40867 11.67546 110.7011  5.3   ?              ?        0.93 
1 1 1 -43 9  1  o 56.84464 10.56134 73.42368  177.8 8.366261       21.12268 0.82 
1 1 1 -43 9  2  o 64.78840 8.535338 84.10876  266.2 17.29268       17.07068 0.88 
1 1 1 -43 9  3  o 186.9696 4.723792 266.3708  357.1 1.308075       9.447583 0.99 
1 1 1 -43 9  4  o 91.70599 5.593708 117.8361  101.4 17.16218       11.18742 0.94 
1 1 1 -43 9  5  o 121.3115 5.224095 178.3110  117.6 18.94241       10.44819 0.97 
1 1 1 -43 9  6  o 144.1317 3.782604 213.8708  119.1 -14.56825      7.565207 0.98 
1 1 1 -43 9  7  o 189.9442 3.759438 233.4179  230.5 -14.76747      7.518875 0.98 
1 1 1 -43 9  8  o 38.03216 9.426045 36.87072  355.0 4.300213       18.85209 0.42 
1 1 1 -43 9  9  o 131.2673 4.348964 188.1518  94.2  18.98751       8.697928 0.97 
1 1 1 -43 9  10 o 127.1829 4.500187 215.7081  353.6 -11.14468      9.000374 0.98 
1 1 1 -43 9  11 o 158.6905 4.284963 280.8927  326.5 -12.67081      8.569925 0.99 
1 1 1 -43 9  12 o 113.7358 4.810077 109.1425  23.9  19.77222       9.620153 0.95 
1 1 1 -43 9  13 o 65.25150 7.897059 145.1931  321.5 13.11641       15.79412 0.94 
1 1 1 -43 9  14 o 45.15173 10.41603 94.71027  288.0 -7.387920      20.83207 0.84 
1 1 1 -43 9  15 o 50.16950 9.768737 82.32023  11.9  9.142044       19.53747 0.82 
1 1 1 -43 9  16 o 84.81841 6.838374 181.3011  275.7 9.106850       13.67675 0.95 
1 1 1 -43 9  17 o 74.18219 7.361670 101.9021  307.7 11.87008       14.72334 0.89 
1 1 1 -43 9  18 o 107.7532 5.020065 166.1940  242.1 3.512451       10.04013 0.95 
1 1 1 -43 9  19 o 98.79052 6.042320 172.8783  199.9 30.82155       12.08464 0.95 
1 1 1 -43 9  20 o 48.20490 10.96332 3.685728  202.0 9.215969       21.92664 0.06 
1 1 1 -43 9  21 o 92.33112 6.146245 114.5827  319.2 -17.43779      12.29249 0.93 
1 1 1 -43 9  22 o 61.77294 10.13383 82.84995  258.2 -14.05618      20.26766 0.86 
1 1 1 -43 9  23 o 47.34986 8.549272 74.66490  214.5 -30.22478      17.09854 0.83 
1 1 1 -43 9  24 f 100.6888 6.597503 193.1187  236.7 -6.139030      13.19501 0.00 
1 1 1 -43 9  25 o 63.77788 9.640308 121.3473  211.4 10.36165       19.28062 0.94 
1 1 1 -43 9  26 o 32.57388 9.681811 53.14440  80.2  5.007946       19.36362 0.73 
1 1 1 -43 9  27 o 36.73189 9.705226 87.86583  343.6 -11.05564      19.41045 0.87 
1 1 1 -43 9  28 o 42.55340 10.23420 60.86329  267.9 -9.772129      20.46839 0.83 
1 1 1 -43 9  29 o 40.24577 11.46691 53.43229  164.9 25.35840       22.93383 0.79 
1 1 1 -43 9  30 o 38.58178 11.56126 62.98587  102.5 ?              ?        0.84 
1 1 1 -43 11 1  o 86.47358 6.161359 61.55819  285.1 13.86331       12.32272 0.86 
1 1 1 -43 11 2  o 107.1441 5.809225 132.7376  346.4 -13.82829      11.61845 0.95 
1 1 1 -43 11 3  o 232.6857 3.733090 325.6273  60.6  -4.334152      7.466180 0.99 
1 1 1 -43 11 4  o 134.2628 4.825608 142.8646  61.9  -25.36281      9.651216 0.96 
1 1 1 -43 11 5  o 82.09823 9.494366 121.8841  241.1 50.52375       18.98873 0.92 
1 1 1 -43 11 6  o 164.2692 5.214610 243.5374  224.4 3.177704       10.42922 0.98 
1 1 1 -43 11 7  o 97.87321 6.720024 124.4035  125.2 1.359489       13.44005 0.94 
1 1 1 -43 11 8  o 33.45507 9.626606 130.2039  193.4 -6.321705      19.25321 0.79 
1 1 1 -43 11 9  o 59.31923 8.639041 139.4057  66.4  24.53455       17.27808 0.90 
1 1 1 -43 11 10 o 111.3646 6.089479 190.3352  187.3 39.22848       12.17896 0.97 
1 1 1 -43 11 11 o 40.19859 10.13820 56.26427  126.9 2.485218       20.27640 0.59 
1 1 1 -43 11 12 o 99.02785 5.648609 198.0277  25.4  -16.06499      11.29722 0.96 
1 1 1 -43 11 13 o 156.2196 4.544228 209.9641  293.1 -11.71291      9.088456 0.98 
1 1 1 -43 11 14 o 106.6908 5.554420 151.2398  225.0 17.60548       11.10884 0.96 
1 1 1 -43 11 15 o 45.84954 9.915344 95.96758  23.0  37.72009       19.83069 0.83 
1 1 1 -43 11 16 o 33.70987 9.872926 29.09052  351.7 -10.18475      19.74585 0.37 
1 1 1 -43 11 17 o 83.32545 7.164631 126.0454  38.5  -23.12092      14.32926 0.95 
1 1 1 -43 11 18 o 52.80375 10.54298 101.8724  323.6 5.723068       21.08597 0.89 
1 1 1 -43 11 19 o 79.74571 7.757241 134.9391  214.4 -5.777321      15.51448 0.96 
1 1 1 -43 11 20 o 53.75773 10.06579 158.4133  129.4 -28.46701      20.13159 0.95 
1 1 1 -43 11 21 o 88.97047 7.430732 125.3035  53.2  32.42416       14.86146 0.97 
1 1 1 -43 11 22 o 32.56545 9.897595 100.9817  288.2 16.59550       19.79519 0.87 
1 1 1 -43 11 23 o 40.92985 10.62695 46.07977  138.2 14.47091       21.25391 0.75 
1 1 1 -43 11 24 o 27.67854 9.075280 62.73488  49.5  4.861662       18.15056 0.75 
1 1 1 -43 11 25 o 38.33400 10.94128 40.43811  71.7  12.44433       21.88255 0.71 
1 1 1 -43 11 26 o 60.40447 10.52397 120.3734  76.0  ?              ?        0.95 
1 1 1 -43 13 1  f 28.54579 9.077588 77.67564  107.1 2.108082       18.15518 0.00 
1 1 1 -43 13 2  o 106.1672 5.805182 137.4299  155.4 -6.091888      11.61036 0.98 
1 1 1 -43 13 3  o 70.44284 8.889380 121.2141  212.3 18.57097       17.77876 0.96 
1 1 1 -43 13 4  o 81.80251 7.358928 124.0145  249.6 -14.73917      14.71786 0.96 
1 1 1 -43 13 5  o 92.43576 6.528090 174.4800  303.0 -9.058563      13.05618 0.98 
1 1 1 -43 13 6  o 55.06621 11.15320 169.3886  342.4 10.33451       22.30640 0.95 
1 1 1 -43 13 7  o 48.10606 9.885968 77.67624  354.9 42.13784       19.77194 0.88 
1 1 1 -43 13 8  o 62.31255 10.27227 88.87938  26.2  -1.653728      20.54454 0.92 
1 1 1 -43 13 9  o 60.79517 11.38179 109.3340  23.6  -12.82370      22.76359 0.93 
1 1 1 -43 13 10 o 142.5163 6.149116 243.8087  234.3 -2.164307      12.29823 0.99 
1 1 1 -43 13 11 o 68.46873 11.29250 162.6592  238.6 8.115189       22.58500 0.96 
1 1 1 -43 13 12 o 44.35345 10.90631 52.24812  300.6 20.41029       21.81261 0.80 
1 1 1 -43 13 13 o 39.57176 10.91268 78.51453  281.1 -17.78380      21.82536 0.86 
1 1 1 -43 13 14 o 55.59969 13.08017 112.5685  276.1 -21.35317      26.16035 0.93 
1 1 1 -43 13 15 o 63.18371 9.878318 106.4104  229.5 -23.23923      19.75664 0.94 
1 1 1 -43 13 16 o 50.49314 10.44042 68.04888  173.8 37.29946       20.88084 0.88 
1 1 1 -43 13 17 o 38.58685 10.40717 48.77720  223.0 28.75732       20.81433 0.76 
1 1 1 -43 13 18 o 47.58529 9.976831 54.80053  289.8 -30.77322      19.95366 0.84 
1 1 1 -43 13 19 o 48.11609 11.12282 87.32581  117.0 -13.55086      22.24563 0.91 
1 1 1 -43 13 20 o 92.93568 8.148911 175.5096  75.3  ?              ?        0.98 
1 1 1 -43 13 21 o 41.45840 10.25498 48.79380  161.6 ?              ?        0.82 
1 1 1 -43 15 5  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -43 15 6  x ?        ?        120.0898  15.5  ?              ?        0.00 
1 1 1 -43 15 7  x ?        ?        69.58751  141.1 ?              ?        0.00 
1 1 1 -43 15 8  x ?        ?        104.9997  176.6 ?              ?        0.00 
1 1 1 -43 15 9  x ?        ?        73.94401  281.7 ?              ?        0.00 
1 1 1 -43 15 10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -42 0  1  o 31.25914 15.48828 55.53001  180.0 -0.000000      0.000000 0.17 
1 1 1 -42 0  2  o 343.7834 4.943878 446.7872  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  3  o 103.3316 6.332779 207.6959  180.0 -0.000000      0.000000 0.96 
1 1 1 -42 0  4  o 25.55879 15.15490 73.32787  360.0 -0.000000      0.000000 0.16 
1 1 1 -42 0  5  o 56.35287 14.64091 71.33883  360.0 -0.000000      0.000000 0.26 
1 1 1 -42 0  6  o 148.1022 5.663283 10.77151  0.0   -0.000000      0.000000 0.06 
1 1 1 -42 0  7  o 126.2603 5.802788 229.0769  360.0 -0.000000      0.000000 0.99 
1 1 1 -42 0  8  o 332.5064 5.996277 543.7391  360.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  9  o 115.8542 7.275730 108.1035  0.0   -0.000000      0.000000 0.84 
1 1 1 -42 0  10 o 13.39648 9.743934 82.37519  180.0 -0.000000      0.000000 0.11 
1 1 1 -42 0  11 o 368.1166 6.407265 508.0372  360.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  12 o 29.90660 16.59804 181.1221  180.0 -0.000000      0.000000 0.48 
1 1 1 -42 0  13 f 274.8672 5.570849 421.2606  180.0 -0.000000      0.000000 0.00 
1 1 1 -42 0  14 o 255.5393 5.609864 340.3535  0.0   -0.000000      0.000000 1.00 
1 1 1 -42 0  15 o 81.47766 8.689614 187.4258  360.0 -0.000000      0.000000 0.95 
1 1 1 -42 0  16 o 49.45988 15.06547 113.8703  180.0 -0.000000      0.000000 0.68 
1 1 1 -42 0  17 o 124.6847 5.227343 213.4486  360.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  18 o 86.32671 7.206240 202.6344  180.0 -0.000000      0.000000 0.99 
1 1 1 -42 0  19 o 276.4976 5.215389 525.6404  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  20 o 261.8589 5.303623 415.3376  360.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  21 o 327.8794 6.135530 462.0036  0.0   -0.000000      0.000000 1.00 
1 1 1 -42 0  22 o 107.6616 6.155545 193.7345  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  23 o 21.72209 13.73362 41.10678  360.0 -0.000000      0.000000 0.22 
1 1 1 -42 0  24 o 96.68494 6.593783 42.60688  360.0 -0.000000      0.000000 0.84 
1 1 1 -42 0  25 o 74.85707 8.003698 107.8044  0.0   -0.000000      0.000000 0.99 
1 1 1 -42 0  26 o 47.94244 15.57387 143.7419  180.0 -0.000000      0.000000 0.99 
1 1 1 -42 0  27 o 223.3080 6.985343 296.4866  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  28 o 71.14587 10.57431 95.07233  180.0 -0.000000      0.000000 0.96 
1 1 1 -42 0  29 o 36.66242 18.46718 28.89439  180.0 -0.000000      0.000000 0.30 
1 1 1 -42 0  30 o 45.55334 17.03135 107.7451  180.0 -0.000000      0.000000 0.93 
1 1 1 -42 0  31 o 62.25397 13.54574 110.8495  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  32 o 86.14818 10.25871 118.8540  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  33 o 250.4408 5.867146 321.0521  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  34 o 85.76028 10.86079 99.20978  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  35 o 133.3040 7.591169 200.5704  180.0 -0.000000      0.000000 1.00 
1 1 1 -42 0  36 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -42 2  1  o 173.2442 3.187011 195.0359  275.7 -7.756210      6.374021 0.94 
1 1 1 -42 2  2  o 203.8158 3.062793 310.3541  308.5 2.619080       6.125585 0.97 
1 1 1 -42 2  3  o 388.7913 3.936258 500.9068  271.0 13.28070       7.872515 0.99 
1 1 1 -42 2  4  o 387.6655 3.863645 497.5760  169.1 -17.79852      7.727289 0.99 
1 1 1 -42 2  5  o 376.0698 3.932386 449.5712  51.5  3.474792       7.864773 0.98 
1 1 1 -42 2  6  o 249.7934 3.901621 339.2271  19.4  15.05583       7.803242 0.97 
1 1 1 -42 2  7  o 99.40312 5.577069 82.95326  79.3  -18.97455      11.15414 0.54 
1 1 1 -42 2  8  o 73.74959 6.951366 142.9838  224.4 3.640808       13.90273 0.71 
1 1 1 -42 2  9  o 222.5973 3.942437 282.4523  57.4  -2.119034      7.884875 0.96 
1 1 1 -42 2  10 o 237.5202 3.773898 283.8254  95.1  -3.936081      7.547795 0.96 
1 1 1 -42 2  11 o 151.3853 4.071735 247.3829  84.2  0.3613739      8.143470 0.93 
1 1 1 -42 2  12 o 382.4467 4.490074 608.9854  322.6 -3.305420      8.980147 0.99 
1 1 1 -42 2  13 o 178.0387 3.860263 231.1647  229.6 34.40562       7.720526 0.96 
1 1 1 -42 2  14 o 168.9437 3.599185 201.9369  318.7 -7.391083      7.198369 0.95 
1 1 1 -42 2  15 o 83.80779 6.025662 125.3362  252.3 20.51276       12.05132 0.84 
1 1 1 -42 2  16 o 146.3634 3.805102 136.3441  128.1 -2.318558      7.610204 0.92 
1 1 1 -42 2  17 o 75.16019 5.385561 58.36528  255.6 19.93822       10.77112 0.56 
1 1 1 -42 2  18 o 32.35107 8.921758 40.03084  43.8  6.450064       17.84352 0.17 
1 1 1 -42 2  19 o 72.73619 5.873645 116.8137  235.2 7.367744       11.74729 0.81 
1 1 1 -42 2  20 o 296.5426 3.893016 406.3372  189.9 7.445923       7.786032 0.99 
1 1 1 -42 2  21 o 201.6548 3.833735 313.9911  78.7  -14.22726      7.667470 0.98 
1 1 1 -42 2  22 o 136.7119 4.404633 239.8164  184.8 -24.64896      8.809266 0.97 
1 1 1 -42 2  23 o 103.6548 4.351555 179.4436  176.2 21.32691       8.703110 0.95 
1 1 1 -42 2  24 o 134.9289 4.010664 171.1208  69.8  3.256271       8.021328 0.97 
1 1 1 -42 2  25 f 52.15219 9.506836 67.40434  284.0 3.288540       19.01367 0.00 
1 1 1 -42 2  26 o 208.7959 3.570984 284.2133  296.8 -2.553345      7.141968 0.99 
1 1 1 -42 2  27 f 212.6329 3.978228 314.3099  29.8  -4.186325      7.956457 0.00 
1 1 1 -42 2  28 o 129.2953 4.543519 210.6987  22.4  15.50413       9.087037 0.97 
1 1 1 -42 2  29 o 122.8604 5.029190 100.9392  175.3 18.87936       10.05838 0.94 
1 1 1 -42 2  30 o 150.4106 4.859245 196.4371  75.6  27.52455       9.718491 0.98 
1 1 1 -42 2  31 o 58.63996 10.50548 84.56777  101.2 -4.035450      21.01096 0.88 
1 1 1 -42 2  32 o 94.68379 6.467554 151.0478  77.2  15.03688       12.93511 0.97 
1 1 1 -42 2  33 o 98.56729 6.463907 162.2413  45.8  -12.44282      12.92781 0.98 
1 1 1 -42 2  34 o 59.25378 10.10905 112.5641  316.7 21.97125       20.21810 0.94 
1 1 1 -42 2  35 o 47.13842 10.39249 106.9606  319.3 ?              ?        0.92 
1 1 1 -42 4  1  o 386.8715 3.857119 614.8421  77.4  -34.72202      7.714239 0.99 
1 1 1 -42 4  2  o 164.8105 3.453048 103.6444  36.4  -22.22476      6.906096 0.89 
1 1 1 -42 4  3  f 82.84845 5.379066 198.5560  357.2 -27.39629      10.75813 0.00 
1 1 1 -42 4  4  o 104.0994 4.999094 164.1170  27.6  -45.14095      9.998188 0.89 
1 1 1 -42 4  5  o 206.6910 3.419425 357.8292  170.7 -4.737381      6.838850 0.98 
1 1 1 -42 4  6  o 190.0426 3.334559 299.9749  272.9 10.85109       6.669117 0.97 
1 1 1 -42 4  7  o 116.1271 4.632731 202.3961  190.9 43.10719       9.265462 0.93 
1 1 1 -42 4  8  f 292.1539 3.538772 336.1186  90.8  -4.089264      7.077543 0.00 
1 1 1 -42 4  9  o 164.0715 4.189991 267.7174  49.4  -5.470413      8.379983 0.96 
1 1 1 -42 4  10 o 288.1610 3.771282 445.6063  142.9 4.356445       7.542564 0.99 
1 1 1 -42 4  11 o 400.6308 4.775204 589.3647  147.0 9.349579       9.550408 0.99 
1 1 1 -42 4  12 o 46.45559 8.098073 78.93916  109.6 26.48458       16.19615 0.37 
1 1 1 -42 4  13 o 49.44009 8.649273 61.21873  275.8 25.76255       17.29855 0.44 
1 1 1 -42 4  14 o 198.2599 3.758891 321.8330  38.1  -4.455658      7.517782 0.97 
1 1 1 -42 4  15 o 329.2522 4.319659 393.4186  310.5 -17.57526      8.639318 0.99 
1 1 1 -42 4  16 o 70.07387 7.698004 126.2797  295.5 9.311470       15.39601 0.78 
1 1 1 -42 4  17 o 137.9256 3.921938 224.7804  42.4  -10.34114      7.843877 0.95 
1 1 1 -42 4  18 o 269.0009 4.080611 424.7220  8.0   -4.967224      8.161222 0.99 
1 1 1 -42 4  19 o 176.5280 3.907257 253.0661  97.9  16.98810       7.814514 0.98 
1 1 1 -42 4  20 o 64.57355 10.04014 71.79313  304.4 9.204708       20.08027 0.73 
1 1 1 -42 4  21 o 246.4773 3.761288 330.2006  315.1 19.09309       7.522577 0.99 
1 1 1 -42 4  22 f 138.7591 3.962772 242.4798  282.0 -22.87560      7.925545 0.00 
1 1 1 -42 4  23 o 88.68843 5.192351 102.8352  343.2 -0.3425751     10.38470 0.92 
1 1 1 -42 4  24 o 92.13916 4.903509 117.2627  340.9 12.44880       9.807017 0.94 
1 1 1 -42 4  25 o 133.2079 4.198609 196.9311  95.3  11.52078       8.397218 0.97 
1 1 1 -42 4  26 o 139.2899 4.465667 172.7437  99.8  3.552200       8.931334 0.97 
1 1 1 -42 4  27 o 127.1641 4.947824 116.6586  159.0 -1.181244      9.895647 0.95 
1 1 1 -42 4  28 o 150.7758 4.618465 266.0967  356.6 5.754807       9.236930 0.98 
1 1 1 -42 4  29 o 123.1065 5.563559 190.9422  31.3  -9.940346      11.12712 0.97 
1 1 1 -42 4  30 o 56.63331 9.857141 76.09666  170.7 35.85064       19.71428 0.87 
1 1 1 -42 4  31 o 44.78764 11.34322 60.48824  280.8 -2.663246      22.68643 0.80 
1 1 1 -42 4  32 f 49.10290 10.04605 65.25554  127.3 -12.71357      20.09211 0.00 
1 1 1 -42 4  33 o 112.9162 6.342533 135.8236  112.4 3.800018       12.68507 0.98 
1 1 1 -42 4  34 o 45.22112 10.78018 95.29054  76.6  -7.520531      21.56037 0.91 
1 1 1 -42 4  35 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -42 6  1  o 394.1614 4.267252 578.1577  155.2 -22.28949      8.534505 0.99 
1 1 1 -42 6  2  o 272.6903 3.816201 308.8620  180.3 -10.22644      7.632402 0.98 
1 1 1 -42 6  3  o 41.07008 9.006078 92.58520  357.2 24.76959       18.01216 0.52 
1 1 1 -42 6  4  o 326.1541 3.914057 468.5062  221.3 -61.41583      7.828114 0.99 
1 1 1 -42 6  5  o 70.42344 7.762759 157.7196  282.0 -17.91114      15.52552 0.83 
1 1 1 -42 6  6  o 79.45895 5.704102 118.0620  349.3 8.899849       11.40820 0.80 
1 1 1 -42 6  7  o 169.6881 3.756577 368.5800  219.3 0.6247406      7.513153 0.97 
1 1 1 -42 6  8  o 39.35787 9.406970 92.11845  325.7 -2.500366      18.81394 0.46 
1 1 1 -42 6  9  o 134.1342 3.968661 306.7500  348.8 -34.92015      7.937322 0.96 
1 1 1 -42 6  10 o 129.1097 4.310362 155.1452  28.1  25.26173       8.620725 0.92 
1 1 1 -42 6  11 o 164.9433 3.564916 251.4258  331.0 15.36761       7.129831 0.96 
1 1 1 -42 6  12 o 131.4444 3.955416 178.4090  290.7 -0.3975677     7.910831 0.94 
1 1 1 -42 6  13 o 221.3650 4.030466 347.1182  175.6 56.38994       8.060932 0.98 
1 1 1 -42 6  14 f 141.7597 5.321412 169.7667  60.4  12.47659       10.64282 0.00 
1 1 1 -42 6  15 o 199.6301 3.707997 333.2925  78.4  -4.395111      7.415994 0.98 
1 1 1 -42 6  16 o 61.95817 8.389400 66.36134  46.6  -0.1311531     16.77880 0.70 
1 1 1 -42 6  17 o 175.0051 4.003267 289.8735  281.8 -16.52417      8.006534 0.98 
1 1 1 -42 6  18 o 117.5176 4.448004 130.5078  221.7 0.4533539      8.896008 0.94 
1 1 1 -42 6  19 o 118.9041 4.181386 233.3045  86.4  9.387489       8.362772 0.97 
1 1 1 -42 6  20 o 66.19125 6.570844 131.2134  270.9 5.106247       13.14169 0.90 
1 1 1 -42 6  21 o 46.37575 8.964970 45.92804  344.9 -18.27886      17.92994 0.60 
1 1 1 -42 6  22 o 135.1898 4.002562 170.3859  5.5   40.60447       8.005124 0.98 
1 1 1 -42 6  23 o 98.71359 5.323184 131.4291  358.1 -3.314941      10.64637 0.95 
1 1 1 -42 6  24 o 47.59485 9.965542 62.36900  148.9 9.874012       19.93108 0.65 
1 1 1 -42 6  25 o 64.26065 8.724555 152.4968  99.1  2.357929       17.44911 0.91 
1 1 1 -42 6  26 o 55.89075 10.02026 80.86157  253.1 21.91977       20.04051 0.80 
1 1 1 -42 6  27 o 46.61979 10.21841 12.81444  214.7 0.5246468      20.43683 0.22 
1 1 1 -42 6  28 o 70.71286 8.546275 81.75926  33.8  3.338776       17.09255 0.90 
1 1 1 -42 6  29 o 50.95618 10.37566 57.71609  101.6 -10.11771      20.75131 0.81 
1 1 1 -42 6  30 o 42.35255 10.07910 61.72344  299.7 -18.98923      20.15819 0.82 
1 1 1 -42 6  31 o 49.50748 11.60709 82.39445  164.8 1.971935       23.21418 0.89 
1 1 1 -42 6  32 o 36.94264 10.88734 85.22322  246.0 5.768600       21.77469 0.86 
1 1 1 -42 6  33 o 60.82929 9.903674 125.0179  191.2 ?              ?        0.95 
1 1 1 -42 8  1  o 61.06131 8.218496 117.7100  115.1 8.461689       16.43699 0.86 
1 1 1 -42 8  2  o 29.48716 8.328125 47.95838  75.8  -14.36808      16.65625 0.34 
1 1 1 -42 8  3  o 163.9425 3.705508 228.5199  331.0 30.33427       7.411017 0.97 
1 1 1 -42 8  4  o 184.0002 4.824647 267.8384  149.1 11.22351       9.649294 0.98 
1 1 1 -42 8  5  o 39.71392 9.363324 45.25003  126.6 13.06200       18.72665 0.41 
1 1 1 -42 8  6  o 40.22574 9.164851 64.36529  334.1 -1.761726      18.32970 0.54 
1 1 1 -42 8  7  o 118.4293 4.143389 211.2468  167.4 -9.658699      8.286777 0.96 
1 1 1 -42 8  8  o 150.5003 4.519767 220.2893  225.1 -3.558502      9.039535 0.97 
1 1 1 -42 8  9  o 164.4630 3.766802 193.3247  203.8 1.597885       7.533604 0.97 
1 1 1 -42 8  10 o 240.2610 3.623459 298.4526  241.7 -22.74519      7.246917 0.99 
1 1 1 -42 8  11 f 48.28534 8.841193 91.39715  292.8 -23.61131      17.68239 0.00 
1 1 1 -42 8  12 o 95.11769 5.050099 183.0000  90.7  -49.06664      10.10020 0.95 
1 1 1 -42 8  13 o 75.48990 6.109999 82.86025  66.0  -18.68989      12.22000 0.84 
1 1 1 -42 8  14 o 80.13179 6.347149 111.1468  165.7 -10.19152      12.69430 0.90 
1 1 1 -42 8  15 o 36.65174 9.557527 86.24907  55.6  -5.057182      19.11505 0.68 
1 1 1 -42 8  16 o 119.4863 4.548939 140.8774  121.0 -10.15557      9.097878 0.96 
1 1 1 -42 8  17 o 261.5388 3.980851 417.3235  50.3  7.258026       7.961702 0.99 
1 1 1 -42 8  18 o 168.9935 4.028589 258.2138  334.5 19.82443       8.057178 0.99 
1 1 1 -42 8  19 o 77.98013 7.287763 153.9372  291.5 24.25872       14.57553 0.95 
1 1 1 -42 8  20 o 161.9410 4.214514 224.3003  78.9  -2.427612      8.429028 0.98 
1 1 1 -42 8  21 o 85.30408 5.944338 154.6577  3.2   -17.14031      11.88868 0.94 
1 1 1 -42 8  22 o 75.33717 8.482283 185.1577  316.1 -2.589020      16.96457 0.94 
1 1 1 -42 8  23 o 32.82820 9.484572 45.59105  187.9 20.26226       18.96914 0.44 
1 1 1 -42 8  24 o 42.94455 9.765220 117.6542  271.9 3.037682       19.53044 0.85 
1 1 1 -42 8  25 o 138.7592 4.415349 322.7354  150.7 7.146500       8.830699 0.99 
1 1 1 -42 8  26 o 95.38647 6.974725 169.2454  117.4 -8.225357      13.94945 0.97 
1 1 1 -42 8  27 o 81.55984 8.480813 136.0134  17.0  0.5599594      16.96163 0.96 
1 1 1 -42 8  28 o 37.42341 9.620300 55.99471  359.0 -13.57440      19.24060 0.78 
1 1 1 -42 8  29 o 50.96830 9.719875 29.64758  322.1 -23.01160      19.43975 0.68 
1 1 1 -42 8  30 o 37.97981 10.90915 69.12663  49.4  17.84313       21.81829 0.83 
1 1 1 -42 8  31 o 33.98885 10.40425 63.17174  7.7   ?              ?        0.81 
1 1 1 -42 10 1  o 131.0133 4.867902 240.4154  228.3 -6.531311      9.735805 0.98 
1 1 1 -42 10 2  o 122.8057 5.567189 168.3383  248.3 5.155518       11.13438 0.97 
1 1 1 -42 10 3  o 61.14790 8.903574 123.6207  7.0   23.82954       17.80715 0.90 
1 1 1 -42 10 4  o 132.2349 5.422146 156.7576  9.6   -26.70931      10.84429 0.97 
1 1 1 -42 10 5  o 164.6403 4.979414 193.7558  83.3  8.210312       9.958828 0.98 
1 1 1 -42 10 6  o 138.1183 4.216389 179.0464  99.5  20.14610       8.432777 0.98 
1 1 1 -42 10 7  o 66.53949 7.797311 125.3782  140.5 14.73552       15.59462 0.92 
1 1 1 -42 10 8  o 83.55736 6.691256 105.2449  167.8 3.130836       13.38251 0.93 
1 1 1 -42 10 9  o 161.9845 4.102029 221.0606  50.4  3.431778       8.204059 0.98 
1 1 1 -42 10 10 o 75.74030 7.961368 95.53156  164.5 40.76041       15.92274 0.91 
1 1 1 -42 10 11 o 92.20088 5.751515 127.9448  85.4  1.462120       11.50303 0.95 
1 1 1 -42 10 12 o 218.6295 3.503408 343.3449  58.5  -23.54173      7.006816 0.99 
1 1 1 -42 10 13 o 80.80630 8.249518 151.6277  69.5  36.72105       16.49904 0.94 
1 1 1 -42 10 14 o 74.76576 8.192478 136.0155  176.1 29.43084       16.38496 0.92 
1 1 1 -42 10 15 o 49.96825 9.731235 78.22820  61.7  -32.50650      19.46247 0.75 
1 1 1 -42 10 16 o 138.2918 4.827396 206.8326  145.1 20.30476       9.654792 0.97 
1 1 1 -42 10 17 o 219.5658 4.021563 354.0156  134.2 17.40927       8.043125 0.99 
1 1 1 -42 10 18 f 177.5916 3.908291 292.3640  114.4 4.825958       7.816581 0.00 
1 1 1 -42 10 19 o 150.0188 4.170367 259.7757  123.2 7.780365       8.340734 0.98 
1 1 1 -42 10 20 o 69.50348 8.663444 135.7494  24.5  -14.67640      17.32689 0.93 
1 1 1 -42 10 21 o 122.4652 5.889439 231.3749  8.7   -16.28297      11.77888 0.98 
1 1 1 -42 10 22 o 79.13654 6.988343 100.6790  100.5 29.94746       13.97669 0.94 
1 1 1 -42 10 23 o 35.38094 10.21257 53.63239  124.2 5.691147       20.42515 0.71 
1 1 1 -42 10 24 o 92.90385 7.206480 140.2126  287.5 8.600906       14.41296 0.97 
1 1 1 -42 10 25 o 40.22151 10.57243 96.43632  97.6  -2.020214      21.14487 0.89 
1 1 1 -42 10 26 o 66.39548 9.653468 119.9721  164.9 6.954285       19.30694 0.95 
1 1 1 -42 10 27 o 43.05344 9.321109 84.47529  236.1 -20.81422      18.64222 0.89 
1 1 1 -42 10 28 o 35.16724 10.66496 71.90633  268.4 ?              ?        0.84 
1 1 1 -42 10 29 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -42 12 1  o 88.75391 6.846243 104.0110  18.7  -3.209663      13.69249 0.94 
1 1 1 -42 12 2  o 59.47153 9.650234 76.74049  294.9 -21.22127      19.30047 0.86 
1 1 1 -42 12 3  o 108.8968 5.339249 177.3463  312.4 7.939957       10.67850 0.97 
1 1 1 -42 12 4  o 39.78823 10.47708 44.98764  36.5  9.322533       20.95416 0.57 
1 1 1 -42 12 5  o 117.5127 5.704919 192.0863  13.5  0.3823853E-01  11.40984 0.97 
1 1 1 -42 12 6  o 86.24940 8.020138 125.4302  319.3 -30.74105      16.04028 0.94 
1 1 1 -42 12 7  o 78.02612 8.080416 129.9401  155.1 18.44462       16.16083 0.94 
1 1 1 -42 12 8  o 145.0635 5.041246 258.6447  181.7 -13.25636      10.08249 0.98 
1 1 1 -42 12 9  o 53.82083 10.42215 59.89247  326.5 -21.41003      20.84430 0.76 
1 1 1 -42 12 10 o 108.1213 6.216848 161.0128  175.3 39.17365       12.43370 0.97 
1 1 1 -42 12 11 o 73.29280 9.983715 98.00131  130.6 19.40039       19.96743 0.91 
1 1 1 -42 12 12 o 39.82427 10.60662 94.08646  335.4 -1.822918      21.21324 0.82 
1 1 1 -42 12 13 o 135.3488 5.241622 251.5243  311.4 -0.9124908     10.48324 0.99 
1 1 1 -42 12 14 o 58.11086 9.544406 77.18823  67.9  22.15512       19.08881 0.87 
1 1 1 -42 12 15 o 54.02748 11.89886 108.1369  126.3 -12.23320      23.79772 0.90 
1 1 1 -42 12 16 o 59.79765 9.570210 79.08528  170.5 -5.750576      19.14042 0.90 
1 1 1 -42 12 17 o 45.18031 11.20536 78.34388  36.0  -3.790707      22.41071 0.86 
1 1 1 -42 12 18 o 48.66690 10.06275 112.4357  293.7 42.57432       20.12549 0.92 
1 1 1 -42 12 19 o 62.38127 10.46761 63.86010  209.1 7.037014       20.93523 0.90 
1 1 1 -42 12 20 o 31.98730 9.770703 53.45938  163.7 0.9785080E-01  19.54141 0.74 
1 1 1 -42 12 21 o 56.77982 9.699979 85.10811  147.4 27.41483       19.39996 0.92 
1 1 1 -42 12 22 o 46.27601 10.34317 113.4855  188.1 -6.074532      20.68633 0.92 
1 1 1 -42 12 23 o 28.91100 9.553061 37.01873  57.3  12.51621       19.10612 0.61 
1 1 1 -42 12 24 o 59.01941 10.78814 135.4997  346.7 ?              ?        0.96 
1 1 1 -42 12 25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -42 14 1  o 86.25188 7.415287 138.8402  53.3  4.508392       14.83057 0.97 
1 1 1 -42 14 2  f 65.47346 9.736757 78.53986  78.4  30.52845       19.47351 0.00 
1 1 1 -42 14 3  o 28.45000 9.203752 8.253044  252.1 -0.4552231     18.40750 0.16 
1 1 1 -42 14 4  o 70.00703 9.279392 140.7359  191.9 35.36404       18.55878 0.96 
1 1 1 -42 14 5  o 61.39047 10.73800 130.8788  198.8 20.95102       21.47599 0.95 
1 1 1 -42 14 6  o 47.64786 11.37214 75.07196  66.6  14.70467       22.74429 0.88 
1 1 1 -42 14 7  o 35.24594 10.31171 26.71372  44.3  17.49066       20.62343 0.52 
1 1 1 -42 14 8  o 142.8074 6.169005 252.7052  275.2 22.46976       12.33801 0.99 
1 1 1 -42 14 9  o 155.9681 6.214787 273.5787  309.2 -6.113342      12.42957 0.99 
1 1 1 -42 14 10 o 34.86164 10.59665 39.95037  71.3  -10.04019      21.19331 0.66 
1 1 1 -42 14 11 o 30.50463 9.945021 35.05302  202.3 -7.707594      19.89004 0.57 
1 1 1 -42 14 12 o 93.17596 10.82817 151.0977  298.4 -30.27769      21.65635 0.97 
1 1 1 -42 14 13 o 35.30759 11.32246 40.57430  270.5 5.389610       22.64491 0.66 
1 1 1 -42 14 14 o 64.13124 11.12284 67.50849  289.8 24.64084       22.24569 0.91 
1 1 1 -42 14 15 o 64.20504 11.23443 99.52067  345.6 -29.51335      22.46886 0.94 
1 1 1 -42 14 16 o 41.66100 12.67128 28.66455  189.4 15.32010       25.34257 0.59 
1 1 1 -42 14 17 o 28.27242 9.480989 80.85750  72.5  ?              ?        0.85 
1 1 1 -42 14 18 o 37.57343 12.02992 112.8446  57.7  ?              ?        0.91 
1 1 1 -41 1  1  o 371.3597 3.504378 504.5322  211.8 -22.89215      7.008756 0.99 
1 1 1 -41 1  2  o 313.6173 3.722845 237.7459  312.1 -0.6853027     7.445690 0.96 
1 1 1 -41 1  3  o 324.2178 3.748019 383.1763  26.7  14.97473       7.496038 0.97 
1 1 1 -41 1  4  o 261.0515 3.508471 301.8716  112.9 -22.75565      7.016943 0.96 
1 1 1 -41 1  5  o 298.7410 4.073510 452.9263  346.3 -8.491791      8.147019 0.97 
1 1 1 -41 1  6  o 323.8058 3.922182 404.2674  315.1 -20.26764      7.844364 0.97 
1 1 1 -41 1  7  o 322.8084 4.094140 420.5000  351.3 58.17172       8.188280 0.97 
1 1 1 -41 1  8  o 222.5701 4.074380 317.8706  351.6 9.124939       8.148760 0.95 
1 1 1 -41 1  9  o 262.7229 4.028886 320.5324  349.9 -32.87431      8.057772 0.96 
1 1 1 -41 1  10 o 347.6262 4.438676 362.3459  164.4 -32.86328      8.877353 0.97 
1 1 1 -41 1  11 o 98.14153 5.489498 289.8212  33.8  36.48740       10.97900 0.89 
1 1 1 -41 1  12 o 142.0237 4.268626 178.4583  2.3   13.94275       8.537252 0.89 
1 1 1 -41 1  13 o 212.4844 4.010424 298.0504  114.6 4.783127       8.020848 0.96 
1 1 1 -41 1  14 o 134.5475 4.206462 240.0963  2.5   11.13564       8.412924 0.93 
1 1 1 -41 1  15 o 151.6556 4.047709 224.5237  319.9 6.276306       8.095417 0.95 
1 1 1 -41 1  16 o 166.7720 3.554242 238.3553  19.7  11.63474       7.108484 0.96 
1 1 1 -41 1  17 o 98.92116 4.417779 197.2670  59.4  -12.08366      8.835558 0.91 
1 1 1 -41 1  18 o 273.4992 3.701144 371.1112  292.6 15.94843       7.402288 0.98 
1 1 1 -41 1  19 o 36.13840 8.006466 32.86674  359.2 -26.77706      16.01293 0.17 
1 1 1 -41 1  20 o 169.1269 3.645082 210.1860  83.7  -6.455841      7.290164 0.96 
1 1 1 -41 1  21 o 60.20658 7.413069 98.54570  275.3 -41.63972      14.82614 0.76 
1 1 1 -41 1  22 o 41.25425 8.841526 120.7469  175.3 7.045898       17.68305 0.75 
1 1 1 -41 1  23 o 124.8800 3.954562 146.8239  315.8 24.32071       7.909124 0.95 
1 1 1 -41 1  24 o 150.4651 3.832643 247.7974  356.5 -14.71519      7.665286 0.98 
1 1 1 -41 1  25 o 101.7920 4.804881 170.8263  310.1 -33.38047      9.609762 0.96 
1 1 1 -41 1  26 o 161.5937 3.878979 210.6775  270.3 -9.643707      7.757957 0.98 
1 1 1 -41 1  27 f 76.74107 6.321265 71.83264  181.2 -15.04729      12.64253 0.00 
1 1 1 -41 1  28 o 151.9956 4.898502 285.5921  79.3  0.6755371      9.797004 0.98 
1 1 1 -41 1  29 o 38.81164 10.33367 61.87905  107.4 7.421310       20.66735 0.58 
1 1 1 -41 1  30 o 39.92480 10.33648 83.83645  45.0  7.364075       20.67296 0.74 
1 1 1 -41 1  31 o 109.4461 5.487091 175.2063  105.4 6.161545       10.97418 0.97 
1 1 1 -41 1  32 o 29.43015 9.269778 26.08146  321.4 4.124241       18.53956 0.38 
1 1 1 -41 1  33 o 53.22794 11.07270 93.37394  307.2 14.18340       22.14540 0.91 
1 1 1 -41 1  34 o 61.44027 10.06947 92.32032  322.5 -1.866112      20.13894 0.92 
1 1 1 -41 1  35 f 41.64826 11.19171 80.04942  276.8 5.087994       22.38341 0.00 
1 1 1 -41 1  36 o 44.39773 10.78493 67.18159  122.8 ?              ?        0.87 
1 1 1 -41 3  1  o 36.54026 8.779469 49.15604  31.4  -4.846447      17.55894 0.22 
1 1 1 -41 3  2  o 338.0887 3.707961 486.7821  67.6  -30.01062      7.415921 0.99 
1 1 1 -41 3  3  o 69.57437 6.335844 84.67817  8.5   0.4565125      12.67169 0.56 
1 1 1 -41 3  4  o 532.6519 4.971624 716.7896  217.2 26.92517       9.943248 0.99 
1 1 1 -41 3  5  f 139.2000 4.064017 192.7774  212.7 -3.227280      8.128035 0.00 
1 1 1 -41 3  6  o 346.8895 3.840409 292.7228  21.1  -41.93765      7.680818 0.97 
1 1 1 -41 3  7  o 171.8597 3.296903 224.4778  31.0  -6.424561      6.593806 0.93 
1 1 1 -41 3  8  o 323.1130 4.074948 388.7466  317.3 -25.00528      8.149896 0.98 
1 1 1 -41 3  9  o 147.5732 4.497723 191.9451  29.3  -67.21012      8.995445 0.90 
1 1 1 -41 3  10 o 265.0745 4.059030 380.8248  144.5 11.19827       8.118059 0.98 
1 1 1 -41 3  11 o 137.1447 4.106469 202.5821  298.7 2.359360       8.212938 0.92 
1 1 1 -41 3  12 o 323.6743 4.319092 458.8568  343.9 -1.263733      8.638185 0.99 
1 1 1 -41 3  13 o 285.1830 4.119114 410.6667  232.7 14.85284       8.238228 0.98 
1 1 1 -41 3  14 o 220.5617 3.763167 302.1738  330.5 -43.94272      7.526333 0.97 
1 1 1 -41 3  15 o 33.98292 8.458800 46.85488  264.2 16.47796       16.91760 0.28 
1 1 1 -41 3  16 o 130.2273 4.306905 191.6112  112.1 -41.66341      8.613810 0.93 
1 1 1 -41 3  17 o 71.19768 6.240147 142.6991  241.8 -3.278778      12.48029 0.82 
1 1 1 -41 3  18 o 130.9562 3.925020 193.5324  66.5  -12.35496      7.850041 0.94 
1 1 1 -41 3  19 o 180.6891 4.043553 281.6933  41.5  -4.761398      8.087107 0.97 
1 1 1 -41 3  20 o 258.3829 3.736481 363.4758  167.2 -3.675995      7.472962 0.99 
1 1 1 -41 3  21 o 109.1638 4.284289 226.2014  208.0 14.29523       8.568579 0.96 
1 1 1 -41 3  22 o 126.8239 3.759786 183.5113  163.3 -14.50925      7.519572 0.96 
1 1 1 -41 3  23 o 48.98713 10.04447 188.2395  130.8 -13.81358      20.08895 0.89 
1 1 1 -41 3  24 o 160.7486 3.751026 230.1086  97.4  -7.062256      7.502053 0.98 
1 1 1 -41 3  25 o 124.3068 4.760888 120.3422  339.7 -34.06245      9.521775 0.96 
1 1 1 -41 3  26 o 142.6625 4.168850 212.0124  290.4 21.96896       8.337700 0.98 
1 1 1 -41 3  27 o 95.54311 5.658226 76.45685  244.5 -10.01063      11.31645 0.88 
1 1 1 -41 3  28 o 55.04002 9.382497 110.5461  241.5 9.443508       18.76499 0.85 
1 1 1 -41 3  29 f 46.99850 9.930236 54.95573  341.5 -16.38317      19.86047 0.00 
1 1 1 -41 3  30 o 112.0046 4.917315 99.82594  72.9  1.205185       9.834630 0.95 
1 1 1 -41 3  31 o 50.39605 10.67554 69.12302  63.9  -0.6100845     21.35108 0.83 
1 1 1 -41 3  32 o 50.46915 8.723284 45.77816  86.4  -32.61428      17.44657 0.80 
1 1 1 -41 3  33 o 50.42172 9.636974 98.17643  160.4 -14.75146      19.27395 0.91 
1 1 1 -41 3  34 o 66.56116 9.658686 109.3729  116.6 -3.908707      19.31737 0.94 
1 1 1 -41 3  35 o 51.28023 10.10967 63.34524  359.2 ?              ?        0.88 
1 1 1 -41 5  1  o 333.0148 3.545438 476.4586  128.3 -5.342407      7.090875 0.99 
1 1 1 -41 5  2  o 188.7397 3.373506 208.0811  271.6 4.230240       6.747012 0.96 
1 1 1 -41 5  3  o 56.01649 7.710366 98.78364  336.9 -34.22609      15.42073 0.63 
1 1 1 -41 5  4  o 92.56166 4.672812 68.24085  36.5  -3.174309      9.345624 0.63 
1 1 1 -41 5  5  o 168.9820 3.610910 248.2298  272.2 1.814651       7.221820 0.96 
1 1 1 -41 5  6  o 210.1574 3.225889 362.1116  344.4 2.971863       6.451779 0.98 
1 1 1 -41 5  7  o 261.3804 3.375630 356.2177  152.3 5.380127       6.751259 0.98 
1 1 1 -41 5  8  o 39.70921 9.224133 87.63362  125.6 6.793671       18.44827 0.49 
1 1 1 -41 5  9  o 58.89940 7.296575 52.48142  110.2 -26.25289      14.59315 0.46 
1 1 1 -41 5  10 o 86.80240 5.504666 129.8018  353.1 -25.23496      11.00933 0.84 
1 1 1 -41 5  11 o 264.9711 3.850616 330.3163  316.3 20.72298       7.701231 0.98 
1 1 1 -41 5  12 o 157.3704 3.945598 214.3141  28.6  1.545273       7.891196 0.95 
1 1 1 -41 5  13 o 146.7120 3.935966 290.0594  118.3 29.61029       7.871931 0.96 
1 1 1 -41 5  14 o 103.8260 5.019822 110.5342  68.3  -13.23755      10.03964 0.86 
1 1 1 -41 5  15 f 169.0776 3.766398 210.2228  359.8 -10.40349      7.532796 0.00 
1 1 1 -41 5  16 o 156.7778 3.986206 149.6584  127.3 -6.684540      7.972412 0.94 
1 1 1 -41 5  17 o 83.87643 7.902107 111.7922  282.1 0.6969452E-01  15.80421 0.85 
1 1 1 -41 5  18 o 88.56287 5.040497 147.7085  342.3 -4.534187      10.08099 0.91 
1 1 1 -41 5  19 o 91.39735 5.529226 118.4219  144.3 19.30879       11.05845 0.90 
1 1 1 -41 5  20 o 120.1832 4.130192 195.8996  71.3  12.62213       8.260384 0.96 
1 1 1 -41 5  21 o 33.74536 9.230066 5.292851  218.9 -2.682053      18.46013 0.05 
1 1 1 -41 5  22 o 147.3012 3.664357 269.5304  273.7 -1.632431      7.328714 0.98 
1 1 1 -41 5  23 o 213.9700 3.811781 356.4055  358.0 -19.90669      7.623563 0.99 
1 1 1 -41 5  24 o 36.93720 8.946006 121.5245  140.4 -19.76634      17.89201 0.84 
1 1 1 -41 5  25 o 61.96670 8.536669 112.4514  192.7 1.665771       17.07334 0.88 
1 1 1 -41 5  26 o 101.5776 5.794009 206.2018  332.4 -23.59573      11.58802 0.96 
1 1 1 -41 5  27 o 118.8811 5.033566 206.3848  32.9  2.839478       10.06713 0.97 
1 1 1 -41 5  28 o 113.9869 5.335546 210.7381  29.2  21.45566       10.67109 0.97 
1 1 1 -41 5  29 o 103.8044 6.412563 200.5880  340.8 -15.85373      12.82513 0.97 
1 1 1 -41 5  30 o 48.74965 8.472787 65.89399  303.1 -38.46622      16.94557 0.84 
1 1 1 -41 5  31 o 60.74033 10.20947 68.47706  185.1 9.250893       20.41895 0.89 
1 1 1 -41 5  32 o 38.37901 10.77767 45.01585  221.3 5.031021       21.55534 0.70 
1 1 1 -41 5  33 o 41.18568 10.78822 18.97766  198.7 26.58622       21.57644 0.43 
1 1 1 -41 5  34 o 49.09441 10.86400 87.47911  354.4 ?              ?        0.91 
1 1 1 -41 7  1  o 313.3206 3.439570 429.1833  226.3 -26.34036      6.879140 0.99 
1 1 1 -41 7  2  o 194.1803 3.329252 321.2866  202.9 -5.308731      6.658504 0.98 
1 1 1 -41 7  3  o 69.52162 6.285687 153.0684  86.2  -3.245377      12.57137 0.87 
1 1 1 -41 7  4  o 239.8191 3.646747 361.4183  109.8 18.10175       7.293493 0.99 
1 1 1 -41 7  5  o 124.9790 3.748438 182.4582  151.7 -5.776329      7.496876 0.94 
1 1 1 -41 7  6  o 118.0674 4.143533 136.9743  356.4 12.52320       8.287066 0.91 
1 1 1 -41 7  7  o 162.4196 4.040701 221.5029  235.9 -4.939804      8.081403 0.96 
1 1 1 -41 7  8  o 266.6474 3.350193 424.9370  187.3 1.320496       6.700387 0.99 
1 1 1 -41 7  9  o 131.1511 3.744061 205.9494  192.3 4.489166       7.488121 0.95 
1 1 1 -41 7  10 o 146.7014 3.538958 289.4235  145.8 -9.885101      7.077915 0.97 
1 1 1 -41 7  11 o 141.0247 4.375241 250.6069  31.2  49.43170       8.750482 0.96 
1 1 1 -41 7  12 o 142.9171 3.918544 233.7709  68.7  34.39083       7.837088 0.97 
1 1 1 -41 7  13 o 45.24780 8.744531 117.8386  159.3 -3.496349      17.48906 0.75 
1 1 1 -41 7  14 o 147.6499 4.255010 268.9421  35.0  24.37469       8.510020 0.97 
1 1 1 -41 7  15 o 175.8550 4.090737 273.7155  344.7 35.91901       8.181474 0.98 
1 1 1 -41 7  16 o 115.9942 5.113899 168.3233  292.1 10.22000       10.22780 0.95 
1 1 1 -41 7  17 o 155.1663 3.953697 252.3396  356.6 0.4511261      7.907393 0.98 
1 1 1 -41 7  18 o 49.11354 8.903060 81.76351  65.6  23.26247       17.80612 0.73 
1 1 1 -41 7  19 o 57.03271 8.330926 98.30244  301.9 23.54681       16.66185 0.84 
1 1 1 -41 7  20 o 132.8943 4.107476 251.7752  4.6   -2.546783      8.214952 0.98 
1 1 1 -41 7  21 o 99.29211 5.154753 252.6291  35.1  12.94713       10.30951 0.98 
1 1 1 -41 7  22 o 103.7965 6.551144 136.4866  148.6 -39.25298      13.10229 0.95 
1 1 1 -41 7  23 o 74.02896 6.322550 72.53879  197.1 9.326385       12.64510 0.84 
1 1 1 -41 7  24 o 78.94040 7.115285 166.4620  9.4   -1.068634      14.23057 0.94 
1 1 1 -41 7  25 o 94.15723 7.711723 169.5428  58.6  -42.82331      15.42345 0.95 
1 1 1 -41 7  26 o 108.0432 5.746569 197.0834  241.3 34.93506       11.49314 0.97 
1 1 1 -41 7  27 o 48.64404 10.05860 81.98647  33.5  -9.790512      20.11720 0.84 
1 1 1 -41 7  28 o 50.47079 9.235303 91.53185  53.8  43.69985       18.47061 0.89 
1 1 1 -41 7  29 o 61.47022 11.00725 118.7700  273.3 5.352131       22.01449 0.94 
1 1 1 -41 7  30 o 34.28174 9.991015 31.85741  274.0 -3.322235      19.98203 0.56 
1 1 1 -41 7  31 o 75.31775 8.369047 92.56509  206.3 25.13380       16.73809 0.95 
1 1 1 -41 7  32 o 26.80327 8.995967 23.46632  124.8 ?              ?        0.42 
1 1 1 -41 7  33 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -41 9  1  o 218.4795 5.074506 312.4668  94.2  -39.86885      10.14901 0.99 
1 1 1 -41 9  2  o 148.5095 4.152038 200.8617  195.5 -7.808655      8.304075 0.97 
1 1 1 -41 9  3  o 101.1246 5.512048 155.0414  229.0 34.48077       11.02410 0.95 
1 1 1 -41 9  4  o 61.31059 7.358191 113.7821  176.7 -3.343239      14.71638 0.86 
1 1 1 -41 9  5  o 184.5742 4.323995 292.1216  40.8  -17.91170      8.647990 0.98 
1 1 1 -41 9  6  o 130.4619 4.122406 154.5708  346.6 -3.671951      8.244811 0.96 
1 1 1 -41 9  7  o 104.1802 4.792291 158.7388  166.0 4.539833       9.584582 0.95 
1 1 1 -41 9  8  f 74.37750 7.207575 94.32062  194.4 27.08514       14.41515 0.00 
1 1 1 -41 9  9  o 172.4748 3.675210 233.8811  262.6 40.21431       7.350419 0.98 
1 1 1 -41 9  10 o 113.1536 4.300282 216.6218  145.5 9.002579       8.600563 0.97 
1 1 1 -41 9  11 o 96.25682 5.791089 93.73464  232.9 36.87101       11.58218 0.91 
1 1 1 -41 9  12 o 64.30457 7.788290 115.8902  214.8 11.55472       15.57658 0.89 
1 1 1 -41 9  13 o 102.5581 5.191573 169.3252  141.0 -32.68378      10.38315 0.96 
1 1 1 -41 9  14 o 122.4639 4.309213 153.8493  107.1 -11.48577      8.618425 0.97 
1 1 1 -41 9  15 o 84.05199 6.665225 139.6685  126.5 30.84863       13.33045 0.95 
1 1 1 -41 9  16 o 80.50876 6.431101 215.0249  107.3 -10.62189      12.86220 0.97 
1 1 1 -41 9  17 o 169.1912 4.053136 321.9285  64.8  -5.331436      8.106273 0.99 
1 1 1 -41 9  18 o 152.6386 4.141132 255.7640  355.5 -10.00725      8.282265 0.98 
1 1 1 -41 9  19 o 42.61119 9.045957 55.23676  206.6 -26.37394      18.09191 0.58 
1 1 1 -41 9  20 f 135.9757 5.028180 227.1871  186.0 -10.99390      10.05636 0.00 
1 1 1 -41 9  21 o 79.63660 7.742249 143.6496  317.3 -11.52142      15.48450 0.93 
1 1 1 -41 9  22 o 111.7825 5.657081 125.9492  350.2 5.944206       11.31416 0.95 
1 1 1 -41 9  23 o 57.78510 9.933724 91.67424  38.4  -0.5497894     19.86745 0.87 
1 1 1 -41 9  24 o 28.30420 9.392900 27.06815  168.0 20.18172       18.78580 0.33 
1 1 1 -41 9  25 o 90.70232 7.257060 194.7063  146.8 0.1102905      14.51412 0.97 
1 1 1 -41 9  26 o 103.0297 6.442226 160.3078  120.5 19.77666       12.88445 0.98 
1 1 1 -41 9  27 f 30.68029 9.169266 49.63437  32.9  -2.169291      18.33853 0.00 
1 1 1 -41 9  28 o 29.96309 9.560595 54.82289  358.0 1.661272       19.12119 0.71 
1 1 1 -41 9  29 o 33.42543 9.732161 62.47885  20.7  -5.857950      19.46432 0.80 
1 1 1 -41 9  30 o 32.72883 10.18577 51.88053  160.0 ?              ?        0.76 
1 1 1 -41 11 1  o 225.4172 4.636554 354.0614  259.1 -16.20927      9.273108 0.99 
1 1 1 -41 11 2  o 221.8843 3.770634 331.4159  254.8 -4.268936      7.541267 0.99 
1 1 1 -41 11 3  o 42.70278 9.788686 23.72514  136.5 -12.01978      19.57737 0.29 
1 1 1 -41 11 4  o 226.3145 4.362117 383.3683  44.3  45.25645       8.724234 0.99 
1 1 1 -41 11 5  o 188.1990 4.727781 323.0106  32.2  -8.576309      9.455563 0.99 
1 1 1 -41 11 6  o 48.27081 10.35711 58.84706  325.5 -10.80780      20.71422 0.64 
1 1 1 -41 11 7  o 128.8556 5.264390 172.3625  209.4 -22.86556      10.52878 0.96 
1 1 1 -41 11 8  o 49.15295 10.94734 93.74496  348.2 18.68993       21.89469 0.79 
1 1 1 -41 11 9  o 106.9610 5.260444 176.1082  15.8  -9.170959      10.52089 0.96 
1 1 1 -41 11 10 f 134.3667 4.233299 235.2443  253.5 -9.961365      8.466599 0.00 
1 1 1 -41 11 11 o 106.0289 5.158758 125.8515  116.0 -6.474098      10.31752 0.94 
1 1 1 -41 11 12 o 202.5293 3.785459 310.5123  37.5  0.6129150      7.570918 0.99 
1 1 1 -41 11 13 o 89.63261 6.273636 162.0571  338.9 -8.189583      12.54727 0.95 
1 1 1 -41 11 14 o 101.4645 6.407309 168.6132  308.5 -22.46473      12.81462 0.96 
1 1 1 -41 11 15 o 127.9533 5.652958 206.3675  68.6  7.250237       11.30592 0.97 
1 1 1 -41 11 16 o 149.7301 4.514336 175.1970  113.4 22.67181       9.028672 0.98 
1 1 1 -41 11 17 o 85.85072 6.239575 159.4984  41.8  -1.469856      12.47915 0.95 
1 1 1 -41 11 18 o 106.2176 5.967609 154.2092  23.5  -23.01469      11.93522 0.97 
1 1 1 -41 11 19 o 49.28002 11.40281 96.93733  356.2 8.287106       22.80563 0.87 
1 1 1 -41 11 20 o 66.74097 9.085981 122.9195  32.6  20.96149       18.17196 0.94 
1 1 1 -41 11 21 o 71.97913 8.692920 167.7541  339.8 -5.859535      17.38584 0.96 
1 1 1 -41 11 22 o 61.04710 10.03598 121.7243  311.9 -10.85446      20.07196 0.95 
1 1 1 -41 11 23 o 75.75353 9.407478 171.2885  281.5 -10.33150      18.81496 0.97 
1 1 1 -41 11 24 o 79.04066 8.511555 164.1191  266.9 -18.62097      17.02311 0.97 
1 1 1 -41 11 25 o 72.70816 8.623978 125.0462  166.0 14.71857       17.24796 0.96 
1 1 1 -41 11 26 o 42.28691 10.55984 54.52003  181.8 -2.999893      21.11968 0.82 
1 1 1 -41 11 27 o 31.97025 9.313657 81.32353  202.2 ?              ?        0.87 
1 1 1 -41 13 1  o 90.03563 6.144895 150.9515  322.3 -20.49014      12.28979 0.97 
1 1 1 -41 13 2  o 38.40571 10.70287 56.15991  331.5 8.116165       21.40574 0.75 
1 1 1 -41 13 3  o 33.44333 9.745363 46.07804  61.9  -12.69874      19.49073 0.64 
1 1 1 -41 13 4  o 117.0417 5.777234 263.8162  174.7 17.09605       11.55447 0.99 
1 1 1 -41 13 5  o 135.1590 4.963219 234.2330  178.4 6.494934       9.926437 0.99 
1 1 1 -41 13 6  o 72.23169 9.121346 103.3359  254.5 64.42561       18.24269 0.94 
1 1 1 -41 13 7  o 33.00021 9.738324 23.56620  161.3 7.231190       19.47665 0.38 
1 1 1 -41 13 8  o 51.65479 11.96139 140.6196  151.4 9.028767       23.92278 0.93 
1 1 1 -41 13 9  o 137.1709 5.592287 181.6506  24.0  8.584930       11.18457 0.98 
1 1 1 -41 13 10 o 48.78679 11.86772 29.63370  117.0 -1.330662      23.73544 0.58 
1 1 1 -41 13 11 o 56.91748 11.75358 80.02161  149.8 -1.637444      23.50716 0.89 
1 1 1 -41 13 12 o 49.62207 10.77512 95.47717  78.6  -25.61956      21.55025 0.90 
1 1 1 -41 13 13 f 103.0041 7.343007 184.9231  61.4  -27.55923      14.68601 0.00 
1 1 1 -41 13 14 o 44.04433 13.94381 94.88798  247.6 -18.21061      27.88761 0.88 
1 1 1 -41 13 15 o 97.08341 6.813157 193.7788  294.9 -5.509979      13.62631 0.98 
1 1 1 -41 13 16 o 58.02166 10.63918 108.1114  53.9  -19.61111      21.27836 0.94 
1 1 1 -41 13 17 o 123.2397 5.773290 226.8265  61.3  -2.702835      11.54658 0.99 
1 1 1 -41 13 18 o 35.98629 11.02243 77.01849  328.8 1.461891       22.04486 0.84 
1 1 1 -41 13 19 o 57.12930 11.45688 61.26851  234.4 17.63998       22.91377 0.88 
1 1 1 -41 13 20 o 28.10907 9.139572 31.35408  159.7 2.498888       18.27914 0.54 
1 1 1 -41 13 21 o 53.82294 11.03931 88.97009  180.2 -20.87111      22.07862 0.92 
1 1 1 -41 13 22 o 51.78654 10.55848 71.20028  165.6 ?              ?        0.90 
1 1 1 -41 15 1  x ?        ?        30.90487  210.7 ?              ?        0.00 
1 1 1 -41 15 2  o 33.81744 10.42534 46.51245  324.8 ?              ?        0.75 
1 1 1 -41 15 3  o 51.16615 10.78144 94.05598  337.1 ?              ?        0.93 
1 1 1 -41 15 4  o 36.33022 10.50942 83.44863  211.5 ?              ?        0.88 
1 1 1 -41 15 5  o 33.76851 9.764989 74.62211  195.9 ?              ?        0.86 
1 1 1 -41 15 6  o 28.16692 9.414259 48.52908  308.2 ?              ?        0.72 
1 1 1 -41 15 7  o 43.52428 12.01970 101.6263  196.6 ?              ?        0.91 
1 1 1 -41 15 8  o 30.51474 10.08799 42.66062  251.9 ?              ?        0.69 
1 1 1 -41 15 9  o 85.75496 9.785798 159.3327  336.2 ?              ?        0.98 
1 1 1 -41 15 10 o 58.90682 13.70915 116.3589  256.7 ?              ?        0.94 
1 1 1 -41 15 11 o 38.76772 12.11586 103.5923  231.7 ?              ?        0.90 
1 1 1 -41 15 12 o 56.49629 13.67618 87.00769  237.1 ?              ?        0.91 
1 1 1 -41 15 13 o 77.27122 11.38830 130.9587  213.3 ?              ?        0.97 
1 1 1 -41 15 14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -40 0  1  o 17.69717 11.41626 37.57389  360.0 -0.000000      0.000000 0.05 
1 1 1 -40 0  2  o 516.8539 5.973241 711.2882  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  3  o 207.9380 5.139898 292.6114  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  4  o 44.67043 16.27427 68.13739  180.0 -0.000000      0.000000 0.17 
1 1 1 -40 0  5  o 193.0700 4.982745 506.2307  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  6  o 119.9546 6.566425 6.420151  180.0 -0.000000      0.000000 0.03 
1 1 1 -40 0  7  o 320.8294 5.853955 543.3672  180.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  8  o 240.9588 5.321197 275.0756  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  9  o 333.6985 5.814538 530.1605  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  10 o 85.44859 9.356058 363.3983  180.0 -0.000000      0.000000 0.94 
1 1 1 -40 0  11 o 109.7172 7.031014 16.91516  180.0 -0.000000      0.000000 0.15 
1 1 1 -40 0  12 o 40.61055 16.16123 60.19467  180.0 -0.000000      0.000000 0.19 
1 1 1 -40 0  13 o 100.3687 7.528023 201.9988  0.0   -0.000000      0.000000 0.92 
1 1 1 -40 0  14 o 71.63133 9.050336 171.8571  0.0   -0.000000      0.000000 0.82 
1 1 1 -40 0  15 o 172.8591 5.103839 287.5717  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  16 o 69.96372 8.807410 213.2281  0.0   -0.000000      0.000000 0.95 
1 1 1 -40 0  17 o 136.8773 5.608763 236.3819  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  18 o 93.93272 6.404590 235.5860  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  19 o 207.1815 4.641689 260.8792  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  20 o 364.4113 5.812333 748.5747  180.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  21 o 159.1995 5.208119 251.1819  180.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  22 o 295.3733 5.484698 384.6093  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  23 o 21.06288 14.01167 6.291548  180.0 -0.000000      0.000000 0.03 
1 1 1 -40 0  24 o 129.0832 6.162517 240.5936  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  25 o 220.4568 5.170537 293.6427  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  26 o 134.2416 5.854598 250.2486  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  27 o 127.9243 8.989187 170.9838  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  28 o 62.43291 15.13609 141.5749  180.0 -0.000000      0.000000 0.99 
1 1 1 -40 0  29 o 195.7287 5.828051 238.8107  180.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  30 o 158.3094 5.747290 244.2695  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  31 o 75.31010 9.203081 123.8194  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  32 o 81.89565 10.36972 151.7715  180.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  33 o 188.8651 5.804644 285.9972  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  34 o 135.3508 7.674449 190.7660  360.0 -0.000000      0.000000 1.00 
1 1 1 -40 0  35 o 57.19565 12.85006 106.4474  0.0   -0.000000      0.000000 1.00 
1 1 1 -40 0  36 o 19.72203 13.67928 16.00827  0.0   ?              ?        0.23 
1 1 1 -40 2  1  o 142.8969 3.535699 102.3016  118.7 -29.58409      7.071397 0.78 
1 1 1 -40 2  2  o 162.2647 3.590075 237.3833  68.7  -49.59331      7.180151 0.92 
1 1 1 -40 2  3  o 465.9764 4.304105 587.6945  207.3 -7.898560      8.608210 0.99 
1 1 1 -40 2  4  o 104.8629 4.351369 214.3774  179.8 29.07915       8.702738 0.83 
1 1 1 -40 2  5  o 55.64147 7.820805 166.0558  46.3  -28.04371      15.64161 0.56 
1 1 1 -40 2  6  o 259.4660 3.852466 255.4841  309.9 -16.40833      7.704933 0.94 
1 1 1 -40 2  7  o 226.7742 3.541686 264.9787  6.3   45.30374       7.083371 0.94 
1 1 1 -40 2  8  o 370.0303 4.385774 489.0681  220.4 25.76337       8.771548 0.98 
1 1 1 -40 2  9  o 145.4296 3.953439 231.0575  294.8 -19.34161      7.906878 0.90 
1 1 1 -40 2  10 o 336.0161 4.378801 592.7194  110.4 -15.68481      8.757602 0.98 
1 1 1 -40 2  11 o 152.4506 3.895039 187.5733  73.8  19.14243       7.790079 0.88 
1 1 1 -40 2  12 o 278.6008 3.935256 459.4770  238.8 62.42751       7.870512 0.98 
1 1 1 -40 2  13 o 176.8714 3.908095 242.3654  263.8 -4.774048      7.816191 0.93 
1 1 1 -40 2  14 o 82.03562 6.067519 128.0548  123.4 12.78716       12.13504 0.73 
1 1 1 -40 2  15 o 42.24737 8.770062 81.56476  10.8  -23.94047      17.54012 0.38 
1 1 1 -40 2  16 o 204.4318 3.498363 272.2334  7.9   2.696426       6.996726 0.97 
1 1 1 -40 2  17 o 90.51080 4.971552 175.9721  276.8 -2.954544      9.943105 0.89 
1 1 1 -40 2  18 o 159.1697 3.221620 235.5646  335.4 2.199493       6.443240 0.96 
1 1 1 -40 2  19 o 200.0231 3.396773 253.4380  278.3 13.97435       6.793546 0.97 
1 1 1 -40 2  20 o 116.0613 3.869567 158.8590  58.7  12.22437       7.739134 0.92 
1 1 1 -40 2  21 o 71.73602 6.178337 107.5910  352.0 -35.58057      12.35667 0.81 
1 1 1 -40 2  22 o 104.5214 4.239569 169.8229  22.1  2.610779       8.479138 0.94 
1 1 1 -40 2  23 o 36.32685 8.564537 32.41532  282.6 16.96113       17.12907 0.28 
1 1 1 -40 2  24 o 137.4269 3.770647 214.9439  132.1 -5.327606      7.541294 0.97 
1 1 1 -40 2  25 o 92.45495 5.398107 143.8755  212.5 -17.20139      10.79621 0.94 
1 1 1 -40 2  26 o 132.9680 4.127713 200.4337  172.4 -9.448120      8.255425 0.98 
1 1 1 -40 2  27 o 79.52716 6.010537 99.35201  247.0 -3.559044      12.02107 0.91 
1 1 1 -40 2  28 o 57.41816 8.610031 23.94984  248.1 -37.46754      17.22006 0.36 
1 1 1 -40 2  29 o 139.4712 4.459832 191.3228  271.6 12.50092       8.919663 0.97 
1 1 1 -40 2  30 o 100.1970 6.216821 142.5673  269.3 8.887062       12.43364 0.95 
1 1 1 -40 2  31 o 32.56461 9.621078 30.91504  313.1 1.761284       19.24216 0.40 
1 1 1 -40 2  32 o 96.35591 6.391254 125.0953  343.0 -29.17690      12.78251 0.96 
1 1 1 -40 2  33 o 56.25986 10.51348 105.8990  284.5 3.040508       21.02696 0.93 
1 1 1 -40 2  34 o 55.24328 9.455742 68.83788  295.0 31.89421       18.91148 0.88 
1 1 1 -40 2  35 o 93.99065 7.190599 144.3246  233.9 26.61477       14.38120 0.97 
1 1 1 -40 2  36 o 162.0279 5.220367 212.6794  187.4 ?              ?        0.99 
1 1 1 -40 4  1  o 269.6032 3.339101 257.6735  80.4  59.99382       6.678202 0.97 
1 1 1 -40 4  2  o 128.7878 3.554175 202.3130  220.1 -15.00885      7.108351 0.92 
1 1 1 -40 4  3  o 204.8702 3.254004 220.3888  291.3 -7.642776      6.508008 0.95 
1 1 1 -40 4  4  f 93.72351 4.322669 80.32022  108.3 -23.32233      8.645337 0.00 
1 1 1 -40 4  5  f 55.91924 8.058038 53.72434  86.5  29.39561       16.11608 0.00 
1 1 1 -40 4  6  o 266.2679 3.283111 437.1683  306.1 11.76047       6.566222 0.98 
1 1 1 -40 4  7  o 364.5773 3.898445 447.2537  227.8 -32.82791      7.796890 0.98 
1 1 1 -40 4  8  o 365.6514 4.003426 529.2919  245.2 2.014832       8.006851 0.99 
1 1 1 -40 4  9  o 139.4037 4.109460 111.5606  254.9 11.61072       8.218920 0.83 
1 1 1 -40 4  10 o 167.6348 3.557002 320.0983  222.1 17.75548       7.114003 0.96 
1 1 1 -40 4  11 o 139.3725 3.862050 149.0921  271.4 30.11550       7.724100 0.90 
1 1 1 -40 4  12 o 71.42995 7.534868 5.166632  270.7 29.66885       15.06974 0.11 
1 1 1 -40 4  13 o 144.9814 3.825719 170.4513  315.0 -7.822678      7.651437 0.94 
1 1 1 -40 4  14 o 229.2941 3.903047 262.9027  8.9   -63.85347      7.806093 0.97 
1 1 1 -40 4  15 o 124.7952 4.338265 269.0140  159.4 5.464455       8.676530 0.95 
1 1 1 -40 4  16 o 239.7306 4.302525 307.0692  145.0 11.70668       8.605049 0.98 
1 1 1 -40 4  17 o 240.1703 3.703155 283.7306  148.6 8.663376       7.406310 0.98 
1 1 1 -40 4  18 o 210.3877 3.481402 316.4243  120.7 -20.04727      6.962803 0.98 
1 1 1 -40 4  19 o 87.13042 5.044660 150.3626  356.7 -31.12340      10.08932 0.89 
1 1 1 -40 4  20 f 49.38367 9.565593 34.55519  98.0  25.79150       19.13119 0.00 
1 1 1 -40 4  21 o 260.9817 3.573169 390.7251  154.0 37.33904       7.146339 0.99 
1 1 1 -40 4  22 o 133.2529 3.874130 249.0221  177.9 12.53757       7.748260 0.97 
1 1 1 -40 4  23 o 115.5004 3.954828 237.3482  351.5 1.820015       7.909656 0.97 
1 1 1 -40 4  24 o 196.5046 3.895902 338.6762  168.0 23.16463       7.791805 0.99 
1 1 1 -40 4  25 o 185.6069 3.641630 273.8984  221.1 10.28819       7.283260 0.99 
1 1 1 -40 4  26 o 127.8157 4.861668 178.5395  341.4 -24.78449      9.723335 0.97 
1 1 1 -40 4  27 o 39.16234 9.176282 66.76359  141.4 -10.32065      18.35256 0.59 
1 1 1 -40 4  28 o 175.5339 4.317461 268.6082  212.4 2.406555       8.634922 0.98 
1 1 1 -40 4  29 o 113.6039 5.221350 217.6801  305.7 2.550468       10.44270 0.97 
1 1 1 -40 4  30 o 176.6611 4.255218 252.0156  58.3  -17.80521      8.510435 0.99 
1 1 1 -40 4  31 f 142.1737 5.411386 248.1356  149.7 -20.21555      10.82277 0.00 
1 1 1 -40 4  32 o 60.11069 10.05914 75.53248  338.4 0.2755127      20.11828 0.90 
1 1 1 -40 4  33 o 58.37850 10.10148 78.09815  321.0 19.42034       20.20297 0.90 
1 1 1 -40 4  34 o 31.63926 9.707609 3.189978  140.2 20.98963       19.41522 0.07 
1 1 1 -40 4  35 o 42.77528 10.90964 68.84427  356.2 ?              ?        0.87 
1 1 1 -40 6  1  o 144.7545 3.153119 121.4110  99.1  -18.09097      6.306239 0.90 
1 1 1 -40 6  2  o 277.6722 3.343501 313.9313  13.6  -31.82901      6.687002 0.98 
1 1 1 -40 6  3  o 100.5019 5.069407 184.0543  191.1 40.04946       10.13881 0.91 
1 1 1 -40 6  4  o 133.7298 3.870549 305.1155  161.4 41.29691       7.741098 0.96 
1 1 1 -40 6  5  f 39.44344 9.035763 72.12106  178.7 9.105801       18.07153 0.00 
1 1 1 -40 6  6  o 119.0428 4.337026 143.2606  120.1 33.77798       8.674051 0.89 
1 1 1 -40 6  7  o 114.7286 3.837766 102.9988  174.3 -0.8888245E-01 7.675533 0.84 
1 1 1 -40 6  8  o 123.4337 4.242516 112.3890  343.1 -24.60291      8.485031 0.89 
1 1 1 -40 6  9  o 77.56680 5.732051 212.5690  303.4 -30.61091      11.46410 0.89 
1 1 1 -40 6  10 o 123.9216 4.904110 220.7906  118.8 22.65450       9.808221 0.94 
1 1 1 -40 6  11 o 156.1701 4.017496 195.1603  310.3 38.49895       8.034991 0.95 
1 1 1 -40 6  12 f 87.72415 6.259979 154.4829  9.3   33.35982       12.51996 0.00 
1 1 1 -40 6  13 o 289.9857 4.039533 468.9510  239.1 -15.70901      8.079065 0.99 
1 1 1 -40 6  14 o 158.3578 5.028537 264.1527  238.0 -3.785843      10.05707 0.96 
1 1 1 -40 6  15 f 156.8662 4.290008 215.4846  14.0  49.59129       8.580016 0.00 
1 1 1 -40 6  16 o 239.7411 3.856409 412.0910  54.3  26.20877       7.712819 0.99 
1 1 1 -40 6  17 f 135.2202 4.271275 303.5038  21.5  47.26285       8.542550 0.00 
1 1 1 -40 6  18 o 144.4356 4.067058 198.5916  124.3 -16.37610      8.134115 0.97 
1 1 1 -40 6  19 o 107.1004 4.502037 131.8958  171.5 -3.785767      9.004073 0.93 
1 1 1 -40 6  20 o 159.7696 3.643483 298.2889  36.8  0.4460449      7.286966 0.98 
1 1 1 -40 6  21 f 91.45367 5.174841 86.12077  92.5  -10.04103      10.34968 0.00 
1 1 1 -40 6  22 o 83.03716 5.620775 130.5187  137.0 18.56882       11.24155 0.94 
1 1 1 -40 6  23 o 169.0068 3.871035 274.1140  287.7 -17.32292      7.742071 0.99 
1 1 1 -40 6  24 o 211.6445 3.672695 359.3945  223.9 -20.99428      7.345390 0.99 
1 1 1 -40 6  25 f 71.46704 8.289045 138.1506  294.8 -9.787285      16.57809 0.00 
1 1 1 -40 6  26 o 66.15473 8.503797 67.99839  296.4 -6.184429      17.00759 0.80 
1 1 1 -40 6  27 o 63.79452 9.044034 75.80691  353.0 -0.2254448     18.08807 0.83 
1 1 1 -40 6  28 o 43.51654 10.38069 96.72234  48.0  14.98564       20.76138 0.83 
1 1 1 -40 6  29 o 106.5394 6.332404 196.0931  310.7 -0.2886047     12.66481 0.98 
1 1 1 -40 6  30 o 51.37985 11.36561 104.2041  231.5 3.847198       22.73121 0.91 
1 1 1 -40 6  31 o 35.84773 10.54520 68.48946  260.7 7.322762       21.09039 0.81 
1 1 1 -40 6  32 o 32.91639 10.24945 65.01034  110.8 1.315460       20.49889 0.78 
1 1 1 -40 6  33 o 40.03770 11.45641 18.57088  274.9 3.730812       22.91283 0.43 
1 1 1 -40 6  34 o 48.75318 11.04184 41.82035  59.4  ?              ?        0.81 
1 1 1 -40 8  1  o 131.1863 4.815928 223.5562  167.8 -10.70532      9.631855 0.97 
1 1 1 -40 8  2  o 245.5989 3.441966 379.9529  173.9 4.485229       6.883932 0.99 
1 1 1 -40 8  3  o 33.06903 8.807529 38.65104  5.6   12.32246       17.61506 0.29 
1 1 1 -40 8  4  o 172.5513 4.218886 303.8203  336.3 -23.15051      8.437773 0.98 
1 1 1 -40 8  5  o 89.98129 5.259820 139.3056  100.6 -19.36337      10.51964 0.91 
1 1 1 -40 8  6  o 194.9832 3.433238 358.0309  102.7 13.81746       6.866475 0.98 
1 1 1 -40 8  7  o 53.13908 8.448853 77.57552  79.7  -26.49923      16.89771 0.67 
1 1 1 -40 8  8  o 87.45055 6.794108 137.2953  348.5 24.17476       13.58822 0.90 
1 1 1 -40 8  9  o 137.7091 3.708348 225.8180  292.2 48.94477       7.416695 0.97 
1 1 1 -40 8  10 o 72.33581 7.105672 131.6358  324.0 -26.54173      14.21134 0.89 
1 1 1 -40 8  11 o 103.1311 5.032115 177.0194  334.1 1.548706       10.06423 0.94 
1 1 1 -40 8  12 o 107.2860 4.862763 151.8909  32.6  27.92091       9.725527 0.94 
1 1 1 -40 8  13 o 94.48862 5.450154 161.3289  113.4 -38.62121      10.90031 0.94 
1 1 1 -40 8  14 o 109.3128 4.695607 178.7945  339.8 4.098495       9.391213 0.95 
1 1 1 -40 8  15 o 138.6765 4.220479 185.5372  236.6 -0.5020142     8.440959 0.97 
1 1 1 -40 8  16 o 229.7773 3.735420 342.4248  238.8 14.00511       7.470840 0.99 
1 1 1 -40 8  17 o 32.35271 9.141608 71.86141  140.1 -12.77734      18.28322 0.58 
1 1 1 -40 8  18 o 91.16665 5.553138 131.6556  61.2  -2.097549      11.10628 0.94 
1 1 1 -40 8  19 o 49.54113 9.556519 90.63577  237.1 -12.65479      19.11304 0.84 
1 1 1 -40 8  20 o 126.5957 4.117473 229.0208  189.2 20.22983       8.234946 0.98 
1 1 1 -40 8  21 o 35.79939 9.776387 59.11499  307.9 11.52796       19.55277 0.58 
1 1 1 -40 8  22 o 51.25266 9.237073 104.0438  201.7 16.19093       18.47415 0.82 
1 1 1 -40 8  23 f 146.7155 4.345539 125.2958  342.0 1.769058       8.691078 0.00 
1 1 1 -40 8  24 o 32.67077 9.369450 53.83153  87.8  0.9070663      18.73890 0.51 
1 1 1 -40 8  25 o 80.76877 6.576881 131.5863  235.5 35.06626       13.15376 0.94 
1 1 1 -40 8  26 o 93.95472 6.572519 137.5435  334.5 13.04237       13.14504 0.96 
1 1 1 -40 8  27 o 123.7081 5.701293 210.5936  38.0  -17.62979      11.40259 0.98 
1 1 1 -40 8  28 o 38.41945 9.147180 34.90171  150.2 -19.66016      18.29436 0.64 
1 1 1 -40 8  29 o 57.06591 11.22061 82.53568  177.5 38.80860       22.44122 0.91 
1 1 1 -40 8  30 o 52.47495 10.79626 131.0349  198.1 -10.83648      21.59251 0.94 
1 1 1 -40 8  31 o 76.01396 10.32276 157.1054  231.9 -37.49828      20.64553 0.97 
1 1 1 -40 8  32 o 33.74206 10.10286 10.20325  313.1 ?              ?        0.25 
1 1 1 -40 10 1  o 75.69860 6.773973 166.9295  94.6  -9.768051      13.54795 0.95 
1 1 1 -40 10 2  o 149.2574 4.746212 163.5105  280.7 -14.89369      9.492425 0.98 
1 1 1 -40 10 3  o 106.0146 5.041747 160.1441  261.6 19.55512       10.08349 0.96 
1 1 1 -40 10 4  o 172.4587 4.401635 247.5567  222.0 -18.52412      8.803269 0.99 
1 1 1 -40 10 5  o 148.3977 4.173635 172.2959  229.3 6.358658       8.347270 0.97 
1 1 1 -40 10 6  f 178.1635 4.076491 219.5392  8.5   -12.19923      8.152983 0.00 
1 1 1 -40 10 7  o 192.6826 3.656327 287.4504  141.2 -6.348190      7.312655 0.99 
1 1 1 -40 10 8  o 75.85206 8.611660 118.1808  318.5 7.868958       17.22332 0.92 
1 1 1 -40 10 9  o 202.7459 3.987076 308.4856  337.8 25.13063       7.974152 0.99 
1 1 1 -40 10 10 o 38.94771 9.828279 28.96354  49.0  -10.72410      19.65656 0.39 
1 1 1 -40 10 11 o 32.52530 9.268261 65.11240  343.5 -6.667387      18.53652 0.64 
1 1 1 -40 10 12 o 50.75965 7.872538 69.92216  272.7 -44.51118      15.74508 0.82 
1 1 1 -40 10 13 o 34.14639 9.882069 56.18958  170.6 -5.699890      19.76414 0.61 
1 1 1 -40 10 14 o 53.73867 8.338367 153.9474  340.8 36.53164       16.67673 0.92 
1 1 1 -40 10 15 o 224.9005 3.611163 394.8751  351.9 -5.287430      7.222325 0.99 
1 1 1 -40 10 16 o 198.5328 4.068837 301.0510  353.3 15.83327       8.137673 0.99 
1 1 1 -40 10 17 o 106.3003 5.896999 176.1587  305.5 0.7258987      11.79400 0.96 
1 1 1 -40 10 18 o 61.51992 8.219051 113.4135  284.2 -48.58896      16.43810 0.88 
1 1 1 -40 10 19 o 52.75671 10.04312 109.0746  283.8 30.37494       20.08623 0.85 
1 1 1 -40 10 20 o 77.37842 7.814230 127.2887  27.4  -18.53223      15.62846 0.93 
1 1 1 -40 10 21 o 30.64518 9.417814 68.92643  183.5 8.671412       18.83563 0.63 
1 1 1 -40 10 22 o 31.61016 9.755346 68.22972  204.4 18.10660       19.51069 0.68 
1 1 1 -40 10 23 o 59.99422 10.57870 85.39527  214.3 9.589554       21.15740 0.89 
1 1 1 -40 10 24 o 61.67100 9.541070 104.6941  262.5 3.440914       19.08214 0.93 
1 1 1 -40 10 25 o 73.37758 9.203369 132.8833  320.0 -15.58633      18.40674 0.96 
1 1 1 -40 10 26 o 123.2724 6.178689 236.3657  347.2 1.570618       12.35738 0.99 
1 1 1 -40 10 27 o 38.69454 10.65030 58.05449  88.8  3.106792       21.30061 0.79 
1 1 1 -40 10 28 o 34.07988 10.58108 123.9085  113.0 4.478088       21.16216 0.91 
1 1 1 -40 10 29 o 38.05998 10.85700 49.11686  81.9  ?              ?        0.78 
1 1 1 -40 12 1  o 90.22757 5.995671 64.29104  265.0 23.05359       11.99134 0.88 
1 1 1 -40 12 2  o 40.20813 10.02721 30.29266  232.2 5.877708       20.05443 0.40 
1 1 1 -40 12 3  o 82.07649 6.834649 76.21201  173.9 -3.905708      13.66930 0.88 
1 1 1 -40 12 4  o 73.47284 7.980987 54.86626  95.3  -18.42106      15.96197 0.80 
1 1 1 -40 12 5  o 64.39162 8.779481 125.8999  38.8  -17.22708      17.55896 0.91 
1 1 1 -40 12 6  f 86.03605 7.195580 91.92325  258.6 31.19806       14.39116 0.00 
1 1 1 -40 12 7  o 39.82798 10.01998 53.29609  29.6  -14.68643      20.03995 0.58 
1 1 1 -40 12 8  f 97.16898 6.511909 148.7529  2.6   11.74920       13.02382 0.00 
1 1 1 -40 12 9  o 102.0478 6.339250 126.6736  291.0 -6.668388      12.67850 0.95 
1 1 1 -40 12 10 o 146.0702 4.579281 213.7040  265.4 -32.53873      9.158562 0.98 
1 1 1 -40 12 11 o 64.16151 11.61620 82.63630  64.7  1.354267       23.23240 0.85 
1 1 1 -40 12 12 o 185.8384 4.121726 334.2207  42.5  -4.639297      8.243451 0.99 
1 1 1 -40 12 13 o 148.0845 4.844164 273.7763  67.1  1.698837       9.688329 0.99 
1 1 1 -40 12 14 o 54.46438 10.29582 111.4662  71.0  -18.48505      20.59164 0.89 
1 1 1 -40 12 15 o 60.28536 9.169872 56.32489  18.4  32.98134       18.33974 0.81 
1 1 1 -40 12 16 o 104.7825 5.979674 138.7623  20.3  20.56166       11.95935 0.97 
1 1 1 -40 12 17 o 110.5206 6.366079 225.3777  42.1  -7.309738      12.73216 0.98 
1 1 1 -40 12 18 o 105.4949 6.070570 164.0844  32.5  -5.660622      12.14114 0.98 
1 1 1 -40 12 19 o 43.33913 10.29248 71.32091  1.1   -12.49718      20.58496 0.85 
1 1 1 -40 12 20 o 76.54463 9.094967 146.3359  330.3 -15.33218      18.18993 0.97 
1 1 1 -40 12 21 o 132.5085 5.936636 230.9048  311.6 -19.80406      11.87327 0.99 
1 1 1 -40 12 22 o 67.21231 8.899634 161.4639  248.3 -1.518944      17.79927 0.97 
1 1 1 -40 12 23 o 50.75376 9.001403 116.3072  176.5 -27.46789      18.00281 0.94 
1 1 1 -40 12 24 o 24.88939 8.332317 76.47104  110.0 6.975353       16.66463 0.81 
1 1 1 -40 12 25 o 34.04478 9.908381 58.67785  178.5 ?              ?        0.82 
1 1 1 -40 14 1  o 105.6419 6.104599 191.2569  290.2 33.65229       12.20920 0.98 
1 1 1 -40 14 2  o 71.30960 9.244493 124.5448  346.4 43.31615       18.48899 0.96 
1 1 1 -40 14 3  o 93.52313 6.998805 147.9311  6.1   19.43601       13.99761 0.98 
1 1 1 -40 14 4  o 38.47831 10.74905 35.39693  310.6 -2.869629      21.49809 0.65 
1 1 1 -40 14 5  o 81.27320 7.351466 134.8609  218.8 -2.891693      14.70293 0.97 
1 1 1 -40 14 6  o 47.91896 11.53991 58.53805  113.9 3.149883       23.07983 0.84 
1 1 1 -40 14 7  o 189.6525 5.291805 317.2127  102.7 -6.336639      10.58361 0.99 
1 1 1 -40 14 8  o 83.64259 8.880137 154.2971  88.1  -17.92704      17.76027 0.97 
1 1 1 -40 14 9  o 114.4460 6.512568 191.1854  357.4 22.38085       13.02514 0.99 
1 1 1 -40 14 10 o 36.90611 11.21136 44.80014  27.2  3.672497       22.42273 0.71 
1 1 1 -40 14 11 o 86.70351 9.063931 101.5232  115.5 -12.89037      18.12786 0.96 
1 1 1 -40 14 12 o 55.23074 10.86310 106.9062  103.2 -27.38504      21.72621 0.93 
1 1 1 -40 14 13 o 47.88359 12.72590 107.9587  125.8 3.381088       25.45180 0.91 
1 1 1 -40 14 14 o 45.11983 12.29625 70.97673  296.1 0.5491562      24.59249 0.85 
1 1 1 -40 14 15 o 32.34373 10.86538 60.51242  244.0 14.84492       21.73076 0.77 
1 1 1 -40 14 16 o 56.31122 13.32167 61.74413  218.1 11.61583       26.64334 0.86 
1 1 1 -40 14 17 o 61.30687 12.27834 100.7939  149.0 8.590683       24.55668 0.93 
1 1 1 -40 14 18 o 51.63639 12.64741 45.77254  158.5 ?              ?        0.81 
1 1 1 -40 14 19 o 50.36776 11.74455 99.26934  105.9 ?              ?        0.93 
1 1 1 -40 14 20 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -39 1  1  o 198.5045 2.914814 336.1903  169.0 17.05353       5.829628 0.94 
1 1 1 -39 1  2  o 27.52864 8.281851 87.78406  25.5  4.726788       16.56370 0.16 
1 1 1 -39 1  3  o 281.1287 3.595840 364.7166  203.8 -6.001221      7.191681 0.95 
1 1 1 -39 1  4  o 341.1589 4.298362 314.7635  168.1 0.4765320      8.596724 0.96 
1 1 1 -39 1  5  o 471.3647 5.124610 703.0338  127.1 48.88068       10.24922 0.99 
1 1 1 -39 1  6  o 574.9504 5.534455 725.5426  277.9 15.66034       11.06891 0.99 
1 1 1 -39 1  7  o 95.40199 5.535751 205.0201  200.2 16.98279       11.07150 0.65 
1 1 1 -39 1  8  o 483.1124 5.194735 593.9719  142.7 -26.91467      10.38947 0.98 
1 1 1 -39 1  9  o 298.1791 4.029346 302.2074  239.2 15.97018       8.058692 0.95 
1 1 1 -39 1  10 o 271.8978 3.920906 348.4218  354.6 -6.348602      7.841812 0.95 
1 1 1 -39 1  11 o 120.2066 4.403845 244.3294  349.8 -37.83112      8.807691 0.85 
1 1 1 -39 1  12 o 272.3465 3.945679 404.8687  161.2 22.26511       7.891358 0.96 
1 1 1 -39 1  13 o 172.3865 3.795411 160.4216  287.1 15.35065       7.590821 0.86 
1 1 1 -39 1  14 o 200.6359 3.638225 187.9406  88.0  -1.483765      7.276450 0.92 
1 1 1 -39 1  15 o 178.1600 3.646865 324.2807  261.8 -22.42549      7.293731 0.95 
1 1 1 -39 1  16 o 398.5721 4.544185 548.9741  0.7   -17.60861      9.088369 0.99 
1 1 1 -39 1  17 o 329.5820 4.202099 435.0237  16.1  14.44699       8.404198 0.99 
1 1 1 -39 1  18 o 246.2104 3.486630 554.2087  117.4 -6.517044      6.973260 0.99 
1 1 1 -39 1  19 o 222.6789 3.473487 362.1071  221.5 -16.20264      6.946974 0.98 
1 1 1 -39 1  20 o 319.4384 3.937723 388.0259  254.5 -1.323853      7.875447 0.99 
1 1 1 -39 1  21 o 140.3343 3.503347 212.4064  61.2  26.01048       7.006694 0.95 
1 1 1 -39 1  22 o 157.4680 3.425077 246.7908  30.5  26.09264       6.850155 0.97 
1 1 1 -39 1  23 o 91.42944 4.773495 141.2132  99.2  -6.285553      9.546989 0.92 
1 1 1 -39 1  24 o 221.0031 3.576324 334.1189  89.9  -12.12152      7.152647 0.99 
1 1 1 -39 1  25 o 96.91753 4.709867 225.0877  23.2  35.57484       9.419735 0.96 
1 1 1 -39 1  26 o 44.42445 8.636814 34.30053  219.7 -13.90756      17.27363 0.46 
1 1 1 -39 1  27 o 188.6855 3.725583 253.0176  278.0 -2.211655      7.451166 0.99 
1 1 1 -39 1  28 o 141.1830 4.478386 256.0740  250.1 -0.5844116E-02 8.956772 0.98 
1 1 1 -39 1  29 o 122.1280 4.738067 164.2800  259.0 -3.534218      9.476133 0.96 
1 1 1 -39 1  30 o 149.3611 4.462509 203.3296  321.6 25.38094       8.925018 0.98 
1 1 1 -39 1  31 o 87.69279 6.924876 154.3611  300.7 -4.181183      13.84975 0.95 
1 1 1 -39 1  32 o 64.85967 9.294791 129.4336  273.9 -5.854382      18.58958 0.94 
1 1 1 -39 1  33 o 121.8656 6.077497 180.8680  333.5 0.6532059      12.15499 0.98 
1 1 1 -39 1  34 o 57.00950 9.383316 66.12249  290.7 28.38890       18.76663 0.88 
1 1 1 -39 1  35 o 24.06961 8.304205 66.88895  165.7 -2.333649      16.60841 0.72 
1 1 1 -39 1  36 o 35.32346 10.10201 40.37874  159.7 ?              ?        0.70 
1 1 1 -39 3  1  o 230.0168 3.230705 305.9941  240.9 -24.17792      6.461411 0.96 
1 1 1 -39 3  2  o 283.3657 3.338519 395.0261  251.1 -2.291779      6.677038 0.97 
1 1 1 -39 3  3  o 396.6824 3.998960 488.2082  258.7 -27.25977      7.997921 0.98 
1 1 1 -39 3  4  o 162.5380 3.213418 262.2931  357.3 11.65933       6.426837 0.91 
1 1 1 -39 3  5  o 143.7266 3.928515 184.9656  161.8 -41.52442      7.857030 0.86 
1 1 1 -39 3  6  o 300.4370 3.637935 298.0700  243.4 2.628479       7.275871 0.96 
1 1 1 -39 3  7  o 43.31675 9.466619 73.00378  43.4  16.56355       18.93324 0.20 
1 1 1 -39 3  8  o 148.3200 4.055600 221.7691  264.2 28.58090       8.111200 0.88 
1 1 1 -39 3  9  o 292.3956 3.992072 452.0616  334.4 61.08987       7.984144 0.97 
1 1 1 -39 3  10 o 342.4813 4.362354 460.6620  158.2 13.25305       8.724709 0.98 
1 1 1 -39 3  11 o 189.8550 3.676384 159.4678  176.2 -7.650208      7.352767 0.88 
1 1 1 -39 3  12 o 217.2057 3.879116 292.8496  182.8 -23.97592      7.758232 0.95 
1 1 1 -39 3  13 o 266.3274 4.106160 477.7881  47.7  35.11574       8.212319 0.98 
1 1 1 -39 3  14 o 51.40116 7.938680 89.82537  284.7 -39.75015      15.87736 0.48 
1 1 1 -39 3  15 o 36.47257 9.179925 67.28543  334.1 -8.141232      18.35985 0.29 
1 1 1 -39 3  16 o 179.8224 3.480198 191.0468  133.1 -9.675171      6.960395 0.95 
1 1 1 -39 3  17 f 108.8949 4.187447 203.0425  138.4 19.61224       8.374894 0.00 
1 1 1 -39 3  18 o 159.5771 3.453917 280.5633  26.9  6.760880       6.907834 0.96 
1 1 1 -39 3  19 f 126.1044 3.935111 189.9082  319.6 13.31279       7.870222 0.00 
1 1 1 -39 3  20 f 80.42502 5.271867 121.7973  316.0 16.13747       10.54373 0.00 
1 1 1 -39 3  21 o 99.00024 4.321195 61.89520  15.4  5.201469       8.642389 0.76 
1 1 1 -39 3  22 o 165.3531 3.407781 178.1936  320.4 -10.71706      6.815563 0.97 
1 1 1 -39 3  23 o 171.6978 3.442690 266.9746  309.8 6.327408       6.885381 0.98 
1 1 1 -39 3  24 o 270.6097 3.843419 427.5603  129.8 -21.53275      7.686838 0.99 
1 1 1 -39 3  25 o 127.6049 4.334897 195.4286  252.3 9.490479       8.669793 0.97 
1 1 1 -39 3  26 o 105.8286 5.437891 148.4948  349.6 -23.91701      10.87578 0.96 
1 1 1 -39 3  27 o 181.4474 3.902574 259.4741  33.0  -16.03732      7.805147 0.98 
1 1 1 -39 3  28 o 100.7990 5.601362 140.5578  188.7 8.535454       11.20272 0.94 
1 1 1 -39 3  29 o 156.8752 4.155290 197.9888  241.3 -3.179779      8.310579 0.98 
1 1 1 -39 3  30 o 51.55287 9.035541 121.8623  53.9  28.22964       18.07108 0.88 
1 1 1 -39 3  31 o 95.15233 5.364880 166.5545  139.6 -1.445465      10.72976 0.97 
1 1 1 -39 3  32 o 58.95853 8.741371 54.13575  278.7 40.86337       17.48274 0.85 
1 1 1 -39 3  33 o 85.94086 7.047987 112.8392  2.9   -22.86636      14.09597 0.96 
1 1 1 -39 3  34 o 72.43403 8.826295 71.30621  10.7  -29.76516      17.65259 0.92 
1 1 1 -39 3  35 o 43.62288 10.70118 66.00059  207.7 -16.65163      21.40235 0.85 
1 1 1 -39 5  1  o 119.6744 4.009313 187.6465  52.5  25.91440       8.018626 0.91 
1 1 1 -39 5  2  o 37.65939 9.053273 61.17138  319.9 -5.647686      18.10655 0.33 
1 1 1 -39 5  3  o 126.3697 4.144229 182.3264  113.8 19.11398       8.288459 0.92 
1 1 1 -39 5  4  o 183.2582 3.411983 214.2881  183.0 5.155334       6.823967 0.95 
1 1 1 -39 5  5  o 153.3217 3.164547 156.4436  182.7 -14.12035      6.329093 0.91 
1 1 1 -39 5  6  o 200.2581 3.416392 293.6833  58.1  27.98148       6.832785 0.96 
1 1 1 -39 5  7  o 240.6241 3.532262 413.4975  225.6 -28.82309      7.064525 0.98 
1 1 1 -39 5  8  o 429.9623 4.231654 611.7332  254.1 -52.87863      8.463307 0.99 
1 1 1 -39 5  9  o 30.14368 8.478986 149.5474  244.9 4.155510       16.95797 0.46 
1 1 1 -39 5  10 o 412.5096 4.703549 527.3288  108.0 7.004272       9.407099 0.99 
1 1 1 -39 5  11 o 145.9180 4.057744 192.7432  118.1 12.79918       8.115488 0.94 
1 1 1 -39 5  12 o 338.0333 4.157626 465.9362  325.1 -24.88510      8.315252 0.99 
1 1 1 -39 5  13 o 225.4522 4.087877 348.0677  307.2 -16.72215      8.175754 0.98 
1 1 1 -39 5  14 o 186.7397 3.765656 193.8955  193.6 34.50479       7.531312 0.96 
1 1 1 -39 5  15 o 100.1572 4.670633 105.1925  308.2 -16.44939      9.341267 0.85 
1 1 1 -39 5  16 o 128.4620 4.013087 244.0954  73.4  25.97501       8.026175 0.95 
1 1 1 -39 5  17 o 167.3787 4.375191 217.4082  121.0 -3.387329      8.750381 0.96 
1 1 1 -39 5  18 o 181.7416 3.462905 247.4543  172.7 15.77109       6.925810 0.97 
1 1 1 -39 5  19 o 143.4109 3.658165 237.6167  348.3 -30.47815      7.316329 0.97 
1 1 1 -39 5  20 o 188.8183 3.643274 245.4568  70.0  -5.603012      7.286549 0.98 
1 1 1 -39 5  21 o 330.9863 3.819235 533.1638  138.4 10.33115       7.638470 0.99 
1 1 1 -39 5  22 o 125.5145 4.025714 260.2601  119.1 18.23721       8.051428 0.97 
1 1 1 -39 5  23 o 110.2117 4.128412 157.8233  329.2 4.303055       8.256824 0.96 
1 1 1 -39 5  24 o 47.61249 6.937618 64.17978  219.9 49.47382       13.87524 0.75 
1 1 1 -39 5  25 o 98.03804 5.758967 145.3194  199.8 -13.00408      11.51793 0.95 
1 1 1 -39 5  26 o 155.8220 3.958611 214.8153  145.6 44.66168       7.917223 0.98 
1 1 1 -39 5  27 o 49.67628 9.921516 54.75616  183.4 4.131836       19.84303 0.62 
1 1 1 -39 5  28 o 43.77064 8.620284 5.701366  228.7 -27.57225      17.24057 0.08 
1 1 1 -39 5  29 o 51.86326 9.955136 98.16033  356.5 0.3503990      19.91027 0.86 
1 1 1 -39 5  30 f 172.2540 4.643177 231.9637  109.1 4.004013       9.286354 0.00 
1 1 1 -39 5  31 o 53.50165 10.57949 73.71661  199.0 -4.776524      21.15899 0.88 
1 1 1 -39 5  32 o 91.29739 7.039529 177.5039  73.5  3.554993       14.07906 0.98 
1 1 1 -39 5  33 o 45.50135 11.28969 52.73336  64.3  -10.57912      22.57938 0.79 
1 1 1 -39 5  34 o 44.08197 11.13605 53.52176  157.1 2.606529       22.27209 0.81 
1 1 1 -39 7  1  o 190.5316 3.023120 340.6867  33.6  -31.06831      6.046240 0.98 
1 1 1 -39 7  2  o 60.13475 6.483749 80.76176  203.4 -5.555328      12.96750 0.59 
1 1 1 -39 7  3  o 298.4305 3.469220 448.5231  263.0 0.5830078      6.938439 0.99 
1 1 1 -39 7  4  o 237.6180 3.282346 262.6103  351.6 -37.08508      6.564692 0.97 
1 1 1 -39 7  5  o 204.8924 3.263097 270.5686  96.9  -42.39101      6.526193 0.97 
1 1 1 -39 7  6  o 80.94221 5.034101 158.3641  147.5 9.661842       10.06820 0.87 
1 1 1 -39 7  7  o 190.4854 4.880173 350.0151  248.8 -34.11621      9.760345 0.98 
1 1 1 -39 7  8  o 68.32771 6.140872 70.79918  230.7 0.1512680      12.28174 0.58 
1 1 1 -39 7  9  o 113.5763 4.162488 210.3789  112.2 3.250877       8.324977 0.93 
1 1 1 -39 7  10 o 75.15907 5.442626 59.95922  31.2  13.58335       10.88525 0.46 
1 1 1 -39 7  11 o 100.5271 5.358332 153.3962  316.7 28.05058       10.71666 0.89 
1 1 1 -39 7  12 o 196.7482 3.481422 318.7935  351.9 -9.592133      6.962845 0.98 
1 1 1 -39 7  13 o 65.02006 6.515095 165.0966  340.1 -1.048874      13.03019 0.86 
1 1 1 -39 7  14 o 154.8476 4.073728 301.0686  197.1 -8.928818      8.147456 0.97 
1 1 1 -39 7  15 o 50.07470 8.113450 65.63144  48.6  -37.06084      16.22690 0.59 
1 1 1 -39 7  16 o 68.55742 7.436913 111.3660  243.4 8.007912       14.87383 0.85 
1 1 1 -39 7  17 o 113.0696 4.336247 212.1357  218.8 -23.51643      8.672495 0.96 
1 1 1 -39 7  18 o 105.4302 4.627201 135.5497  85.6  12.33289       9.254402 0.93 
1 1 1 -39 7  19 o 63.38552 8.152426 108.9375  301.4 12.33694       16.30485 0.86 
1 1 1 -39 7  20 o 38.53078 8.613894 39.61092  286.6 26.81262       17.22779 0.43 
1 1 1 -39 7  21 o 44.50663 9.857038 65.58688  36.5  4.514462       19.71408 0.71 
1 1 1 -39 7  22 o 120.3183 4.190723 133.8811  81.1  3.176666       8.381446 0.97 
1 1 1 -39 7  23 o 35.26841 9.485737 92.27268  290.6 11.18574       18.97147 0.73 
1 1 1 -39 7  24 o 204.7647 3.768295 315.0920  165.9 6.544876       7.536591 0.99 
1 1 1 -39 7  25 o 36.06308 10.07384 83.87646  213.9 3.510956       20.14769 0.67 
1 1 1 -39 7  26 o 108.5883 5.870010 207.1374  294.5 -13.40111      11.74002 0.97 
1 1 1 -39 7  27 o 60.01625 9.864742 103.2184  305.8 3.238396       19.72948 0.89 
1 1 1 -39 7  28 o 73.90075 8.274359 82.44423  160.4 -3.348312      16.54872 0.91 
1 1 1 -39 7  29 f 82.06503 7.732431 86.59770  54.9  6.777618       15.46486 0.00 
1 1 1 -39 7  30 o 58.80149 10.35032 91.26876  232.7 -21.12379      20.70063 0.92 
1 1 1 -39 7  31 o 33.19588 10.16831 48.39963  237.5 -4.235847      20.33661 0.69 
1 1 1 -39 7  32 o 50.56520 11.54085 37.80292  336.5 0.7956352      23.08169 0.75 
1 1 1 -39 7  33 o 39.82634 11.35560 55.15699  31.1  ?              ?        0.81 
1 1 1 -39 9  1  o 111.9521 6.179323 182.8705  2.3   -1.728157      12.35865 0.95 
1 1 1 -39 9  2  o 103.2308 5.572082 173.9391  313.6 -24.38828      11.14416 0.95 
1 1 1 -39 9  3  o 112.8356 4.912835 132.5932  208.4 -0.1366959     9.825669 0.94 
1 1 1 -39 9  4  o 89.08608 5.697998 111.6546  293.5 -8.174744      11.39600 0.90 
1 1 1 -39 9  5  o 54.12490 9.503884 68.37226  238.6 -32.08800      19.00777 0.68 
1 1 1 -39 9  6  o 131.0878 4.100376 194.8347  28.0  -7.858292      8.200751 0.96 
1 1 1 -39 9  7  o 322.3326 3.741152 449.7567  46.0  11.58694       7.482304 0.99 
1 1 1 -39 9  8  o 131.3339 4.001138 268.7778  332.4 -0.7207031     8.002275 0.97 
1 1 1 -39 9  9  o 65.23593 7.256659 98.95148  284.3 2.010963       14.51332 0.84 
1 1 1 -39 9  10 o 38.06223 9.239436 101.7219  126.8 3.139503       18.47887 0.70 
1 1 1 -39 9  11 o 27.45939 8.613398 59.21066  106.2 -5.144348      17.22680 0.40 
1 1 1 -39 9  12 o 31.88973 8.724586 100.6311  115.7 5.309259       17.44917 0.66 
1 1 1 -39 9  13 o 68.06455 7.206526 110.6280  27.5  13.24171       14.41305 0.88 
1 1 1 -39 9  14 o 144.6153 4.363289 214.4235  33.5  17.60770       8.726579 0.97 
1 1 1 -39 9  15 o 25.52869 8.114468 14.15455  103.4 7.965300       16.22894 0.12 
1 1 1 -39 9  16 o 84.20520 6.733553 70.02625  300.6 9.702652       13.46711 0.88 
1 1 1 -39 9  17 o 69.48933 6.816332 82.25601  105.7 -6.582939      13.63266 0.89 
1 1 1 -39 9  18 o 227.6209 3.635822 414.5559  45.4  -0.7163239     7.271644 0.99 
1 1 1 -39 9  19 o 24.86629 8.201576 71.22340  176.1 6.062901       16.40315 0.54 
1 1 1 -39 9  20 f 81.00257 6.880663 104.4166  190.1 -4.371552      13.76133 0.00 
1 1 1 -39 9  21 o 106.6400 5.392111 236.4375  132.3 -18.20852      10.78422 0.97 
1 1 1 -39 9  22 o 140.7817 4.838581 243.4338  209.2 0.5832977      9.677161 0.98 
1 1 1 -39 9  23 o 49.81867 10.22721 92.67552  267.5 10.40732       20.45442 0.82 
1 1 1 -39 9  24 o 54.13823 9.770854 48.27951  284.1 14.03889       19.54171 0.71 
1 1 1 -39 9  25 o 118.0357 5.726731 169.6223  286.0 19.00300       11.45346 0.98 
1 1 1 -39 9  26 o 100.0774 5.995231 161.0311  309.8 20.92406       11.99046 0.97 
1 1 1 -39 9  27 o 91.03904 8.496791 137.2691  100.3 -42.12100      16.99358 0.97 
1 1 1 -39 9  28 f 48.38908 10.73184 82.11292  84.5  -15.97270      21.46369 0.00 
1 1 1 -39 9  29 o 50.00867 11.43231 96.21963  343.8 -4.466446      22.86462 0.91 
1 1 1 -39 9  30 o 56.99106 11.86045 77.00642  152.8 20.71471       23.72090 0.90 
1 1 1 -39 9  31 o 57.85731 13.42344 84.02566  210.9 ?              ?        0.91 
1 1 1 -39 11 1  o 29.30510 8.961632 52.16357  147.0 -6.634739      17.92326 0.43 
1 1 1 -39 11 2  o 92.05120 5.619533 147.2127  167.7 13.03821       11.23907 0.94 
1 1 1 -39 11 3  o 62.96656 8.907467 50.87485  57.7  -28.26394      17.81493 0.73 
1 1 1 -39 11 4  o 105.1027 5.027390 146.9059  189.2 14.28630       10.05478 0.96 
1 1 1 -39 11 5  o 208.8885 3.810622 331.1363  149.0 -3.257507      7.621243 0.99 
1 1 1 -39 11 6  o 308.7054 5.031022 480.9802  122.4 4.853760       10.06204 1.00 
1 1 1 -39 11 7  o 135.4281 5.451654 189.5172  171.3 27.25558       10.90331 0.98 
1 1 1 -39 11 8  o 38.71137 10.14108 79.64499  285.9 1.265385       20.28216 0.73 
1 1 1 -39 11 9  o 117.4005 4.631927 236.5787  55.3  1.289093       9.263854 0.98 
1 1 1 -39 11 10 o 44.64792 9.608080 90.98631  14.1  16.55111       19.21616 0.80 
1 1 1 -39 11 11 o 128.4646 5.402710 173.2895  251.3 5.444511       10.80542 0.97 
1 1 1 -39 11 12 o 110.2927 4.988912 165.3256  96.9  4.357979       9.977823 0.96 
1 1 1 -39 11 13 o 113.8187 5.194168 180.3083  102.4 1.647980       10.38834 0.96 
1 1 1 -39 11 14 o 101.7575 5.377201 73.03646  317.3 -0.1748123     10.75440 0.89 
1 1 1 -39 11 15 o 31.78357 9.561882 134.4508  165.1 -1.209608      19.12376 0.79 
1 1 1 -39 11 16 o 46.90663 9.024058 54.38536  266.5 -27.91786      18.04812 0.64 
1 1 1 -39 11 17 o 79.12759 7.956997 123.6824  180.5 -4.866135      15.91399 0.93 
1 1 1 -39 11 18 o 56.73688 10.08063 89.61841  169.5 6.133373       20.16127 0.85 
1 1 1 -39 11 19 o 40.23540 10.88970 38.94821  209.5 -3.418438      21.77940 0.52 
1 1 1 -39 11 20 o 41.05918 11.51335 68.91721  218.8 12.29098       23.02670 0.76 
1 1 1 -39 11 21 o 37.06492 10.35288 56.87946  76.7  13.61055       20.70576 0.71 
1 1 1 -39 11 22 f 42.04671 9.688709 134.0295  90.3  -11.52484      19.37742 0.00 
1 1 1 -39 11 23 o 92.55135 6.480456 123.3363  346.9 -13.35839      12.96091 0.97 
1 1 1 -39 11 24 o 46.26915 10.23543 101.9002  345.5 -10.73107      20.47086 0.91 
1 1 1 -39 11 25 o 53.17084 11.11164 85.08292  295.7 21.96049       22.22329 0.90 
1 1 1 -39 11 26 o 31.84971 10.33828 65.04468  304.3 1.434124       20.67656 0.79 
1 1 1 -39 11 27 o 39.26858 11.48623 62.72601  352.8 ?              ?        0.83 
1 1 1 -39 11 28 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -39 13 1  f 35.25299 9.791817 28.42954  277.7 16.85094       19.58363 0.00 
1 1 1 -39 13 2  o 145.1046 4.529361 193.1309  27.6  -0.7104950     9.058722 0.98 
1 1 1 -39 13 3  o 100.3401 6.061623 135.5515  35.4  18.34045       12.12325 0.96 
1 1 1 -39 13 4  o 54.42577 10.43316 75.56621  52.0  6.598358       20.86632 0.85 
1 1 1 -39 13 5  o 38.95879 10.27406 48.37206  292.1 -17.94880      20.54811 0.64 
1 1 1 -39 13 6  o 86.40376 7.107946 176.8398  303.2 11.52932       14.21589 0.97 
1 1 1 -39 13 7  o 95.29678 7.058897 157.9943  12.6  -12.12263      14.11779 0.96 
1 1 1 -39 13 8  o 61.00964 10.07457 119.2432  22.1  -13.95990      20.14914 0.92 
1 1 1 -39 13 9  f 36.83304 10.25900 46.39755  320.1 -12.84479      20.51800 0.00 
1 1 1 -39 13 10 o 30.21293 9.746748 34.62196  336.7 -1.297867      19.49350 0.44 
1 1 1 -39 13 11 o 35.43378 9.503128 27.50159  184.4 -23.32903      19.00626 0.43 
1 1 1 -39 13 12 o 68.23193 10.66831 114.0452  97.2  10.32265       21.33663 0.93 
1 1 1 -39 13 13 o 108.2625 8.562386 212.8791  108.7 -26.30257      17.12477 0.98 
1 1 1 -39 13 14 o 42.05478 11.89675 78.02580  88.9  -11.08243      23.79350 0.83 
1 1 1 -39 13 15 o 42.68790 10.27553 69.64565  149.1 -24.68885      20.55107 0.84 
1 1 1 -39 13 16 o 36.97425 10.51314 43.91853  254.9 14.62990       21.02628 0.70 
1 1 1 -39 13 17 o 43.22112 11.75929 36.18896  351.1 -5.031277      23.51858 0.68 
1 1 1 -39 13 18 o 38.18488 11.62770 65.50697  7.6   8.776257       23.25540 0.81 
1 1 1 -39 13 19 o 48.11561 10.25890 122.6375  0.5   -13.20425      20.51781 0.93 
1 1 1 -39 13 20 o 33.22878 10.01771 47.24762  339.7 8.640680       20.03541 0.71 
1 1 1 -39 13 21 o 43.61622 10.45704 77.03540  308.9 11.33047       20.91409 0.88 
1 1 1 -39 13 22 o 63.67534 10.25639 168.0041  277.4 ?              ?        0.97 
1 1 1 -39 13 23 o 31.31662 9.735094 44.44997  202.3 ?              ?        0.73 
1 1 1 -39 15 1  o 44.08604 11.11907 113.6830  201.0 ?              ?        0.92 
1 1 1 -39 15 2  o 29.53761 9.284234 37.24630  236.9 2.976097       18.56847 0.63 
1 1 1 -39 15 3  o 82.38176 8.283221 130.9475  11.3  1.308716       16.56644 0.97 
1 1 1 -39 15 4  o 85.25333 8.191965 168.1533  7.9   5.011185       16.38393 0.98 
1 1 1 -39 15 5  o 71.97153 10.01233 111.2777  18.8  -1.866188      20.02465 0.95 
1 1 1 -39 15 6  o 84.43362 8.156741 170.0810  67.5  33.37926       16.31348 0.98 
1 1 1 -39 15 7  o 69.12549 11.49367 154.6344  152.1 29.83116       22.98733 0.96 
1 1 1 -39 15 8  o 92.58192 10.47343 152.1665  104.0 -38.15221      20.94686 0.97 
1 1 1 -39 15 9  o 131.0243 8.000414 264.3043  65.4  -15.46964      16.00083 0.99 
1 1 1 -39 15 10 o 41.29511 11.38242 38.21325  329.9 -2.452881      22.76484 0.71 
1 1 1 -39 15 11 o 42.57405 11.39202 81.72274  32.0  25.23734       22.78404 0.88 
1 1 1 -39 15 12 o 96.33340 9.031269 160.0196  64.9  4.615448       18.06254 0.98 
1 1 1 -39 15 13 o 34.35191 11.08586 81.29269  181.1 ?              ?        0.86 
1 1 1 -39 15 14 f 33.88905 11.12113 56.17311  185.6 ?              ?        0.00 
1 1 1 -39 15 15 o 37.59417 11.28501 20.81918  327.0 ?              ?        0.49 
1 1 1 -39 15 16 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -38 0  1  o 427.6219 5.743053 604.7103  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  2  o 518.4815 6.400916 600.7781  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  3  o 239.7542 5.348048 406.9279  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  4  o 59.82480 12.27518 138.4549  180.0 -0.000000      0.000000 0.37 
1 1 1 -38 0  5  o 37.39911 17.53356 90.04574  360.0 -0.000000      0.000000 0.11 
1 1 1 -38 0  6  o 171.2119 5.101066 61.77709  0.0   -0.000000      0.000000 0.32 
1 1 1 -38 0  7  o 138.5466 6.514832 194.1558  180.0 -0.000000      0.000000 0.79 
1 1 1 -38 0  8  o 188.3150 5.631668 281.2167  180.0 -0.000000      0.000000 0.97 
1 1 1 -38 0  9  o 14.92195 10.70856 46.76617  180.0 -0.000000      0.000000 0.02 
1 1 1 -38 0  10 o 496.4747 7.510304 631.3763  360.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  11 o 217.4726 5.323962 389.2465  0.0   -0.000000      0.000000 1.00 
1 1 1 -38 0  12 o 68.12725 9.091129 162.9124  0.0   -0.000000      0.000000 0.63 
1 1 1 -38 0  13 o 526.1185 7.695806 567.9242  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  14 o 115.3679 5.970266 64.14704  0.0   -0.000000      0.000000 0.39 
1 1 1 -38 0  15 o 217.2841 5.123147 351.6263  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  16 o 133.6226 5.007610 48.40125  0.0   -0.000000      0.000000 0.56 
1 1 1 -38 0  17 o 25.19125 13.78912 182.5436  360.0 -0.000000      0.000000 0.46 
1 1 1 -38 0  18 o 172.0327 5.128543 203.4174  0.0   -0.000000      0.000000 1.00 
1 1 1 -38 0  19 o 378.9188 6.341730 551.3013  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  20 o 385.1700 6.307958 586.0757  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  21 o 247.9276 4.955178 301.1885  0.0   -0.000000      0.000000 1.00 
1 1 1 -38 0  22 o 84.20302 6.958063 49.43658  360.0 -0.000000      0.000000 0.71 
1 1 1 -38 0  23 o 180.6874 4.535082 184.7518  360.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  24 o 98.21286 6.024007 124.7138  180.0 -0.000000      0.000000 1.00 
1 1 1 -38 0  25 o 15.45442 11.00437 50.32206  0.0   -0.000000      0.000000 0.20 
1 1 1 -38 0  26 o 63.08028 11.92151 81.24770  180.0 -0.000000      0.000000 0.92 
1 1 1 -38 0  27 o 189.0145 6.985222 328.5161  0.0   -0.000000      0.000000 1.00 
1 1 1 -38 0  28 o 197.7826 4.773071 325.7930  0.0   -0.000000      0.000000 1.00 
1 1 1 -38 0  29 o 20.62904 13.57995 20.01138  180.0 -0.000000      0.000000 0.12 
1 1 1 -38 0  30 o 21.21564 13.67642 79.18792  0.0   -0.000000      0.000000 0.48 
1 1 1 -38 0  31 o 27.77336 16.60187 149.4023  0.0   -0.000000      0.000000 0.89 
1 1 1 -38 0  32 o 16.52621 11.73901 65.30616  0.0   -0.000000      0.000000 0.47 
1 1 1 -38 0  33 o 36.89552 17.51048 67.63710  180.0 -0.000000      0.000000 0.86 
1 1 1 -38 0  34 o 13.90727 10.21845 20.81567  180.0 -0.000000      0.000000 0.19 
1 1 1 -38 0  35 o 19.20602 13.16231 10.38437  0.0   -0.000000      0.000000 0.13 
1 1 1 -38 0  36 o 20.01324 13.88320 10.87651  180.0 ?              ?        0.15 
1 1 1 -38 2  1  o 271.5586 3.605865 381.3844  272.7 -2.978943      7.211730 0.96 
1 1 1 -38 2  2  o 108.9357 4.460886 216.8659  89.1  35.37549       8.921772 0.77 
1 1 1 -38 2  3  o 147.3605 4.021244 157.0968  203.4 -8.539917      8.042488 0.76 
1 1 1 -38 2  4  o 311.9788 3.625929 665.4250  282.7 9.967560       7.251857 0.98 
1 1 1 -38 2  5  o 230.8770 3.305990 182.2084  129.9 -18.58746      6.611979 0.87 
1 1 1 -38 2  6  o 628.4445 6.159602 895.5360  31.8  -13.84540      12.31920 0.99 
1 1 1 -38 2  7  o 215.9238 4.106760 300.0576  156.7 -8.576111      8.213520 0.92 
1 1 1 -38 2  8  o 285.8789 4.096435 391.1667  168.7 -51.56073      8.192869 0.96 
1 1 1 -38 2  9  o 33.27238 9.443646 114.3263  57.8  -11.20833      18.88729 0.20 
1 1 1 -38 2  10 o 352.2744 4.261483 642.7117  59.0  42.19131       8.522965 0.98 
1 1 1 -38 2  11 o 236.5670 3.746938 211.4318  187.0 4.512253       7.493877 0.91 
1 1 1 -38 2  12 o 119.9080 4.477904 230.2852  5.3   -1.430222      8.955809 0.83 
1 1 1 -38 2  13 o 304.8248 4.017896 407.5073  337.7 -33.47412      8.035791 0.97 
1 1 1 -38 2  14 o 267.3646 4.063481 357.5115  238.9 -30.80292      8.126962 0.96 
1 1 1 -38 2  15 o 203.0369 3.451925 369.4013  189.5 -16.86267      6.903850 0.96 
1 1 1 -38 2  16 o 241.3626 3.556474 383.1067  108.9 13.07411       7.112948 0.97 
1 1 1 -38 2  17 o 195.7081 3.454568 338.2229  45.7  -19.86584      6.909135 0.97 
1 1 1 -38 2  18 o 121.4868 3.831618 224.4147  20.0  24.64099       7.663236 0.94 
1 1 1 -38 2  19 o 160.5603 3.466069 265.4378  280.5 19.05412       6.932138 0.96 
1 1 1 -38 2  20 o 184.1015 3.383002 325.3547  206.3 -10.55853      6.766004 0.97 
1 1 1 -38 2  21 o 165.4310 3.365398 261.2590  144.3 -9.721527      6.730797 0.97 
1 1 1 -38 2  22 o 129.5912 4.381578 146.9981  47.6  -0.2535858     8.763156 0.93 
1 1 1 -38 2  23 o 205.1636 3.370058 318.3729  284.4 14.95621       6.740116 0.98 
1 1 1 -38 2  24 o 146.1546 3.558231 215.7816  359.1 1.605881       7.116462 0.97 
1 1 1 -38 2  25 o 77.54573 6.573641 106.4285  31.9  -37.61686      13.14728 0.89 
1 1 1 -38 2  26 o 50.51361 7.754483 38.20961  189.4 -28.33758      15.50897 0.55 
1 1 1 -38 2  27 o 158.2423 4.073762 225.3379  74.9  10.88576       8.147524 0.98 
1 1 1 -38 2  28 o 150.0094 4.200847 214.6937  111.2 -10.85051      8.401693 0.98 
1 1 1 -38 2  29 o 82.79210 6.061633 136.0304  79.3  12.88027       12.12327 0.92 
1 1 1 -38 2  30 o 103.4207 5.663987 169.7582  85.2  -1.219780      11.32797 0.96 
1 1 1 -38 2  31 o 109.2739 5.607411 135.2425  158.6 -22.66700      11.21482 0.96 
1 1 1 -38 2  32 o 86.61899 10.34134 140.1617  164.8 7.634109       20.68268 0.96 
1 1 1 -38 2  33 o 142.6508 4.870478 186.6034  2.1   12.19896       9.740955 0.99 
1 1 1 -38 2  34 o 33.89226 9.735989 79.14922  46.4  12.55866       19.47198 0.83 
1 1 1 -38 2  35 o 67.54541 10.57526 117.2581  159.5 -26.39539      21.15052 0.95 
1 1 1 -38 2  36 o 46.94708 10.64325 57.46180  3.3   ?              ?        0.85 
1 1 1 -38 4  1  o 206.2192 3.155226 177.8670  253.6 15.23404       6.310453 0.92 
1 1 1 -38 4  2  o 61.60177 6.253887 132.8868  37.3  21.56048       12.50777 0.55 
1 1 1 -38 4  3  o 152.0249 3.353762 262.6640  59.3  -12.48312      6.707524 0.92 
1 1 1 -38 4  4  o 87.92172 5.355498 153.7633  265.9 -41.78451      10.71100 0.71 
1 1 1 -38 4  5  o 271.5053 3.275009 432.1119  166.0 5.209961       6.550018 0.97 
1 1 1 -38 4  6  o 304.1573 3.542248 387.7708  118.2 -19.57019      7.084496 0.97 
1 1 1 -38 4  7  o 249.2761 3.276796 354.8304  64.8  -11.11980      6.553592 0.96 
1 1 1 -38 4  8  f 107.2323 3.958205 191.4373  285.4 -40.38538      7.916409 0.00 
1 1 1 -38 4  9  o 213.5988 3.539531 360.3543  260.1 -8.090637      7.079061 0.95 
1 1 1 -38 4  10 o 142.3617 3.981718 201.9195  55.4  -18.15253      7.963437 0.89 
1 1 1 -38 4  11 o 75.86221 7.087950 126.3006  299.1 -65.23312      14.17590 0.65 
1 1 1 -38 4  12 o 388.5117 4.576427 605.5179  222.6 -42.70880      9.152853 0.99 
1 1 1 -38 4  13 o 198.0204 3.876974 229.6033  37.5  16.81999       7.753948 0.94 
1 1 1 -38 4  14 o 141.2657 4.022804 291.4234  318.0 2.783493       8.045608 0.95 
1 1 1 -38 4  15 o 254.9845 3.748060 430.1624  337.3 -4.530457      7.496120 0.98 
1 1 1 -38 4  16 f 140.2338 4.213945 143.9840  140.4 -17.67276      8.427891 0.00 
1 1 1 -38 4  17 o 117.8313 3.593980 200.0058  248.8 22.64012       7.187959 0.93 
1 1 1 -38 4  18 o 58.10467 6.629634 47.83771  32.1  29.66282       13.25927 0.43 
1 1 1 -38 4  19 o 96.30080 4.580456 138.7715  74.6  47.00398       9.160913 0.87 
1 1 1 -38 4  20 o 271.0535 4.770983 442.4362  0.5   10.07465       9.541966 0.99 
1 1 1 -38 4  21 o 71.96866 5.774402 192.0524  335.4 -2.505905      11.54880 0.92 
1 1 1 -38 4  22 o 92.78763 4.775253 150.7017  75.2  9.394241       9.550507 0.93 
1 1 1 -38 4  23 o 118.0400 3.848749 150.6303  118.9 15.56564       7.697498 0.95 
1 1 1 -38 4  24 o 72.76334 6.152465 116.3638  120.0 -12.55996      12.30493 0.90 
1 1 1 -38 4  25 o 132.3704 4.521170 184.8322  35.0  24.22877       9.042340 0.97 
1 1 1 -38 4  26 o 88.35500 5.477063 86.89413  159.0 28.37151       10.95413 0.92 
1 1 1 -38 4  27 o 103.8048 5.697442 128.7935  14.2  -10.05956      11.39488 0.94 
1 1 1 -38 4  28 o 179.0528 4.003542 243.4777  226.3 1.724792       8.007085 0.98 
1 1 1 -38 4  29 o 234.8916 3.829541 336.5445  218.2 7.351974       7.659083 0.99 
1 1 1 -38 4  30 o 28.72429 9.031630 32.81208  354.1 -3.992706      18.06326 0.35 
1 1 1 -38 4  31 o 42.85863 10.44803 48.16933  14.5  -6.327732      20.89605 0.69 
1 1 1 -38 4  32 o 102.9848 5.798155 206.1626  140.0 -0.3774414     11.59631 0.98 
1 1 1 -38 4  33 o 49.24548 11.44067 83.10349  121.2 8.804890       22.88135 0.89 
1 1 1 -38 4  34 o 55.27257 10.57525 59.69072  356.3 -19.29406      21.15051 0.86 
1 1 1 -38 4  35 o 35.86627 10.87672 73.35171  206.9 ?              ?        0.84 
1 1 1 -38 6  1  o 39.16664 8.464979 120.3082  27.3  -6.756535      16.92996 0.57 
1 1 1 -38 6  2  o 96.52775 4.334659 136.0659  157.8 4.233185       8.669318 0.87 
1 1 1 -38 6  3  o 126.6662 3.821028 174.9640  41.2  12.19952       7.642056 0.92 
1 1 1 -38 6  4  o 70.41884 6.019044 206.7854  317.8 23.22771       12.03809 0.88 
1 1 1 -38 6  5  o 182.1132 3.537688 284.7818  208.0 18.88760       7.075376 0.97 
1 1 1 -38 6  6  o 158.0464 3.715201 197.2094  306.9 48.49234       7.430402 0.94 
1 1 1 -38 6  7  o 109.6099 4.391118 169.8838  233.9 25.18975       8.782235 0.91 
1 1 1 -38 6  8  o 100.7803 4.192578 147.6647  148.5 27.72830       8.385156 0.89 
1 1 1 -38 6  9  o 128.0172 3.807477 299.1372  87.3  11.57354       7.614954 0.96 
1 1 1 -38 6  10 o 50.89455 8.621654 109.9129  356.8 -14.06958      17.24331 0.67 
1 1 1 -38 6  11 o 145.5585 3.542710 224.2342  54.8  -49.60149      7.085419 0.95 
1 1 1 -38 6  12 o 237.6182 3.808473 257.0001  14.5  -19.77298      7.616946 0.97 
1 1 1 -38 6  13 o 166.5111 3.570714 367.9572  358.2 18.17238       7.141428 0.97 
1 1 1 -38 6  14 o 260.7068 5.118388 407.0335  175.6 30.27441       10.23678 0.99 
1 1 1 -38 6  15 o 156.9991 3.906051 248.9642  264.3 5.816406       7.812102 0.96 
1 1 1 -38 6  16 o 81.60578 5.443778 184.7318  318.1 3.624130       10.88756 0.90 
1 1 1 -38 6  17 o 35.97518 7.968818 67.98100  191.2 20.45917       15.93764 0.41 
1 1 1 -38 6  18 o 113.0553 4.179844 146.9675  190.3 16.84782       8.359689 0.93 
1 1 1 -38 6  19 o 100.8317 4.674644 220.8344  110.0 9.428116       9.349288 0.95 
1 1 1 -38 6  20 o 142.2903 3.726362 203.3669  164.4 -5.512177      7.452724 0.97 
1 1 1 -38 6  21 o 86.74245 5.027537 130.0501  55.6  -26.34161      10.05507 0.92 
1 1 1 -38 6  22 o 159.0280 3.617278 227.5527  358.9 -11.74803      7.234557 0.98 
1 1 1 -38 6  23 o 121.6481 4.394701 146.1980  62.9  -15.25110      8.789402 0.96 
1 1 1 -38 6  24 o 128.5588 4.137218 133.1756  12.0  11.74625       8.274436 0.97 
1 1 1 -38 6  25 o 149.7578 3.842941 219.5506  228.8 3.203781       7.685882 0.98 
1 1 1 -38 6  26 o 168.2070 4.464659 230.4294  183.5 6.547485       8.929317 0.98 
1 1 1 -38 6  27 o 89.90672 6.591455 199.8571  88.9  -16.85437      13.18291 0.96 
1 1 1 -38 6  28 o 82.25997 8.606008 149.1121  55.8  -12.00291      17.21202 0.94 
1 1 1 -38 6  29 o 124.4958 5.100523 224.7363  40.6  6.499763       10.20105 0.98 
1 1 1 -38 6  30 o 34.65086 10.58237 55.84300  72.0  22.50470       21.16475 0.70 
1 1 1 -38 6  31 o 35.48518 10.15370 73.92028  86.1  -5.033115      20.30740 0.82 
1 1 1 -38 6  32 o 65.25069 10.33472 66.08113  67.4  1.365692       20.66945 0.90 
1 1 1 -38 6  33 o 69.05975 9.681805 93.87698  63.6  -5.893082      19.36361 0.94 
1 1 1 -38 6  34 o 33.04739 9.315501 42.85344  339.5 ?              ?        0.72 
1 1 1 -38 8  1  o 123.3288 4.469275 221.1521  326.0 -8.777863      8.938549 0.96 
1 1 1 -38 8  2  o 127.2428 3.458808 139.6507  144.2 9.201294       6.917617 0.93 
1 1 1 -38 8  3  o 128.1616 3.441832 157.2756  294.2 -54.81284      6.883664 0.94 
1 1 1 -38 8  4  o 182.1395 4.448913 349.0283  304.8 -20.22768      8.897826 0.98 
1 1 1 -38 8  5  o 42.50051 9.072881 48.98125  245.6 -3.935173      18.14576 0.34 
1 1 1 -38 8  6  o 94.83237 4.504737 250.6059  100.0 17.12453       9.009475 0.94 
1 1 1 -38 8  7  o 112.2852 3.814303 214.1096  328.3 -14.29747      7.628605 0.94 
1 1 1 -38 8  8  o 135.3929 4.060517 159.3591  172.0 -14.99678      8.121035 0.93 
1 1 1 -38 8  9  o 371.3035 3.779964 592.6570  127.6 43.59845       7.559928 0.99 
1 1 1 -38 8  10 o 146.5592 3.587178 340.0965  119.5 9.287476       7.174356 0.97 
1 1 1 -38 8  11 o 87.55489 5.091958 91.11406  251.8 -18.60941      10.18392 0.83 
1 1 1 -38 8  12 o 144.0373 3.787173 271.8416  323.9 -13.33073      7.574346 0.97 
1 1 1 -38 8  13 o 173.8655 3.656405 328.9663  355.5 7.980499       7.312810 0.98 
1 1 1 -38 8  14 o 107.5258 4.209337 80.29607  75.7  6.960136       8.418674 0.88 
1 1 1 -38 8  15 o 231.5627 3.281684 301.5641  41.0  -26.31468      6.563367 0.99 
1 1 1 -38 8  16 o 157.0987 3.774912 231.5725  306.7 12.07164       7.549824 0.98 
1 1 1 -38 8  17 o 119.4330 4.528998 189.5027  192.8 6.067802       9.057996 0.96 
1 1 1 -38 8  18 o 145.9773 4.224508 290.5258  68.4  -3.615814      8.449016 0.98 
1 1 1 -38 8  19 o 161.6394 3.543744 263.7917  102.5 0.4705811      7.087487 0.98 
1 1 1 -38 8  20 o 63.32640 7.371479 77.47496  198.8 -5.073807      14.74296 0.86 
1 1 1 -38 8  21 o 53.44257 8.114468 33.51341  285.1 -33.85024      16.22894 0.58 
1 1 1 -38 8  22 o 59.40367 8.045184 75.71925  239.6 3.886524       16.09037 0.82 
1 1 1 -38 8  23 o 38.68837 9.788767 57.44380  133.9 6.962723       19.57753 0.54 
1 1 1 -38 8  24 o 120.3748 5.227327 224.3986  88.0  0.8188477      10.45465 0.97 
1 1 1 -38 8  25 o 69.57623 7.226723 111.9958  317.6 17.95858       14.45345 0.91 
1 1 1 -38 8  26 o 98.01684 6.054969 130.8119  249.5 0.8327484      12.10994 0.95 
1 1 1 -38 8  27 o 24.57967 8.400469 43.95368  98.9  6.002014       16.80094 0.47 
1 1 1 -38 8  28 o 46.71307 8.718423 55.14160  11.5  -32.54599      17.43685 0.81 
1 1 1 -38 8  29 o 29.60263 9.655150 60.98938  311.9 9.051374       19.31030 0.74 
1 1 1 -38 8  30 o 64.04436 11.23034 109.9010  137.1 -12.80312      22.46069 0.94 
1 1 1 -38 8  31 o 111.4961 7.244479 160.5595  157.7 -15.50645      14.48896 0.98 
1 1 1 -38 8  32 o 38.58678 11.25080 35.29435  158.6 ?              ?        0.67 
1 1 1 -38 10 1  o 148.3094 4.198631 189.1903  123.4 15.47009       8.397263 0.98 
1 1 1 -38 10 2  o 75.42512 6.682709 173.3876  116.6 -17.05432      13.36542 0.94 
1 1 1 -38 10 3  o 111.6200 4.987728 161.4577  345.6 -5.539146      9.975456 0.96 
1 1 1 -38 10 4  o 131.1225 4.260820 162.3292  75.9  8.397064       8.521641 0.96 
1 1 1 -38 10 5  o 167.2446 4.402668 238.3217  89.0  -7.384995      8.805335 0.98 
1 1 1 -38 10 6  o 151.6853 3.996478 183.4472  144.8 0.5862274      7.992955 0.97 
1 1 1 -38 10 7  o 185.0302 3.602868 231.3771  189.5 3.377609       7.205735 0.98 
1 1 1 -38 10 8  o 108.7137 5.386585 193.3668  253.8 1.004509       10.77317 0.96 
1 1 1 -38 10 9  o 85.38848 6.156515 99.69315  302.1 10.34300       12.31303 0.90 
1 1 1 -38 10 10 o 44.89353 9.653445 89.14589  334.2 -9.367756      19.30689 0.76 
1 1 1 -38 10 11 f 116.7499 4.684117 119.4394  148.1 -8.635231      9.368235 0.00 
1 1 1 -38 10 12 o 112.6730 4.542924 152.0183  114.4 -9.130074      9.085849 0.96 
1 1 1 -38 10 13 o 97.14479 5.219188 173.4147  191.4 19.38107       10.43838 0.96 
1 1 1 -38 10 14 o 43.11452 9.065704 125.2187  136.1 15.32143       18.13141 0.88 
1 1 1 -38 10 15 o 121.1674 4.648360 207.5896  56.0  -2.315445      9.296720 0.98 
1 1 1 -38 10 16 o 40.00925 9.930903 28.07092  114.4 10.09504       19.86181 0.39 
1 1 1 -38 10 17 o 85.44115 7.104197 140.7950  174.8 0.9587097      14.20839 0.94 
1 1 1 -38 10 18 o 54.16969 9.619987 107.4155  36.0  -34.30009      19.23997 0.85 
1 1 1 -38 10 19 o 124.5694 4.866713 223.9819  281.4 -30.26428      9.733425 0.97 
1 1 1 -38 10 20 o 134.6917 5.105054 208.9438  201.8 -25.62996      10.21011 0.97 
1 1 1 -38 10 21 o 64.11043 9.270923 82.78162  73.6  -12.35326      18.54185 0.85 
1 1 1 -38 10 22 f 26.04592 8.449411 134.4089  51.6  6.685802       16.89882 0.00 
1 1 1 -38 10 23 o 108.7325 5.924133 184.1087  78.1  5.728111       11.84827 0.97 
1 1 1 -38 10 24 o 135.6177 5.799313 260.7323  98.2  3.350647       11.59863 0.99 
1 1 1 -38 10 25 o 72.75963 11.23648 114.4586  120.7 -23.20696      22.47297 0.94 
1 1 1 -38 10 26 o 49.41697 10.02756 58.65157  243.0 -5.500881      20.05513 0.85 
1 1 1 -38 10 27 o 26.53265 8.957795 32.81190  256.2 6.989515       17.91559 0.50 
1 1 1 -38 10 28 o 70.45198 11.01014 145.2293  10.5  -9.963867      22.02029 0.96 
1 1 1 -38 10 29 o 40.01200 11.53657 106.3548  20.0  ?              ?        0.91 
1 1 1 -38 10 30 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -38 12 1  o 117.2686 4.950844 137.7335  235.1 22.35193       9.901689 0.96 
1 1 1 -38 12 2  o 61.36389 8.562702 77.49729  144.3 18.61911       17.12540 0.82 
1 1 1 -38 12 3  o 157.1560 4.292376 257.2276  128.1 2.262634       8.584751 0.98 
1 1 1 -38 12 4  o 155.3482 4.252771 205.0717  156.1 15.39040       8.505543 0.98 
1 1 1 -38 12 5  o 174.2795 3.895265 218.2572  222.4 -11.02022      7.790529 0.98 
1 1 1 -38 12 6  o 120.6621 4.903966 128.2657  143.3 -30.84223      9.807932 0.95 
1 1 1 -38 12 7  o 172.5728 4.487762 285.4678  17.1  4.138351       8.975524 0.99 
1 1 1 -38 12 8  o 91.78029 6.379869 138.4635  88.6  -7.757042      12.75974 0.94 
1 1 1 -38 12 9  o 197.4299 3.894581 360.9907  111.1 -14.21046      7.789162 0.99 
1 1 1 -38 12 10 o 53.53988 10.77731 95.39888  140.7 -33.36395      21.55462 0.83 
1 1 1 -38 12 11 o 148.2809 5.044053 314.4963  232.6 -3.573425      10.08811 0.98 
1 1 1 -38 12 12 o 160.8426 5.190176 262.3029  169.7 -12.60623      10.38035 0.98 
1 1 1 -38 12 13 o 147.7908 4.463045 202.7267  144.1 -12.82890      8.926090 0.98 
1 1 1 -38 12 14 o 57.39616 11.93457 96.45368  171.1 18.21680       23.86915 0.85 
1 1 1 -38 12 15 o 158.9591 4.019878 227.9089  197.6 -1.634277      8.039757 0.98 
1 1 1 -38 12 16 o 49.06989 10.47918 74.75674  189.2 -10.65395      20.95836 0.81 
1 1 1 -38 12 17 o 119.1480 5.699083 225.5146  177.9 -17.63775      11.39817 0.98 
1 1 1 -38 12 18 o 100.3156 6.544265 118.0890  152.9 -19.37887      13.08853 0.96 
1 1 1 -38 12 19 o 25.16994 8.253549 28.44958  74.4  -3.342648      16.50710 0.38 
1 1 1 -38 12 20 o 159.5485 4.722309 256.5296  76.0  -1.940430      9.444617 0.99 
1 1 1 -38 12 21 o 132.3296 5.060732 245.5374  61.6  -13.06512      10.12146 0.99 
1 1 1 -38 12 22 o 108.8539 6.034254 174.2724  285.0 17.20667       12.06851 0.98 
1 1 1 -38 12 23 o 77.82526 9.044261 138.8017  290.4 -1.556091      18.08852 0.97 
1 1 1 -38 12 24 o 30.48306 8.491873 58.92737  229.0 -10.09937      16.98375 0.78 
1 1 1 -38 12 25 o 74.40744 10.24406 122.8509  206.2 -1.686302      20.48811 0.96 
1 1 1 -38 12 26 o 45.57422 10.85531 80.14811  190.8 ?              ?        0.90 
1 1 1 -38 14 1  o 100.2833 6.310899 139.9562  182.0 0.4305573      12.62180 0.98 
1 1 1 -38 14 2  o 40.77155 10.90542 52.56176  154.7 -1.906811      21.81084 0.79 
1 1 1 -38 14 3  o 89.58784 6.936839 170.8788  24.9  -22.33798      13.87368 0.98 
1 1 1 -38 14 4  o 98.65306 5.867076 171.8672  57.9  -11.75222      11.73415 0.98 
1 1 1 -38 14 5  o 47.73628 10.81997 118.6157  165.9 11.99204       21.63994 0.92 
1 1 1 -38 14 6  o 40.22533 10.16938 53.69606  227.4 11.37460       20.33876 0.78 
1 1 1 -38 14 7  o 29.56513 9.582927 33.96041  295.3 -6.980951      19.16585 0.53 
1 1 1 -38 14 8  o 75.03044 10.41353 112.8094  98.9  -30.76956      20.82706 0.95 
1 1 1 -38 14 9  o 75.45808 9.560182 120.7246  130.2 -5.484810      19.12036 0.96 
1 1 1 -38 14 10 o 78.59958 9.424969 158.6151  229.7 0.3827591      18.84994 0.97 
1 1 1 -38 14 11 o 132.3382 7.653356 248.2363  261.0 -41.01667      15.30671 0.99 
1 1 1 -38 14 12 o 30.20975 9.767582 36.34057  229.5 -3.433861      19.53516 0.59 
1 1 1 -38 14 13 o 47.33106 11.84591 102.5678  123.2 -12.52522      23.69183 0.91 
1 1 1 -38 14 14 o 60.01906 11.70597 157.0325  85.2  -0.5491714     23.41194 0.96 
1 1 1 -38 14 15 o 36.95782 11.19686 41.33599  149.3 -1.278351      22.39372 0.68 
1 1 1 -38 14 16 o 61.06583 13.14587 146.6012  314.3 -14.57341      26.29173 0.95 
1 1 1 -38 14 17 o 60.15512 16.99295 112.0370  307.7 38.98306       33.98590 0.91 
1 1 1 -38 14 18 o 31.34453 10.03459 37.90094  251.1 -4.118755      20.06919 0.64 
1 1 1 -38 14 19 o 43.10108 12.35087 39.51455  338.3 15.35582       24.70174 0.72 
1 1 1 -38 14 20 o 29.09620 10.09520 36.69121  267.8 ?              ?        0.63 
1 1 1 -38 14 21 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -37 1  1  o 429.4545 3.770277 495.1691  99.9  -17.48129      7.540554 0.97 
1 1 1 -37 1  2  o 275.2800 3.629357 433.0561  204.7 -17.92575      7.258715 0.95 
1 1 1 -37 1  3  o 224.1828 3.591180 364.3410  321.9 40.98030       7.182360 0.93 
1 1 1 -37 1  4  o 279.2918 3.966986 271.9539  14.5  22.97977       7.933973 0.91 
1 1 1 -37 1  5  o 109.6413 4.987760 37.96157  268.0 19.13081       9.975519 0.10 
1 1 1 -37 1  6  o 241.8870 4.009727 175.5636  73.4  41.34641       8.019453 0.83 
1 1 1 -37 1  7  o 153.1513 4.025597 213.9828  178.4 -2.426163      8.051193 0.76 
1 1 1 -37 1  8  o 189.5013 3.799487 265.2550  330.0 44.48277       7.598974 0.86 
1 1 1 -37 1  9  o 453.0027 4.919879 486.9175  88.9  -25.02753      9.839758 0.97 
1 1 1 -37 1  10 o 187.4950 3.452337 268.5581  233.2 -24.07440      6.904674 0.88 
1 1 1 -37 1  11 o 264.2282 4.020614 332.3809  222.0 46.96547       8.041227 0.94 
1 1 1 -37 1  12 o 365.7127 4.534526 569.8381  299.4 -36.51071      9.069052 0.98 
1 1 1 -37 1  13 o 275.9426 4.187446 339.7225  181.8 3.995789       8.374892 0.95 
1 1 1 -37 1  14 o 347.6339 4.403072 403.5771  260.5 43.88000       8.806145 0.97 
1 1 1 -37 1  15 o 374.9838 4.529626 533.9036  210.7 -7.503265      9.059253 0.98 
1 1 1 -37 1  16 o 393.6013 4.402050 616.6600  192.2 7.310730       8.804100 0.99 
1 1 1 -37 1  17 o 59.66612 6.736577 207.8208  105.2 -36.84426      13.47315 0.77 
1 1 1 -37 1  18 o 376.8057 4.441258 680.0555  356.4 1.766266       8.882516 0.99 
1 1 1 -37 1  19 o 101.7240 3.895299 147.8422  215.1 3.032524       7.790599 0.88 
1 1 1 -37 1  20 o 422.8235 4.432447 758.3438  177.0 7.462891       8.864894 0.99 
1 1 1 -37 1  21 o 53.49440 6.738471 75.89126  175.6 26.01215       13.47694 0.50 
1 1 1 -37 1  22 o 45.30054 8.165554 26.11005  291.4 -14.68979      16.33111 0.21 
1 1 1 -37 1  23 o 110.3755 3.834887 187.6715  298.9 -9.927444      7.669773 0.94 
1 1 1 -37 1  24 o 100.8294 3.883766 222.3669  321.6 -17.20956      7.767532 0.96 
1 1 1 -37 1  25 o 202.4477 3.438136 259.4265  78.8  -11.78166      6.876272 0.98 
1 1 1 -37 1  26 o 86.94686 5.780948 92.04317  181.6 -30.14655      11.56190 0.89 
1 1 1 -37 1  27 o 42.64513 9.660139 83.87674  351.3 0.1519890      19.32028 0.78 
1 1 1 -37 1  28 o 80.81389 7.246573 102.0252  155.1 33.48480       14.49315 0.91 
1 1 1 -37 1  29 o 93.14500 5.706275 117.1373  166.7 0.9758453      11.41255 0.92 
1 1 1 -37 1  30 o 99.58583 5.539344 100.8527  75.0  -3.102333      11.07869 0.92 
1 1 1 -37 1  31 f 86.49403 6.825772 143.9746  132.8 -4.645096      13.65154 0.00 
1 1 1 -37 1  32 o 146.9774 4.407279 211.9807  163.0 16.89677       8.814558 0.98 
1 1 1 -37 1  33 o 158.4554 4.732995 229.9518  203.5 4.152817       9.465990 0.99 
1 1 1 -37 1  34 o 50.05382 8.387701 56.34579  120.2 40.10906       16.77540 0.84 
1 1 1 -37 1  35 o 63.94916 9.375677 101.5592  84.9  -35.08883      18.75135 0.94 
1 1 1 -37 1  36 o 55.56030 9.428063 77.23219  339.6 ?              ?        0.91 
1 1 1 -37 3  1  o 413.6308 3.982590 515.6678  245.2 15.54077       7.965180 0.98 
1 1 1 -37 3  2  o 406.8565 4.318221 500.0703  90.2  43.46359       8.636441 0.98 
1 1 1 -37 3  3  o 77.92346 5.949166 303.4195  82.4  41.03119       11.89833 0.75 
1 1 1 -37 3  4  o 263.8480 3.437726 324.8346  268.8 -41.91949      6.875452 0.94 
1 1 1 -37 3  5  o 195.3860 3.216264 287.3491  191.1 25.43333       6.432527 0.90 
1 1 1 -37 3  6  o 316.6616 3.612865 346.7461  47.3  27.47824       7.225730 0.95 
1 1 1 -37 3  7  o 151.0605 3.945341 162.5699  81.1  84.42953       7.890682 0.76 
1 1 1 -37 3  8  o 77.99754 7.819459 341.5799  205.3 -67.10929      15.63892 0.76 
1 1 1 -37 3  9  o 175.3668 4.071493 210.8212  191.7 42.90826       8.142985 0.87 
1 1 1 -37 3  10 o 370.2791 4.203966 630.8159  19.4  14.31918       8.407932 0.98 
1 1 1 -37 3  11 o 235.5526 3.781671 268.6992  247.0 -34.27406      7.563342 0.94 
1 1 1 -37 3  12 o 198.6761 3.704470 273.3879  51.1  29.71103       7.408941 0.93 
1 1 1 -37 3  13 o 155.3599 3.853218 230.5392  359.1 -34.41071      7.706435 0.89 
1 1 1 -37 3  14 o 278.9401 4.079589 494.2255  275.1 -60.66403      8.159178 0.98 
1 1 1 -37 3  15 o 214.1842 3.605789 419.7605  278.4 -25.19049      7.211578 0.97 
1 1 1 -37 3  16 o 75.14321 5.214236 76.18895  346.2 2.649185       10.42847 0.52 
1 1 1 -37 3  17 o 161.3397 3.450622 351.3969  147.3 21.07390       6.901243 0.97 
1 1 1 -37 3  18 o 162.1732 3.512855 195.0408  128.0 26.59843       7.025710 0.94 
1 1 1 -37 3  19 o 160.0049 3.516528 168.7382  258.7 11.56862       7.033056 0.94 
1 1 1 -37 3  20 o 89.42290 4.663146 124.9957  256.9 -13.44994      9.326292 0.85 
1 1 1 -37 3  21 o 224.7236 3.321275 312.8589  138.3 -15.73125      6.642550 0.98 
1 1 1 -37 3  22 o 48.33322 7.971936 120.2906  109.9 22.08919       15.94387 0.76 
1 1 1 -37 3  23 o 49.97209 7.906959 70.07538  215.7 -23.91528      15.81392 0.64 
1 1 1 -37 3  24 o 29.09533 8.632559 33.99536  101.4 2.755962       17.26512 0.25 
1 1 1 -37 3  25 o 168.1993 3.817298 220.9748  125.4 -19.95848      7.634597 0.98 
1 1 1 -37 3  26 o 143.6346 4.005997 193.9742  220.7 -21.33813      8.011993 0.98 
1 1 1 -37 3  27 o 52.35229 9.429976 71.80866  339.7 21.64611       18.85995 0.79 
1 1 1 -37 3  28 o 50.18034 7.769502 83.30095  112.3 -41.36542      15.53900 0.77 
1 1 1 -37 3  29 o 40.90211 10.07030 97.63499  210.9 4.927433       20.14059 0.75 
1 1 1 -37 3  30 f 83.00067 6.532270 88.11307  329.0 25.95200       13.06454 0.00 
1 1 1 -37 3  31 o 189.3729 4.099700 235.9581  2.2   6.672989       8.199401 0.99 
1 1 1 -37 3  32 o 54.28260 9.974474 127.4382  120.8 6.262005       19.94895 0.92 
1 1 1 -37 3  33 o 141.4991 4.484504 218.1702  322.2 -2.020020      8.969007 0.99 
1 1 1 -37 3  34 o 128.9257 5.245841 144.5514  309.5 0.7389832      10.49168 0.98 
1 1 1 -37 3  35 o 31.76630 10.13202 37.89050  182.5 6.099522       20.26404 0.61 
1 1 1 -37 3  36 o 25.69047 8.610801 13.02450  111.0 ?              ?        0.26 
1 1 1 -37 5  1  f 90.41773 4.574429 193.8170  206.6 31.93137       9.148857 0.00 
1 1 1 -37 5  2  o 215.4043 3.290801 402.5028  212.8 -5.149231      6.581602 0.97 
1 1 1 -37 5  3  o 136.6155 3.667373 269.1534  8.8   -1.010406      7.334746 0.92 
1 1 1 -37 5  4  o 263.2579 3.189980 452.4668  269.0 9.726227       6.379961 0.98 
1 1 1 -37 5  5  o 343.1284 3.905274 582.0071  276.8 15.01563       7.810549 0.98 
1 1 1 -37 5  6  o 159.9789 3.563920 287.5850  242.3 82.64790       7.127840 0.92 
1 1 1 -37 5  7  o 50.28132 7.529161 114.0736  120.2 -35.39804      15.05832 0.45 
1 1 1 -37 5  8  o 123.3508 3.542462 176.4680  349.1 -8.609398      7.084925 0.85 
1 1 1 -37 5  9  o 171.3134 3.810045 365.2287  255.3 29.94559       7.620089 0.95 
1 1 1 -37 5  10 o 65.21818 7.126102 196.6563  244.4 3.973675       14.25220 0.75 
1 1 1 -37 5  11 o 279.7160 4.116698 419.1310  65.5  -12.66995      8.233396 0.98 
1 1 1 -37 5  12 o 167.5583 3.648800 272.1758  89.7  -25.94739      7.297599 0.95 
1 1 1 -37 5  13 o 72.63579 6.220473 58.76353  61.3  -40.98254      12.44095 0.43 
1 1 1 -37 5  14 o 253.0022 3.779926 478.8185  199.6 -18.48674      7.559851 0.99 
1 1 1 -37 5  15 o 87.60612 4.711716 226.4962  192.2 -7.304367      9.423431 0.92 
1 1 1 -37 5  16 o 206.6941 3.330023 292.5230  208.6 -20.12993      6.660046 0.97 
1 1 1 -37 5  17 o 226.2149 4.648758 377.3945  327.0 7.648895       9.297516 0.98 
1 1 1 -37 5  18 o 200.8772 3.365779 265.0162  38.3  2.474182       6.731559 0.97 
1 1 1 -37 5  19 o 244.5594 3.434056 343.5102  105.1 -19.33057      6.868112 0.98 
1 1 1 -37 5  20 o 150.5930 3.366719 264.3302  277.1 -3.517441      6.733437 0.97 
1 1 1 -37 5  21 o 266.1821 3.713005 466.4526  302.9 -22.16217      7.426009 0.99 
1 1 1 -37 5  22 o 115.8239 3.940374 218.5453  166.9 4.881378       7.880749 0.96 
1 1 1 -37 5  23 o 125.5396 4.295047 152.2500  107.7 -6.916008      8.590095 0.95 
1 1 1 -37 5  24 o 230.1209 3.827192 345.1848  303.8 -5.050705      7.654384 0.99 
1 1 1 -37 5  25 o 112.3870 5.064837 149.1049  90.9  -6.788887      10.12967 0.96 
1 1 1 -37 5  26 o 42.87459 9.584272 26.95858  106.1 21.53667       19.16854 0.37 
1 1 1 -37 5  27 o 136.4827 4.466187 177.6831  22.7  -21.93954      8.932373 0.97 
1 1 1 -37 5  28 o 144.1426 4.389106 208.2378  298.7 5.235214       8.778213 0.97 
1 1 1 -37 5  29 f 87.96786 6.394049 153.0887  135.5 10.66457       12.78810 0.00 
1 1 1 -37 5  30 o 43.75333 9.958376 93.02682  36.5  -15.78336      19.91675 0.84 
1 1 1 -37 5  31 o 84.39915 8.405688 134.0775  66.6  -17.55982      16.81138 0.96 
1 1 1 -37 5  32 o 36.35804 9.906034 52.78222  236.9 -11.19243      19.81207 0.75 
1 1 1 -37 5  33 o 45.65022 10.28493 70.59467  16.1  -11.27523      20.56986 0.86 
1 1 1 -37 5  34 o 61.95235 9.963510 63.22608  37.6  -25.31180      19.92702 0.90 
1 1 1 -37 5  35 o 28.70277 9.087192 34.67466  188.7 ?              ?        0.61 
1 1 1 -37 7  1  o 247.9064 2.958110 406.9981  79.6  -7.200607      5.916220 0.98 
1 1 1 -37 7  2  o 99.29471 3.990509 118.7564  63.8  -0.8061829     7.981019 0.84 
1 1 1 -37 7  3  o 67.65375 6.185895 116.7795  174.4 4.967926       12.37179 0.77 
1 1 1 -37 7  4  o 116.1354 3.816867 217.0782  90.5  11.43300       7.633734 0.93 
1 1 1 -37 7  5  o 313.7723 3.691054 425.4911  14.9  -34.73581      7.382109 0.99 
1 1 1 -37 7  6  o 378.4976 4.029549 531.4807  1.6   17.83936       8.059098 0.99 
1 1 1 -37 7  7  o 161.1301 3.705389 271.3086  315.4 -18.57985      7.410777 0.96 
1 1 1 -37 7  8  f 160.7591 3.418222 194.2671  181.2 48.80690       6.836444 0.00 
1 1 1 -37 7  9  o 141.5925 3.813907 125.5230  155.7 52.93221       7.627813 0.90 
1 1 1 -37 7  10 o 94.36778 5.052347 200.2029  304.8 14.19405       10.10469 0.91 
1 1 1 -37 7  11 o 231.9250 3.682945 333.5968  182.4 49.37067       7.365891 0.98 
1 1 1 -37 7  12 o 79.62502 5.448366 127.8767  95.3  4.749512       10.89673 0.82 
1 1 1 -37 7  13 o 260.7996 3.399573 467.6001  341.0 12.42770       6.799145 0.99 
1 1 1 -37 7  14 f 102.0458 4.640251 182.6459  261.6 -4.379585      9.280501 0.00 
1 1 1 -37 7  15 o 114.8815 4.328236 160.7682  322.2 -26.72147      8.656472 0.93 
1 1 1 -37 7  16 o 64.09694 7.119387 117.6991  329.4 -16.20133      14.23877 0.82 
1 1 1 -37 7  17 o 183.4799 3.658772 302.5155  204.7 10.14406       7.317543 0.98 
1 1 1 -37 7  18 o 130.8216 4.163187 168.7484  196.7 9.590454       8.326373 0.96 
1 1 1 -37 7  19 o 138.9348 3.544168 240.3967  20.5  3.832611       7.088337 0.97 
1 1 1 -37 7  20 o 140.5457 3.700310 230.8888  235.8 -4.362915      7.400620 0.97 
1 1 1 -37 7  21 o 92.06560 5.802705 125.7598  166.5 10.52143       11.60541 0.93 
1 1 1 -37 7  22 o 174.7371 3.576190 292.7395  342.4 26.36081       7.152380 0.99 
1 1 1 -37 7  23 o 83.55637 7.409435 123.4644  256.8 -19.27999      14.81887 0.94 
1 1 1 -37 7  24 o 151.2838 4.721121 234.6469  13.8  -34.17387      9.442242 0.98 
1 1 1 -37 7  25 o 30.92099 9.537561 41.72472  209.7 10.41030       19.07512 0.35 
1 1 1 -37 7  26 o 123.1062 4.940732 194.3744  142.7 -16.47174      9.881463 0.97 
1 1 1 -37 7  27 o 77.81031 8.511168 119.1333  116.9 -25.68292      17.02234 0.92 
1 1 1 -37 7  28 o 36.05548 10.51109 84.36212  223.8 11.54469       21.02217 0.77 
1 1 1 -37 7  29 o 53.32097 10.38393 64.55723  229.0 39.43330       20.76786 0.84 
1 1 1 -37 7  30 o 35.27006 10.28784 34.97091  183.6 -3.121300      20.57569 0.60 
1 1 1 -37 7  31 o 71.40152 10.33409 109.0928  130.9 15.03358       20.66817 0.95 
1 1 1 -37 7  32 o 57.46397 11.42586 103.1516  278.2 8.088860       22.85172 0.93 
1 1 1 -37 7  33 o 38.94649 11.40798 47.85606  302.2 ?              ?        0.76 
1 1 1 -37 9  1  o 225.3351 5.335385 237.5160  327.4 -17.62477      10.67077 0.98 
1 1 1 -37 9  2  o 131.6657 3.898917 164.2655  225.2 1.599350       7.797835 0.95 
1 1 1 -37 9  3  f 165.9188 3.901085 199.6026  266.9 -32.13876      7.802171 0.00 
1 1 1 -37 9  4  o 49.53378 8.829820 99.45136  202.7 19.04225       17.65964 0.75 
1 1 1 -37 9  5  o 146.0316 4.030557 229.2790  195.1 14.83516       8.061114 0.97 
1 1 1 -37 9  6  f 115.3703 4.152087 205.7689  128.9 -4.969856      8.304173 0.00 
1 1 1 -37 9  7  o 199.1669 3.347910 333.5840  30.2  -13.35408      6.695820 0.98 
1 1 1 -37 9  8  o 135.9386 3.696393 192.4695  287.1 29.86716       7.392786 0.96 
1 1 1 -37 9  9  o 141.9526 3.458486 208.6773  247.9 8.945236       6.916972 0.97 
1 1 1 -37 9  10 o 46.79590 8.440235 152.7126  63.2  10.46635       16.88047 0.85 
1 1 1 -37 9  11 f 203.8698 3.163017 341.3946  49.0  -4.413040      6.326033 0.00 
1 1 1 -37 9  12 f 159.6037 3.649742 334.5940  323.0 0.3491364      7.299485 0.00 
1 1 1 -37 9  13 o 140.9356 3.798071 192.7057  243.8 -15.53905      7.596142 0.97 
1 1 1 -37 9  14 o 116.9184 4.594162 144.1168  247.9 -15.26218      9.188325 0.95 
1 1 1 -37 9  15 o 271.1054 4.004145 510.2948  17.4  -5.819519      8.008289 0.99 
1 1 1 -37 9  16 o 44.50926 9.450838 55.47206  176.5 12.41562       18.90168 0.59 
1 1 1 -37 9  17 f 148.2549 3.995722 337.7647  192.6 -3.031952      7.991444 0.00 
1 1 1 -37 9  18 o 100.8693 5.533911 104.6461  182.6 7.306213       11.06782 0.94 
1 1 1 -37 9  19 o 63.52941 7.783998 97.33513  152.8 -12.58775      15.56800 0.90 
1 1 1 -37 9  20 o 73.64188 8.773584 176.3158  56.6  -40.75693      17.54717 0.95 
1 1 1 -37 9  21 o 157.8805 3.910173 307.7273  333.7 2.496521       7.820346 0.98 
1 1 1 -37 9  22 o 98.51892 5.591128 213.8817  15.6  4.429222       11.18226 0.96 
1 1 1 -37 9  23 o 88.60840 7.507869 84.85483  111.2 14.22553       15.01574 0.90 
1 1 1 -37 9  24 o 70.88193 8.909352 163.4813  83.7  -25.20374      17.81870 0.94 
1 1 1 -37 9  25 o 42.39775 10.39069 71.89244  100.1 26.66708       20.78138 0.77 
1 1 1 -37 9  26 o 81.00099 9.400103 150.5339  202.3 -11.47598      18.80021 0.96 
1 1 1 -37 9  27 o 78.72449 9.966397 169.8393  186.8 -47.31216      19.93279 0.97 
1 1 1 -37 9  28 o 45.35307 10.49460 103.5988  287.9 52.10111       20.98919 0.91 
1 1 1 -37 9  29 o 34.92843 10.33957 19.19747  1.0   6.015419       20.67913 0.38 
1 1 1 -37 9  30 o 30.87481 10.21064 52.90260  56.7  11.60293       20.42127 0.72 
1 1 1 -37 9  31 o 42.21384 10.91778 111.0725  82.1  ?              ?        0.92 
1 1 1 -37 11 1  o 92.79597 5.431118 140.7277  299.5 -22.67829      10.86224 0.95 
1 1 1 -37 11 2  o 58.64829 8.524125 50.08284  182.4 24.54133       17.04825 0.76 
1 1 1 -37 11 3  o 173.8497 3.706971 277.4301  323.2 11.21068       7.413942 0.99 
1 1 1 -37 11 4  f 109.0824 5.043716 208.3385  317.2 6.663818       10.08743 0.00 
1 1 1 -37 11 5  o 41.83353 10.25236 91.11080  344.8 13.97454       20.50473 0.81 
1 1 1 -37 11 6  o 41.27166 9.644732 80.35780  293.9 23.65561       19.28946 0.78 
1 1 1 -37 11 7  o 137.8205 5.284533 266.8280  295.0 21.10844       10.56907 0.98 
1 1 1 -37 11 8  o 137.6248 4.461900 183.7749  206.7 -28.75999      8.923800 0.98 
1 1 1 -37 11 9  o 59.33363 9.033228 103.8822  145.9 -24.11812      18.06646 0.90 
1 1 1 -37 11 10 o 83.11076 6.005887 151.9358  267.6 7.846703       12.01177 0.96 
1 1 1 -37 11 11 o 147.3864 4.851781 268.3080  245.1 -6.495392      9.703562 0.99 
1 1 1 -37 11 12 o 70.63455 6.866390 123.3583  281.1 24.30094       13.73278 0.93 
1 1 1 -37 11 13 o 57.94669 9.631368 118.6201  316.1 7.898766       19.26274 0.89 
1 1 1 -37 11 14 o 95.38202 6.213292 162.8171  139.5 15.18142       12.42658 0.95 
1 1 1 -37 11 15 o 132.3382 4.860506 219.0372  232.0 -25.99110      9.721012 0.97 
1 1 1 -37 11 16 o 77.52073 7.281950 217.5367  287.0 45.23051       14.56390 0.95 
1 1 1 -37 11 17 o 41.07166 9.919408 99.63767  285.6 -4.200352      19.83882 0.78 
1 1 1 -37 11 18 o 38.49951 8.449839 51.79248  92.7  -26.48060      16.89968 0.57 
1 1 1 -37 11 19 o 101.0012 6.805778 174.7442  194.8 -10.62186      13.61156 0.96 
1 1 1 -37 11 20 o 170.4329 4.566660 293.9326  232.3 -7.577606      9.133320 0.99 
1 1 1 -37 11 21 o 50.51451 10.02805 68.94646  127.2 -11.62148      20.05610 0.82 
1 1 1 -37 11 22 o 99.73499 8.549359 216.6135  121.4 -54.95462      17.09872 0.98 
1 1 1 -37 11 23 f 157.3131 4.479383 259.3864  108.4 -12.56613      8.958765 0.00 
1 1 1 -37 11 24 o 61.29955 9.366796 121.8736  86.5  -33.69745      18.73359 0.95 
1 1 1 -37 11 25 o 103.1055 6.553337 142.8588  67.0  7.227707       13.10667 0.98 
1 1 1 -37 11 26 o 40.19938 10.21640 113.1671  163.5 -6.586845      20.43280 0.91 
1 1 1 -37 11 27 o 64.61922 10.90595 142.9776  179.1 -24.75283      21.81190 0.96 
1 1 1 -37 11 28 o 52.91116 10.25021 137.0646  132.9 ?              ?        0.95 
1 1 1 -37 13 1  o 87.58862 6.516195 120.1889  166.8 16.17912       13.03239 0.95 
1 1 1 -37 13 2  o 52.70033 9.044949 72.95665  169.8 34.05055       18.08990 0.82 
1 1 1 -37 13 3  o 106.1633 5.729648 160.5811  148.4 10.46845       11.45930 0.97 
1 1 1 -37 13 4  o 247.8373 3.917954 405.1385  119.4 22.99724       7.835907 0.99 
1 1 1 -37 13 5  o 145.6945 4.573085 185.5257  155.1 43.77299       9.146171 0.98 
1 1 1 -37 13 6  o 34.74957 10.18898 68.86009  242.7 -3.211365      20.37797 0.67 
1 1 1 -37 13 7  o 42.13734 10.54115 73.43748  293.9 -5.796703      21.08230 0.75 
1 1 1 -37 13 8  o 55.24768 11.04176 130.3126  133.8 -22.29999      22.08352 0.90 
1 1 1 -37 13 9  o 71.34338 9.779839 90.21070  151.6 15.99363       19.55968 0.90 
1 1 1 -37 13 10 o 33.02131 10.42415 26.83532  1.0   1.582687       20.84829 0.33 
1 1 1 -37 13 11 o 43.87452 11.00849 66.71188  264.0 -13.30364      22.01697 0.75 
1 1 1 -37 13 12 o 45.55285 11.19363 126.0206  180.3 12.10285       22.38726 0.89 
1 1 1 -37 13 13 o 47.24463 11.87958 126.1967  233.6 -1.262367      23.75916 0.90 
1 1 1 -37 13 14 o 64.46460 11.15897 157.3027  37.9  -23.57265      22.31794 0.95 
1 1 1 -37 13 15 o 62.02445 11.19370 96.50726  62.2  -29.35759      22.38739 0.91 
1 1 1 -37 13 16 o 44.60436 11.17013 92.61047  138.9 -8.168732      22.34027 0.88 
1 1 1 -37 13 17 o 37.94131 10.77803 38.78261  151.8 8.747932       21.55606 0.65 
1 1 1 -37 13 18 o 40.38555 10.63114 39.56430  350.0 -2.193115      21.26228 0.71 
1 1 1 -37 13 19 o 70.78058 8.470955 145.3341  255.2 2.017738       16.94191 0.97 
1 1 1 -37 13 20 o 106.0798 8.229548 192.7313  140.2 -1.687622      16.45910 0.98 
1 1 1 -37 13 21 o 65.12655 10.83781 145.7550  47.3  -24.91892      21.67562 0.96 
1 1 1 -37 13 22 o 90.48579 7.869334 201.5211  333.6 5.449188       15.73867 0.98 
1 1 1 -37 13 23 o 30.20891 10.01523 55.76892  296.3 ?              ?        0.77 
1 1 1 -37 13 24 o 38.92389 11.09363 61.69913  232.6 ?              ?        0.84 
1 1 1 -37 15 1  o 44.73137 10.80185 79.15411  162.9 -1.483837      21.60371 0.88 
1 1 1 -37 15 2  o 34.95827 10.36881 59.11436  215.9 3.811298       20.73762 0.79 
1 1 1 -37 15 3  o 63.27218 10.02607 130.0609  156.0 5.637505       20.05213 0.95 
1 1 1 -37 15 4  o 114.6711 6.326194 195.2511  182.5 12.98053       12.65239 0.99 
1 1 1 -37 15 5  o 51.95092 11.53652 125.2869  256.0 -9.198364      23.07304 0.94 
1 1 1 -37 15 6  o 65.27701 11.05615 118.1978  314.1 14.56536       22.11230 0.95 
1 1 1 -37 15 7  o 28.65591 9.360617 22.06270  64.9  4.856455       18.72123 0.40 
1 1 1 -37 15 8  o 81.07797 11.30491 201.9903  190.3 -15.92268      22.60983 0.98 
1 1 1 -37 15 9  o 46.14112 10.72102 131.4081  177.1 -27.79534      21.44204 0.93 
1 1 1 -37 15 10 o 37.57314 11.64815 55.71847  219.0 12.53771       23.29630 0.77 
1 1 1 -37 15 11 o 61.31828 11.18920 114.0606  291.4 55.66851       22.37841 0.94 
1 1 1 -37 15 12 o 38.07196 11.89169 27.02245  196.0 19.17524       23.78338 0.54 
1 1 1 -37 15 13 o 40.12455 11.53752 108.5653  167.2 21.58776       23.07504 0.91 
1 1 1 -37 15 14 o 69.95575 10.96381 149.2611  169.6 -47.46030      21.92763 0.96 
1 1 1 -37 15 15 o 40.56398 12.18979 57.59593  27.2  ?              ?        0.81 
1 1 1 -37 15 16 o 63.58004 13.00537 186.0001  33.8  ?              ?        0.97 
1 1 1 -37 15 17 o 66.21011 12.73094 141.1559  4.0   ?              ?        0.96 
1 1 1 -36 0  1  o 328.0530 4.801266 566.3535  360.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  2  f 96.41118 5.574195 36.45618  180.0 -0.000000      0.000000 0.00 
1 1 1 -36 0  3  o 103.5007 7.822868 230.7474  360.0 -0.000000      0.000000 0.65 
1 1 1 -36 0  4  o 418.1786 6.852880 628.5128  360.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  5  o 159.8001 6.310922 274.4492  0.0   -0.000000      0.000000 0.92 
1 1 1 -36 0  6  o 529.0104 7.939899 676.8445  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  7  o 387.1375 6.436940 506.1152  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  8  o 591.8226 8.419990 974.4955  0.0   -0.000000      0.000000 1.00 
1 1 1 -36 0  9  o 703.5878 9.573614 929.2131  360.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  10 o 425.2797 7.199132 597.4084  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  11 o 229.9381 5.616303 391.9222  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  12 o 439.9353 6.695491 570.2324  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  13 o 12.72984 9.246843 126.6263  180.0 -0.000000      0.000000 0.09 
1 1 1 -36 0  14 o 440.5687 6.766726 639.7189  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  15 o 478.0475 7.259987 701.6007  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  16 o 300.6277 5.625774 305.0119  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  17 o 204.8944 4.780863 282.3849  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  18 o 256.1819 5.421603 345.5502  0.0   -0.000000      0.000000 1.00 
1 1 1 -36 0  19 o 366.2660 6.026097 484.4825  360.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  20 o 12.79398 9.298392 179.2497  180.0 -0.000000      0.000000 0.35 
1 1 1 -36 0  21 o 116.9443 4.886089 35.59995  180.0 -0.000000      0.000000 0.56 
1 1 1 -36 0  22 o 162.2033 4.338842 284.5331  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  23 o 304.6786 5.375219 432.7084  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  24 o 193.8530 5.239055 364.0014  0.0   -0.000000      0.000000 1.00 
1 1 1 -36 0  25 o 213.3987 4.840402 283.0305  360.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  26 o 459.4686 6.701087 623.2246  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  27 o 282.1570 7.482596 351.7946  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  28 o 133.3259 6.165757 126.8903  180.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  29 o 94.35428 7.932194 90.64670  180.0 -0.000000      0.000000 0.99 
1 1 1 -36 0  30 o 20.65920 13.34362 48.32194  180.0 -0.000000      0.000000 0.29 
1 1 1 -36 0  31 o 32.31879 17.37049 2.204615  360.0 -0.000000      0.000000 0.02 
1 1 1 -36 0  32 o 40.02819 17.22466 3.625881  0.0   -0.000000      0.000000 0.06 
1 1 1 -36 0  33 o 32.42291 16.93967 147.6390  180.0 -0.000000      0.000000 0.98 
1 1 1 -36 0  34 f 104.4161 8.809394 168.8241  0.0   -0.000000      0.000000 0.00 
1 1 1 -36 0  35 o 94.48907 8.311781 206.4098  360.0 -0.000000      0.000000 1.00 
1 1 1 -36 0  36 o 63.29541 17.10455 53.42835  0.0   ?              ?        0.97 
1 1 1 -36 2  1  o 63.45403 6.488311 179.1376  175.5 77.27101       12.97662 0.29 
1 1 1 -36 2  2  o 111.0546 3.677042 184.6365  94.7  10.47272       7.354084 0.67 
1 1 1 -36 2  3  o 368.9766 4.186003 444.8612  95.7  33.34332       8.372006 0.96 
1 1 1 -36 2  4  o 533.8061 4.835472 683.5861  209.8 20.90625       9.670943 0.98 
1 1 1 -36 2  5  o 168.1257 3.781042 275.5117  288.5 -29.33780      7.562084 0.82 
1 1 1 -36 2  6  o 134.7395 3.933927 225.1383  52.9  -33.71558      7.867853 0.74 
1 1 1 -36 2  7  o 361.5950 4.096045 376.1858  87.7  4.124481       8.192089 0.96 
1 1 1 -36 2  8  o 112.1404 5.128106 248.5889  236.1 25.93804       10.25621 0.70 
1 1 1 -36 2  9  o 126.7324 4.655068 106.0454  53.8  22.20702       9.310137 0.53 
1 1 1 -36 2  10 o 520.9395 5.462437 642.7437  272.2 6.164307       10.92487 0.98 
1 1 1 -36 2  11 o 106.7254 4.880193 85.81702  210.1 -15.93553      9.760386 0.38 
1 1 1 -36 2  12 o 302.8461 3.963239 490.7305  28.0  -51.10547      7.926478 0.97 
1 1 1 -36 2  13 o 151.1927 4.035224 316.2228  182.4 9.079391       8.070449 0.89 
1 1 1 -36 2  14 o 274.3739 3.894710 443.7484  254.0 -19.96027      7.789421 0.97 
1 1 1 -36 2  15 o 175.1646 3.467625 275.3598  223.9 6.908386       6.935250 0.92 
1 1 1 -36 2  16 o 95.89320 4.254957 272.2578  249.9 -10.94893      8.509914 0.88 
1 1 1 -36 2  17 o 227.2273 3.406660 291.5198  135.3 30.01021       6.813321 0.96 
1 1 1 -36 2  18 o 177.2458 3.372722 204.2954  304.4 -39.64731      6.745443 0.95 
1 1 1 -36 2  19 o 71.05448 5.322035 55.54759  227.5 -3.947800      10.64407 0.48 
1 1 1 -36 2  20 o 226.1701 3.394868 393.3439  175.6 5.974686       6.789736 0.98 
1 1 1 -36 2  21 o 88.71980 4.445627 90.09400  168.3 20.27277       8.891254 0.79 
1 1 1 -36 2  22 o 116.3435 3.851137 185.3174  117.2 20.58771       7.702274 0.93 
1 1 1 -36 2  23 o 166.8152 3.427448 268.8393  83.7  24.14867       6.854896 0.97 
1 1 1 -36 2  24 f 116.0496 3.880698 152.2407  206.1 28.52750       7.761397 0.00 
1 1 1 -36 2  25 o 138.5816 3.507206 198.1917  286.4 -16.98047      7.014412 0.97 
1 1 1 -36 2  26 o 247.7999 3.560433 381.4932  322.5 28.21057       7.120867 0.99 
1 1 1 -36 2  27 o 74.66476 5.968115 169.8041  281.7 20.80570       11.93623 0.95 
1 1 1 -36 2  28 o 41.99287 8.355487 104.2358  223.0 20.66225       16.71097 0.81 
1 1 1 -36 2  29 o 46.18385 8.944748 87.09893  147.3 -2.296768      17.88950 0.74 
1 1 1 -36 2  30 o 72.13579 7.011271 112.3643  12.5  6.794106       14.02254 0.90 
1 1 1 -36 2  31 o 85.07510 6.015652 95.05981  85.7  -21.65759      12.03130 0.92 
1 1 1 -36 2  32 o 95.96698 8.769213 111.6871  200.2 -22.08015      17.53843 0.95 
1 1 1 -36 2  33 o 132.1558 5.067981 190.1898  249.6 5.073792       10.13596 0.98 
1 1 1 -36 2  34 o 31.53124 9.510958 21.63797  170.2 -3.529861      19.02192 0.38 
1 1 1 -36 2  35 o 65.71536 10.17820 131.1829  58.3  -27.11858      20.35641 0.95 
1 1 1 -36 2  36 o 28.10398 9.192998 27.41453  157.7 ?              ?        0.48 
1 1 1 -36 4  1  o 112.4184 3.825149 190.4096  335.6 15.44489       7.650298 0.80 
1 1 1 -36 4  2  o 74.17657 5.981939 35.92250  344.2 -38.62304      11.96388 0.26 
1 1 1 -36 4  3  o 258.6302 3.311148 342.4038  326.7 -22.31218      6.622296 0.95 
1 1 1 -36 4  4  o 220.8535 3.204555 233.9230  253.4 -22.46037      6.409110 0.91 
1 1 1 -36 4  5  o 254.5363 3.421285 362.1723  248.4 22.57851       6.842570 0.95 
1 1 1 -36 4  6  o 80.12688 5.824214 40.94250  144.2 22.36693       11.64843 0.24 
1 1 1 -36 4  7  o 79.93942 5.171094 221.0943  43.9  -24.57866      10.34219 0.69 
1 1 1 -36 4  8  o 322.3815 3.867465 432.7856  16.4  8.298157       7.734930 0.97 
1 1 1 -36 4  9  o 105.0841 4.677404 193.3513  315.7 18.99838       9.354808 0.76 
1 1 1 -36 4  10 o 202.1040 3.641926 337.5871  30.3  38.14275       7.283852 0.94 
1 1 1 -36 4  11 o 198.6404 3.722442 388.4715  31.4  18.18913       7.444884 0.95 
1 1 1 -36 4  12 o 111.6311 4.357510 65.90301  269.0 -5.107140      8.715020 0.49 
1 1 1 -36 4  13 o 177.0494 3.685470 299.9301  188.5 -8.409561      7.370941 0.94 
1 1 1 -36 4  14 o 321.2184 4.169495 431.8580  193.9 -16.52307      8.338989 0.98 
1 1 1 -36 4  15 f 228.5648 3.650269 367.6998  334.9 11.71719       7.300537 0.00 
1 1 1 -36 4  16 o 91.21042 4.802941 141.9077  175.0 -32.85788      9.605883 0.84 
1 1 1 -36 4  17 o 123.0022 3.783050 89.49773  136.1 -4.747047      7.566099 0.83 
1 1 1 -36 4  18 o 74.36455 5.720382 209.1622  329.0 -8.218758      11.44076 0.89 
1 1 1 -36 4  19 f 129.6706 3.618160 197.4364  177.2 37.14689       7.236320 0.00 
1 1 1 -36 4  20 f 173.6912 4.348596 378.1318  206.7 -32.24055      8.697192 0.00 
1 1 1 -36 4  21 o 140.7122 3.465055 241.2453  311.3 10.81923       6.930110 0.96 
1 1 1 -36 4  22 o 58.35709 6.886493 67.96597  27.0  -6.546131      13.77299 0.67 
1 1 1 -36 4  23 o 206.5994 3.418657 338.2947  189.9 26.90701       6.837314 0.99 
1 1 1 -36 4  24 o 40.23063 9.635895 39.49648  321.1 6.552685       19.27179 0.38 
1 1 1 -36 4  25 o 166.7039 3.807290 215.9504  101.7 -12.99500      7.614579 0.98 
1 1 1 -36 4  26 o 111.2354 4.651162 130.5596  30.7  16.92038       9.302324 0.96 
1 1 1 -36 4  27 o 139.4360 3.974164 211.3685  69.1  11.60930       7.948329 0.98 
1 1 1 -36 4  28 o 69.33005 7.864324 75.05505  39.8  -10.90478      15.72865 0.81 
1 1 1 -36 4  29 o 162.0821 4.373335 185.2051  155.8 7.525711       8.746671 0.97 
1 1 1 -36 4  30 o 134.4003 4.625333 207.2887  245.4 -16.12303      9.250667 0.98 
1 1 1 -36 4  31 o 129.0152 4.585883 231.1397  346.4 13.57720       9.171766 0.98 
1 1 1 -36 4  32 o 138.5513 4.626499 201.1403  351.9 12.92812       9.252997 0.99 
1 1 1 -36 4  33 o 134.7156 4.894290 198.5925  338.2 0.1691589      9.788580 0.99 
1 1 1 -36 4  34 o 61.14828 9.683218 87.20506  270.5 6.567299       19.36644 0.92 
1 1 1 -36 4  35 o 72.65343 8.924785 115.8717  246.6 17.88778       17.84957 0.96 
1 1 1 -36 6  1  o 256.1891 3.020520 509.1427  263.8 20.31938       6.041039 0.99 
1 1 1 -36 6  2  f 230.9969 2.881029 373.6535  311.3 19.17833       5.762059 0.00 
1 1 1 -36 6  3  o 279.4440 3.104616 559.0486  87.3  -14.41714      6.209232 0.99 
1 1 1 -36 6  4  o 93.69432 4.342050 210.6029  110.5 17.74256       8.684099 0.85 
1 1 1 -36 6  5  o 173.8704 3.264722 203.4460  301.0 -5.655411      6.529445 0.93 
1 1 1 -36 6  6  o 223.6161 3.230193 355.6822  160.4 -32.66406      6.460385 0.97 
1 1 1 -36 6  7  o 276.7144 3.321381 442.7072  44.9  -36.23935      6.642763 0.98 
1 1 1 -36 6  8  o 106.4041 3.694640 220.6801  32.0  -22.35000      7.389280 0.89 
1 1 1 -36 6  9  o 299.3277 3.348883 475.7639  181.2 -21.52075      6.697767 0.98 
1 1 1 -36 6  10 o 225.8472 3.929216 352.8950  240.1 -22.79129      7.858433 0.97 
1 1 1 -36 6  11 o 124.9001 3.533460 271.0855  190.0 -12.52589      7.066919 0.94 
1 1 1 -36 6  12 o 107.5049 5.197695 109.0424  322.4 15.89696       10.39539 0.87 
1 1 1 -36 6  13 o 85.59210 5.988626 163.0202  279.2 1.568787       11.97725 0.87 
1 1 1 -36 6  14 o 151.6352 4.699187 267.4132  153.1 11.29495       9.398374 0.96 
1 1 1 -36 6  15 o 179.3141 4.409119 366.6242  103.7 -16.27617      8.818238 0.98 
1 1 1 -36 6  16 o 65.33170 7.908652 176.3089  304.8 30.91479       15.81730 0.84 
1 1 1 -36 6  17 o 239.2283 4.395386 541.0347  300.1 -4.094162      8.790771 0.99 
1 1 1 -36 6  18 o 102.9497 4.521359 112.0513  265.6 39.02063       9.042719 0.88 
1 1 1 -36 6  19 o 35.82455 8.492395 45.77395  344.1 -9.362438      16.98479 0.33 
1 1 1 -36 6  20 o 91.01881 4.821797 173.4949  52.1  -3.825577      9.643594 0.94 
1 1 1 -36 6  21 o 62.85063 7.514866 100.6250  9.5   -15.11608      15.02973 0.83 
1 1 1 -36 6  22 o 101.4380 4.327217 163.7794  15.3  -14.28954      8.654433 0.95 
1 1 1 -36 6  23 o 122.4582 4.342942 187.4253  79.4  -25.97164      8.685884 0.97 
1 1 1 -36 6  24 o 189.8239 3.510456 312.8932  302.3 -13.63080      7.020912 0.99 
1 1 1 -36 6  25 o 57.31361 8.629197 117.0494  169.7 -8.935078      17.25839 0.89 
1 1 1 -36 6  26 o 43.78248 10.30115 59.00995  180.1 11.56937       20.60230 0.60 
1 1 1 -36 6  27 o 123.3611 4.989038 164.8521  247.6 12.48272       9.978076 0.96 
1 1 1 -36 6  28 o 43.18417 9.358474 80.81762  299.6 -20.86116      18.71695 0.75 
1 1 1 -36 6  29 o 53.53991 9.353573 104.6932  142.9 -31.21012      18.70715 0.88 
1 1 1 -36 6  30 o 40.32759 10.72140 71.89799  310.9 10.81954       21.44280 0.79 
1 1 1 -36 6  31 o 41.84616 10.95132 45.17536  196.2 21.04598       21.90263 0.72 
1 1 1 -36 6  32 o 61.45982 8.786712 123.5280  245.5 -52.05931      17.57342 0.95 
1 1 1 -36 6  33 o 42.67463 10.72103 70.40895  24.4  -16.43549      21.44205 0.85 
1 1 1 -36 6  34 o 51.50991 11.18366 75.15125  82.6  ?              ?        0.90 
1 1 1 -36 8  1  o 130.0042 4.606591 180.5441  96.7  17.88223       9.213181 0.94 
1 1 1 -36 8  2  o 90.81207 4.672245 131.0841  318.8 16.35559       9.344490 0.87 
1 1 1 -36 8  3  f 220.9193 2.903636 260.7817  205.1 6.101105       5.807272 0.00 
1 1 1 -36 8  4  o 308.2197 4.996875 506.4725  177.4 -17.83926      9.993751 0.99 
1 1 1 -36 8  5  o 156.1500 3.430555 307.5604  273.1 -9.124847      6.861110 0.97 
1 1 1 -36 8  6  o 248.5616 3.234849 455.5666  345.0 -5.865326      6.469699 0.99 
1 1 1 -36 8  7  o 385.6895 4.168635 581.0227  334.4 11.40894       8.337270 0.99 
1 1 1 -36 8  8  o 205.2900 3.983544 303.6775  301.7 29.79794       7.967089 0.97 
1 1 1 -36 8  9  o 58.22138 6.877855 195.2175  9.9   -22.71291      13.75571 0.83 
1 1 1 -36 8  10 o 177.5404 3.398565 285.6762  76.4  34.55869       6.797129 0.97 
1 1 1 -36 8  11 o 139.7456 3.579413 239.6353  171.9 5.849625       7.158825 0.96 
1 1 1 -36 8  12 o 127.4803 4.415609 124.3573  105.2 1.236588       8.831219 0.91 
1 1 1 -36 8  13 o 108.7802 4.019643 182.5390  260.9 -17.56547      8.039286 0.93 
1 1 1 -36 8  14 o 145.2304 3.335574 229.5210  237.2 -9.896378      6.671148 0.96 
1 1 1 -36 8  15 o 162.8215 3.827459 301.2831  330.7 -22.21309      7.654919 0.98 
1 1 1 -36 8  16 o 119.6502 3.974280 187.8094  78.0  8.466118       7.948561 0.96 
1 1 1 -36 8  17 o 62.05268 8.229797 142.4885  146.1 10.68219       16.45959 0.89 
1 1 1 -36 8  18 o 32.55785 9.055613 52.41565  122.9 -1.575741      18.11123 0.42 
1 1 1 -36 8  19 o 53.98325 8.104419 96.40817  72.2  -3.717144      16.20884 0.82 
1 1 1 -36 8  20 o 64.92232 8.546149 69.22074  343.3 -37.28468      17.09230 0.81 
1 1 1 -36 8  21 o 54.03493 7.986742 81.63454  143.0 7.419712       15.97348 0.85 
1 1 1 -36 8  22 o 158.1521 3.940911 197.8025  357.6 -21.27437      7.881823 0.98 
1 1 1 -36 8  23 o 139.2655 5.021382 271.1888  192.4 27.05862       10.04276 0.98 
1 1 1 -36 8  24 o 113.2619 4.925761 251.8964  131.3 10.77647       9.851521 0.97 
1 1 1 -36 8  25 o 25.83190 8.786637 29.33697  234.3 11.95041       17.57327 0.24 
1 1 1 -36 8  26 o 36.67123 9.071989 45.75295  331.2 -14.26512      18.14398 0.52 
1 1 1 -36 8  27 o 72.46542 8.478463 119.1513  119.0 11.51009       16.95693 0.93 
1 1 1 -36 8  28 o 41.92781 11.09857 84.89408  280.3 23.24095       22.19715 0.84 
1 1 1 -36 8  29 o 79.16514 10.02317 137.3836  310.8 1.231125       20.04634 0.96 
1 1 1 -36 8  30 o 71.68648 10.04947 71.53125  228.2 -5.335991      20.09894 0.92 
1 1 1 -36 8  31 o 55.63550 11.67535 63.87964  110.9 23.66872       23.35070 0.87 
1 1 1 -36 8  32 o 38.93418 10.86828 49.08484  238.1 ?              ?        0.77 
1 1 1 -36 10 1  o 177.4238 3.636657 281.9225  351.3 3.549118       7.273314 0.98 
1 1 1 -36 10 2  o 92.67606 5.860690 204.0088  347.0 -8.375076      11.72138 0.95 
1 1 1 -36 10 3  o 217.2395 3.361605 342.2600  293.2 6.374329       6.723209 0.99 
1 1 1 -36 10 4  o 122.3347 4.509593 168.3714  280.0 -19.97539      9.019187 0.96 
1 1 1 -36 10 5  o 200.3488 3.606878 280.6274  44.5  24.81311       7.213755 0.98 
1 1 1 -36 10 6  o 205.6340 4.931199 283.0829  53.3  -10.63589      9.862397 0.98 
1 1 1 -36 10 7  o 150.1608 3.866484 231.3521  3.9   26.15878       7.732969 0.97 
1 1 1 -36 10 8  o 120.8217 4.426081 184.6561  302.5 -1.122185      8.852162 0.96 
1 1 1 -36 10 9  o 119.6574 3.672920 172.1943  273.7 -34.69301      7.345840 0.96 
1 1 1 -36 10 10 o 101.0735 4.350079 100.4456  326.4 -10.34255      8.700158 0.91 
1 1 1 -36 10 11 o 111.5767 4.315289 122.3673  345.9 -0.8091736     8.630578 0.94 
1 1 1 -36 10 12 o 203.0949 3.418920 368.3128  283.5 17.38799       6.837839 0.99 
1 1 1 -36 10 13 o 137.1342 4.210372 290.2451  165.7 -29.90109      8.420744 0.98 
1 1 1 -36 10 14 o 122.5023 4.141190 115.8528  130.9 0.5999222      8.282380 0.95 
1 1 1 -36 10 15 o 47.11294 9.179695 68.17555  8.7   1.049736       18.35939 0.75 
1 1 1 -36 10 16 o 113.7211 5.037902 133.4553  283.7 23.79550       10.07580 0.96 
1 1 1 -36 10 17 o 47.08187 7.745440 89.59788  134.8 -37.56138      15.49088 0.84 
1 1 1 -36 10 18 o 102.0424 5.571880 174.0132  132.3 -5.459000      11.14376 0.96 
1 1 1 -36 10 19 o 51.56932 8.175307 79.00078  160.4 -36.85555      16.35061 0.78 
1 1 1 -36 10 20 o 103.5351 5.149672 173.6499  278.5 42.59692       10.29934 0.96 
1 1 1 -36 10 21 o 138.6420 4.935460 263.1212  299.5 -18.18823      9.870919 0.98 
1 1 1 -36 10 22 o 41.57964 9.766870 13.63694  327.3 -5.538147      19.53374 0.20 
1 1 1 -36 10 23 o 36.09772 9.801216 62.25136  284.3 15.48843       19.60243 0.66 
1 1 1 -36 10 24 o 70.41374 8.207041 139.6359  242.7 11.50858       16.41408 0.95 
1 1 1 -36 10 25 o 31.43063 9.364388 31.76835  197.5 -1.129641      18.72878 0.48 
1 1 1 -36 10 26 o 41.18553 10.44852 90.28263  151.6 -7.171425      20.89704 0.88 
1 1 1 -36 10 27 o 71.21005 10.24173 140.9313  191.1 -45.67802      20.48347 0.96 
1 1 1 -36 10 28 o 49.75929 11.77627 67.77908  235.0 -9.442711      23.55253 0.86 
1 1 1 -36 10 29 o 57.73172 9.691138 96.20652  170.2 -44.32639      19.38228 0.93 
1 1 1 -36 10 30 o 36.00681 11.81296 39.59863  220.5 ?              ?        0.69 
1 1 1 -36 12 1  o 119.0008 4.504120 186.8891  95.2  -11.85082      9.008241 0.97 
1 1 1 -36 12 2  o 128.4596 4.347734 226.5186  270.3 11.30170       8.695469 0.97 
1 1 1 -36 12 3  o 156.7944 4.089403 215.0293  272.9 29.04951       8.178806 0.98 
1 1 1 -36 12 4  o 64.79829 7.811390 56.62575  60.6  -18.13332      15.62278 0.76 
1 1 1 -36 12 5  o 56.29792 9.426032 72.69913  219.8 11.99606       18.85206 0.78 
1 1 1 -36 12 6  o 71.88843 8.005776 51.80264  271.2 -21.04832      16.01155 0.77 
1 1 1 -36 12 7  o 129.6161 5.438401 215.4919  227.1 6.158417       10.87680 0.97 
1 1 1 -36 12 8  o 114.3202 6.041882 165.5369  186.2 14.52059       12.08376 0.96 
1 1 1 -36 12 9  o 81.90752 7.327952 119.4393  64.2  -17.80866      14.65590 0.92 
1 1 1 -36 12 10 o 171.0836 5.523511 350.0216  2.6   -29.82545      11.04702 0.99 
1 1 1 -36 12 11 o 90.34349 6.575378 163.9478  355.5 -9.372330      13.15076 0.95 
1 1 1 -36 12 12 o 164.3829 4.895241 206.7040  204.0 2.970093       9.790482 0.98 
1 1 1 -36 12 13 o 58.71487 9.989539 50.91764  259.9 -39.44094      19.97908 0.69 
1 1 1 -36 12 14 f 42.50124 11.12695 74.70161  70.3  16.89484       22.25390 0.00 
1 1 1 -36 12 15 o 33.29071 9.739843 41.62174  294.6 -8.267382      19.47969 0.44 
1 1 1 -36 12 16 o 39.09322 10.23661 53.71532  40.3  -8.226315      20.47322 0.60 
1 1 1 -36 12 17 o 70.61264 7.743539 68.53063  274.2 5.334099       15.48708 0.87 
1 1 1 -36 12 18 o 138.6678 4.672232 311.2057  222.3 -2.905869      9.344464 0.99 
1 1 1 -36 12 19 o 206.4856 5.408597 339.9940  226.8 -3.095505      10.81719 0.99 
1 1 1 -36 12 20 o 51.65609 10.08946 72.61820  125.0 -23.43504      20.17891 0.87 
1 1 1 -36 12 21 o 122.7951 6.044314 174.8872  113.5 -9.442703      12.08863 0.98 
1 1 1 -36 12 22 o 62.98135 9.296357 99.21259  76.4  3.971981       18.59271 0.94 
1 1 1 -36 12 23 o 39.73520 9.515626 50.44427  88.4  -7.569916      19.03125 0.78 
1 1 1 -36 12 24 o 34.20792 9.826922 66.38544  77.0  1.755650       19.65384 0.81 
1 1 1 -36 12 25 o 65.06081 10.63289 84.00315  107.5 -20.04332      21.26578 0.93 
1 1 1 -36 12 26 f 34.84193 9.981716 52.39976  226.9 ?              ?        0.00 
1 1 1 -36 14 1  o 63.56214 9.484893 111.8489  162.5 -7.785797      18.96979 0.94 
1 1 1 -36 14 2  o 53.82970 9.951417 93.02034  204.4 8.545288       19.90283 0.91 
1 1 1 -36 14 3  o 40.12781 10.43142 35.53656  318.8 -9.169739      20.86284 0.61 
1 1 1 -36 14 4  o 59.90087 9.097130 103.1408  286.6 1.158031       18.19426 0.93 
1 1 1 -36 14 5  o 82.76875 7.708761 132.8145  275.6 14.52014       15.41752 0.96 
1 1 1 -36 14 6  o 34.93937 9.786637 65.92765  151.1 -18.18624      19.57327 0.77 
1 1 1 -36 14 7  o 43.69060 9.779317 114.1448  226.6 21.69956       19.55863 0.90 
1 1 1 -36 14 8  o 70.24113 10.92003 120.2003  228.7 10.90808       21.84006 0.94 
1 1 1 -36 14 9  o 70.50142 11.19925 126.6426  11.8  -12.38773      22.39851 0.95 
1 1 1 -36 14 10 o 32.65238 10.43345 41.98769  110.2 14.08189       20.86690 0.61 
1 1 1 -36 14 11 o 52.78394 11.90042 29.40491  238.8 0.9458885      23.80084 0.64 
1 1 1 -36 14 12 o 36.51762 11.36718 30.98490  60.0  11.80046       22.73437 0.54 
1 1 1 -36 14 13 o 60.00119 12.32026 100.2456  257.8 2.779976       24.64051 0.92 
1 1 1 -36 14 14 o 41.21604 12.27045 96.04130  132.7 15.05104       24.54090 0.89 
1 1 1 -36 14 15 o 59.29379 11.51802 94.88734  70.8  -12.99709      23.03605 0.93 
1 1 1 -36 14 16 o 40.54105 11.15961 98.08673  93.0  -6.504303      22.31922 0.89 
1 1 1 -36 14 17 o 47.31916 12.04301 109.1954  51.5  33.42982       24.08603 0.92 
1 1 1 -36 14 18 o 40.67400 11.61850 50.87586  69.8  10.59097       23.23700 0.77 
1 1 1 -36 14 19 o 47.51236 11.44880 96.38225  260.2 -8.318230      22.89759 0.91 
1 1 1 -36 14 20 o 30.36083 10.45182 78.07085  136.5 13.86536       20.90364 0.84 
1 1 1 -36 14 21 o 44.22887 10.91236 96.43844  51.6  ?              ?        0.92 
1 1 1 -36 16 1  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -36 16 2  o 37.83373 10.51208 56.30482  287.6 ?              ?        0.83 
1 1 1 -36 16 3  o 44.94826 11.47694 29.43472  100.3 ?              ?        0.68 
1 1 1 -36 16 4  o 86.67326 8.255242 137.8366  152.4 ?              ?        0.98 
1 1 1 -36 16 5  o 52.68449 11.82337 77.38541  105.1 ?              ?        0.91 
1 1 1 -36 16 6  o 46.97769 12.07420 106.7261  302.4 ?              ?        0.92 
1 1 1 -36 16 7  o 84.35164 8.888426 122.7796  263.5 ?              ?        0.97 
1 1 1 -36 16 8  o 31.05917 10.23285 23.25823  318.3 ?              ?        0.49 
1 1 1 -36 16 9  o 43.86937 12.01284 88.41331  56.9  ?              ?        0.90 
1 1 1 -36 16 10 o 35.03079 11.13306 20.87502  313.8 ?              ?        0.48 
1 1 1 -36 16 11 x ?        ?        118.9708  269.4 ?              ?        0.00 
1 1 1 -35 1  1  o 431.6273 4.324878 624.9573  46.5  37.64615       8.649756 0.97 
1 1 1 -35 1  2  o 285.1968 3.742802 408.8776  68.6  1.493958       7.485603 0.94 
1 1 1 -35 1  3  o 218.7878 3.388019 375.0965  90.0  21.44031       6.776039 0.92 
1 1 1 -35 1  4  o 166.5237 3.997808 152.0148  347.8 29.75192       7.995617 0.56 
1 1 1 -35 1  5  o 328.0994 4.299507 493.0733  354.7 -28.03381      8.599013 0.96 
1 1 1 -35 1  6  o 372.6202 4.313190 339.7248  341.7 -4.992706      8.626380 0.95 
1 1 1 -35 1  7  o 193.3138 3.849648 205.8048  107.8 44.42039       7.699295 0.86 
1 1 1 -35 1  8  o 321.0084 4.349047 381.0419  127.6 57.07932       8.698093 0.95 
1 1 1 -35 1  9  o 144.2406 4.141057 201.1652  347.3 -7.943848      8.282113 0.74 
1 1 1 -35 1  10 o 378.1855 4.436681 518.7958  179.6 39.64084       8.873363 0.96 
1 1 1 -35 1  11 o 382.1206 4.481645 452.0182  178.9 36.08606       8.963290 0.96 
1 1 1 -35 1  12 o 295.6335 3.907886 262.1591  169.9 18.94943       7.815772 0.92 
1 1 1 -35 1  13 o 233.0535 3.687660 355.5779  110.1 41.18399       7.375320 0.93 
1 1 1 -35 1  14 o 219.7426 3.621338 402.4149  144.9 45.54832       7.242676 0.94 
1 1 1 -35 1  15 o 156.4690 3.582305 270.3037  149.2 19.93587       7.164610 0.90 
1 1 1 -35 1  16 o 262.1692 3.754370 436.3422  112.2 2.032898       7.508740 0.97 
1 1 1 -35 1  17 o 224.4597 3.464475 315.1796  161.5 66.72673       6.928950 0.95 
1 1 1 -35 1  18 o 102.7601 3.972054 237.2592  241.2 16.43266       7.944108 0.89 
1 1 1 -35 1  19 o 402.0856 4.494154 646.9363  356.2 -16.44208      8.988309 0.99 
1 1 1 -35 1  20 o 232.9622 3.506876 377.9819  96.4  23.02310       7.013752 0.98 
1 1 1 -35 1  21 o 199.8976 3.209156 312.4797  123.5 5.343460       6.418311 0.97 
1 1 1 -35 1  22 f 121.2428 3.464442 156.6248  295.8 50.59840       6.928885 0.00 
1 1 1 -35 1  23 o 33.06576 8.317884 61.16306  153.3 6.436440       16.63577 0.31 
1 1 1 -35 1  24 o 152.5694 3.287943 201.0911  105.5 23.77509       6.575886 0.97 
1 1 1 -35 1  25 o 206.7333 3.358558 241.9736  301.9 23.88310       6.717116 0.98 
1 1 1 -35 1  26 f 69.93977 5.672011 29.85441  240.8 3.942352       11.34402 0.00 
1 1 1 -35 1  27 o 95.04982 4.769597 137.6170  69.1  -7.083633      9.539194 0.94 
1 1 1 -35 1  28 o 34.45557 9.258707 90.29303  93.9  7.720613       18.51741 0.75 
1 1 1 -35 1  29 o 102.6803 4.929657 175.8553  104.8 -20.63483      9.859314 0.96 
1 1 1 -35 1  30 o 102.6130 5.064487 136.8792  23.4  11.08863       10.12897 0.94 
1 1 1 -35 1  31 o 233.3450 4.154604 313.4823  14.4  -11.62570      8.309209 0.99 
1 1 1 -35 1  32 o 108.9050 5.092559 134.8520  351.7 17.30840       10.18512 0.96 
1 1 1 -35 1  33 o 66.07773 9.728520 64.38857  46.5  5.572857       19.45704 0.88 
1 1 1 -35 1  34 o 38.70858 9.454045 35.86515  29.2  22.82050       18.90809 0.64 
1 1 1 -35 1  35 o 111.2490 5.645026 144.6879  328.7 -9.781059      11.29005 0.98 
1 1 1 -35 1  36 o 34.88617 9.498734 70.29490  248.7 14.40725       18.99747 0.83 
1 1 1 -35 3  1  o 68.76337 6.089572 109.5345  210.0 42.68070       12.17914 0.36 
1 1 1 -35 3  2  o 462.3931 4.508662 438.2433  211.8 30.73743       9.017323 0.97 
1 1 1 -35 3  3  o 217.6459 3.155170 386.0275  15.4  35.09181       6.310340 0.92 
1 1 1 -35 3  4  o 513.2037 4.567773 643.0234  129.9 -80.30566      9.135546 0.98 
1 1 1 -35 3  5  o 152.4812 3.635646 123.7585  234.3 -37.68893      7.271291 0.49 
1 1 1 -35 3  6  o 203.3352 3.265806 331.4004  190.0 -12.69797      6.531612 0.90 
1 1 1 -35 3  7  o 245.1474 4.063474 306.8171  314.9 65.60297       8.126948 0.89 
1 1 1 -35 3  8  o 474.0928 5.027433 643.4769  355.9 -18.34979      10.05487 0.98 
1 1 1 -35 3  9  o 500.8186 5.176636 635.5090  58.3  6.853607       10.35327 0.98 
1 1 1 -35 3  10 o 186.9475 3.679504 309.3472  294.7 56.30345       7.359007 0.89 
1 1 1 -35 3  11 o 235.2229 3.865492 453.9079  21.6  -9.371094      7.730985 0.95 
1 1 1 -35 3  12 o 246.5969 3.685328 387.2844  147.2 -9.815338      7.370657 0.94 
1 1 1 -35 3  13 o 211.9059 3.663314 338.6185  34.6  -20.87663      7.326627 0.94 
1 1 1 -35 3  14 o 68.59129 5.606875 350.7168  229.5 22.70662       11.21375 0.81 
1 1 1 -35 3  15 o 189.1977 3.322140 302.9223  334.0 5.628555       6.644281 0.94 
1 1 1 -35 3  16 o 100.9855 4.217432 161.0556  342.6 3.023506       8.434863 0.81 
1 1 1 -35 3  17 f 69.06126 5.011687 159.5936  120.7 -17.34864      10.02337 0.00 
1 1 1 -35 3  18 o 111.7536 3.831926 229.1867  175.7 9.151665       7.663852 0.93 
1 1 1 -35 3  19 o 198.9461 3.681401 282.6310  148.6 10.80208       7.362803 0.97 
1 1 1 -35 3  20 f 97.57890 4.002987 174.6719  201.9 36.32250       8.005975 0.00 
1 1 1 -35 3  21 f 227.2574 3.302859 365.8918  2.7   23.19405       6.605718 0.00 
1 1 1 -35 3  22 o 136.5425 3.455908 198.5829  23.0  30.67472       6.911816 0.95 
1 1 1 -35 3  23 o 49.62281 6.842804 44.89912  237.3 -44.69748      13.68561 0.45 
1 1 1 -35 3  24 o 134.9274 3.972625 148.2335  330.4 8.365219       7.945251 0.95 
1 1 1 -35 3  25 o 111.9301 3.911984 245.9360  111.4 24.33192       7.823967 0.97 
1 1 1 -35 3  26 o 115.6495 4.188988 181.6967  104.5 36.56557       8.377976 0.96 
1 1 1 -35 3  27 o 298.4959 3.692713 369.0504  159.5 4.089905       7.385426 0.99 
1 1 1 -35 3  28 o 56.84917 8.953037 89.17154  132.6 -6.441776      17.90607 0.83 
1 1 1 -35 3  29 o 100.6656 5.173194 122.4722  125.4 7.173347       10.34639 0.93 
1 1 1 -35 3  30 o 102.5182 5.386112 156.8655  255.1 -5.949669      10.77222 0.95 
1 1 1 -35 3  31 o 85.32585 7.182627 107.7232  195.1 6.223915       14.36525 0.93 
1 1 1 -35 3  32 o 117.2640 5.098704 190.5233  359.9 0.1851273      10.19741 0.98 
1 1 1 -35 3  33 o 44.28870 9.895450 43.28189  284.0 26.80111       19.79090 0.73 
1 1 1 -35 3  34 o 98.05579 5.548341 144.5564  208.3 2.461464       11.09668 0.97 
1 1 1 -35 3  35 o 27.96198 9.009731 44.47515  323.8 5.672108       18.01946 0.63 
1 1 1 -35 3  36 o 40.84274 10.26165 44.26036  359.8 ?              ?        0.77 
1 1 1 -35 5  1  f 153.3705 3.029907 114.3377  48.8  24.76802       6.059813 0.00 
1 1 1 -35 5  2  o 322.0305 3.642678 484.4295  328.7 -49.79321      7.285356 0.98 
1 1 1 -35 5  3  o 174.6560 3.408612 194.2191  61.1  36.24471       6.817224 0.88 
1 1 1 -35 5  4  o 436.5234 4.038298 504.5484  89.7  22.50763       8.076595 0.98 
1 1 1 -35 5  5  o 324.6531 3.669894 386.7986  312.5 6.261444       7.339787 0.97 
1 1 1 -35 5  6  o 173.9789 3.141655 225.3775  42.2  40.70314       6.283309 0.89 
1 1 1 -35 5  7  o 352.5778 3.873548 366.1111  38.8  20.51523       7.747096 0.97 
1 1 1 -35 5  8  o 280.3818 3.312951 378.1408  53.3  -31.40533      6.625903 0.96 
1 1 1 -35 5  9  o 112.1823 4.226509 211.6132  290.6 -17.24166      8.453017 0.81 
1 1 1 -35 5  10 o 252.2349 4.723676 366.0476  215.5 -11.98174      9.447352 0.96 
1 1 1 -35 5  11 o 181.5050 3.458847 224.7773  182.3 -23.29063      6.917693 0.91 
1 1 1 -35 5  12 o 244.9912 3.752554 390.6201  354.8 0.2660522      7.505108 0.97 
1 1 1 -35 5  13 o 174.1409 4.097900 194.3818  109.6 12.01599       8.195801 0.91 
1 1 1 -35 5  14 o 74.26851 7.687910 77.32156  173.1 49.70535       15.37582 0.59 
1 1 1 -35 5  15 o 289.0249 3.822743 477.8754  23.4  -5.753906      7.645487 0.99 
1 1 1 -35 5  16 o 74.89377 5.081134 222.5132  308.6 -4.258537      10.16227 0.88 
1 1 1 -35 5  17 o 120.6219 5.703987 166.4274  351.1 13.99135       11.40797 0.92 
1 1 1 -35 5  18 o 140.0922 3.520295 275.5682  69.6  -23.56035      7.040590 0.96 
1 1 1 -35 5  19 o 57.75429 6.974369 97.98510  172.6 17.32779       13.94874 0.65 
1 1 1 -35 5  20 f 123.0104 3.814450 243.2477  17.4  5.322624       7.628901 0.00 
1 1 1 -35 5  21 o 31.62217 8.657629 119.7820  304.2 0.7867966      17.31526 0.63 
1 1 1 -35 5  22 o 179.2647 3.645705 260.3182  239.5 0.4335480      7.291410 0.98 
1 1 1 -35 5  23 o 173.2074 3.768730 269.9753  158.3 -49.56171      7.537460 0.98 
1 1 1 -35 5  24 o 129.9769 4.123363 201.1381  108.0 -15.19316      8.246727 0.97 
1 1 1 -35 5  25 o 75.97160 7.639779 115.6491  189.9 -13.45864      15.27956 0.92 
1 1 1 -35 5  26 o 67.94203 6.869981 69.19649  175.2 38.44244       13.73996 0.86 
1 1 1 -35 5  27 o 46.29851 10.07000 65.04099  287.4 5.973774       20.14000 0.67 
1 1 1 -35 5  28 o 128.7401 4.501874 169.4313  302.2 4.818871       9.003748 0.96 
1 1 1 -35 5  29 o 160.2155 4.284523 250.2328  230.0 -2.658234      8.569045 0.98 
1 1 1 -35 5  30 o 121.5068 5.050202 170.3605  240.2 8.718140       10.10040 0.97 
1 1 1 -35 5  31 o 140.1587 5.234388 199.0805  106.3 -9.454208      10.46878 0.98 
1 1 1 -35 5  32 o 47.22863 10.40595 29.37705  36.2  21.76047       20.81191 0.63 
1 1 1 -35 5  33 o 152.7965 4.875901 183.7583  300.5 4.471130       9.751801 0.99 
1 1 1 -35 5  34 o 34.76873 10.11561 50.17319  319.3 -13.45357      20.23121 0.73 
1 1 1 -35 5  35 o 33.49725 9.847921 49.66996  214.8 ?              ?        0.75 
1 1 1 -35 7  1  o 327.2766 3.209990 446.9714  305.4 23.44168       6.419979 0.99 
1 1 1 -35 7  2  o 185.9530 2.739812 252.9508  352.6 6.211899       5.479624 0.96 
1 1 1 -35 7  3  o 360.4644 3.373890 678.8022  143.3 -26.41946      6.747780 0.99 
1 1 1 -35 7  4  o 191.3039 3.206889 272.8560  196.7 2.851974       6.413777 0.97 
1 1 1 -35 7  5  o 108.9570 3.833687 205.8016  266.0 -5.991348      7.667374 0.91 
1 1 1 -35 7  6  o 85.77667 4.436505 243.6473  207.3 -15.81353      8.873010 0.91 
1 1 1 -35 7  7  o 265.2858 4.318741 448.0882  354.7 20.51625       8.637483 0.99 
1 1 1 -35 7  8  o 189.3402 3.214970 331.0504  303.7 25.45924       6.429940 0.97 
1 1 1 -35 7  9  o 73.97619 5.649912 121.7448  94.1  -26.44560      11.29982 0.76 
1 1 1 -35 7  10 o 141.8265 3.617689 231.0520  304.3 10.81891       7.235379 0.95 
1 1 1 -35 7  11 o 119.8601 4.230024 136.5809  240.3 9.251373       8.460049 0.90 
1 1 1 -35 7  12 o 86.33862 4.950542 184.2420  5.4   25.10395       9.901084 0.89 
1 1 1 -35 7  13 o 179.0744 3.266125 241.2472  172.5 15.00999       6.532249 0.96 
1 1 1 -35 7  14 o 244.2656 3.799818 458.9963  124.9 -38.87846      7.599636 0.99 
1 1 1 -35 7  15 o 114.0764 4.204014 259.9690  107.1 -30.13432      8.408028 0.94 
1 1 1 -35 7  16 o 97.60593 4.723152 193.2481  330.4 -47.08220      9.446304 0.92 
1 1 1 -35 7  17 o 166.4509 3.757540 306.1822  287.8 11.28209       7.515080 0.98 
1 1 1 -35 7  18 o 48.05406 7.778796 109.5501  77.6  -13.84765      15.55759 0.75 
1 1 1 -35 7  19 o 184.3543 3.693640 238.8847  86.9  -7.849579      7.387280 0.98 
1 1 1 -35 7  20 f 69.96404 7.669389 135.2417  1.5   -21.40388      15.33878 0.00 
1 1 1 -35 7  21 o 24.72152 7.886850 31.90301  254.0 4.057171       15.77370 0.22 
1 1 1 -35 7  22 o 102.3058 5.787482 167.8746  67.5  11.54298       11.57496 0.96 
1 1 1 -35 7  23 o 25.38728 8.057714 29.89128  84.5  16.54240       16.11543 0.29 
1 1 1 -35 7  24 o 113.1157 5.127844 159.6423  298.6 11.25812       10.25569 0.97 
1 1 1 -35 7  25 o 37.97900 9.754568 33.79681  187.0 -1.096527      19.50914 0.37 
1 1 1 -35 7  26 o 40.06659 10.43682 78.64646  87.8  12.05501       20.87363 0.68 
1 1 1 -35 7  27 o 24.70678 8.258853 14.23936  348.5 7.155058       16.51771 0.12 
1 1 1 -35 7  28 o 53.29736 10.01045 73.27427  38.6  -1.149353      20.02090 0.81 
1 1 1 -35 7  29 o 29.45553 9.433121 30.38246  250.6 2.711794       18.86624 0.40 
1 1 1 -35 7  30 o 46.05437 11.16260 117.0300  128.3 1.775940       22.32520 0.91 
1 1 1 -35 7  31 o 45.26431 11.47708 82.50341  115.0 13.04971       22.95416 0.88 
1 1 1 -35 7  32 o 81.13765 8.112313 125.5854  149.4 9.908592       16.22463 0.96 
1 1 1 -35 7  33 o 43.86444 11.46968 89.56704  170.0 24.65866       22.93935 0.89 
1 1 1 -35 7  34 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -35 9  1  f 218.3770 3.989532 259.1708  86.8  3.137527       7.979065 0.00 
1 1 1 -35 9  2  o 137.3427 3.410958 209.1925  77.4  5.472580       6.821916 0.96 
1 1 1 -35 9  3  f 120.4451 3.589830 171.2902  246.2 -0.2009125     7.179659 0.00 
1 1 1 -35 9  4  o 31.98655 9.844875 9.671469  318.8 6.309885       19.68975 0.05 
1 1 1 -35 9  5  o 74.68153 6.694328 156.5178  93.7  27.03280       13.38866 0.89 
1 1 1 -35 9  6  o 103.3162 4.371768 124.9618  130.9 30.87611       8.743535 0.90 
1 1 1 -35 9  7  o 130.5100 3.412956 221.3904  264.7 -25.03945      6.825913 0.96 
1 1 1 -35 9  8  o 182.0512 3.392757 289.2484  15.1  29.49403       6.785515 0.98 
1 1 1 -35 9  9  o 63.38211 6.455142 83.83574  119.7 0.3520584      12.91028 0.72 
1 1 1 -35 9  10 o 117.0252 3.987897 167.2855  139.7 31.08114       7.975793 0.94 
1 1 1 -35 9  11 o 47.62077 8.509134 72.90083  186.1 -1.880196      17.01827 0.60 
1 1 1 -35 9  12 o 220.8705 3.176931 331.3287  104.4 6.461136       6.353862 0.99 
1 1 1 -35 9  13 o 162.6127 3.441122 262.5190  176.4 -16.00850      6.882245 0.98 
1 1 1 -35 9  14 o 73.27454 6.092208 124.2531  258.0 -19.12001      12.18442 0.89 
1 1 1 -35 9  15 o 116.8649 4.086233 159.5796  320.7 14.20299       8.172466 0.95 
1 1 1 -35 9  16 o 56.00676 8.343376 108.5945  150.1 15.21514       16.68675 0.84 
1 1 1 -35 9  17 o 55.02392 8.229444 91.69028  79.8  10.52766       16.45889 0.81 
1 1 1 -35 9  18 f 76.45679 6.260783 175.9273  309.3 -8.475418      12.52157 0.00 
1 1 1 -35 9  19 o 44.61616 8.961674 46.65568  16.8  -11.87888      17.92335 0.62 
1 1 1 -35 9  20 o 175.4400 3.710189 294.4630  78.4  -6.577576      7.420377 0.99 
1 1 1 -35 9  21 o 139.2335 4.631258 204.5510  135.7 -11.23741      9.262517 0.98 
1 1 1 -35 9  22 o 59.37494 8.183371 116.7787  257.1 -43.97367      16.36674 0.88 
1 1 1 -35 9  23 o 78.87610 7.944714 108.3619  332.1 -31.12710      15.88943 0.90 
1 1 1 -35 9  24 o 106.3114 5.971189 157.0557  170.6 4.197540       11.94238 0.96 
1 1 1 -35 9  25 o 44.88411 9.610824 108.6653  233.9 -12.33327      19.22165 0.85 
1 1 1 -35 9  26 o 117.7316 5.471123 226.9375  35.5  5.628151       10.94225 0.98 
1 1 1 -35 9  27 o 29.18930 9.717012 28.95755  112.3 7.864883       19.43402 0.41 
1 1 1 -35 9  28 o 56.82481 10.52513 73.71854  295.8 -15.06530      21.05025 0.90 
1 1 1 -35 9  29 o 35.35575 10.52003 27.58329  130.3 -2.643387      21.04007 0.51 
1 1 1 -35 9  30 o 65.44965 11.17239 121.1418  210.2 -23.32273      22.34478 0.95 
1 1 1 -35 9  31 o 41.83142 12.04866 22.64029  224.7 ?              ?        0.51 
1 1 1 -35 11 1  o 171.7978 4.083448 286.8563  158.1 32.57906       8.166896 0.99 
1 1 1 -35 11 2  f 90.54701 5.595614 160.7674  237.8 -4.130440      11.19123 0.00 
1 1 1 -35 11 3  o 47.45591 8.586853 73.91788  29.3  -14.85962      17.17371 0.76 
1 1 1 -35 11 4  o 64.47574 8.223022 65.75986  310.1 -35.72395      16.44604 0.81 
1 1 1 -35 11 5  o 102.1233 4.844669 201.9042  359.4 -30.70754      9.689339 0.97 
1 1 1 -35 11 6  o 155.2330 4.519509 300.7837  60.0  -14.03210      9.039019 0.99 
1 1 1 -35 11 7  o 110.3102 5.035638 203.2587  63.7  -30.43610      10.07128 0.97 
1 1 1 -35 11 8  o 140.9349 4.456350 238.4761  19.1  -9.197617      8.912700 0.98 
1 1 1 -35 11 9  o 29.19536 9.123927 100.4980  76.6  6.096369       18.24785 0.71 
1 1 1 -35 11 10 o 131.5274 5.236345 204.0786  174.0 40.78047       10.47269 0.98 
1 1 1 -35 11 11 o 140.2040 4.265933 235.6734  118.4 16.19951       8.531866 0.98 
1 1 1 -35 11 12 o 121.4897 4.281758 182.5559  206.5 -0.5807114     8.563517 0.98 
1 1 1 -35 11 13 o 123.3072 4.374056 183.7955  102.5 -39.73149      8.748113 0.98 
1 1 1 -35 11 14 o 257.4354 3.478118 460.4653  78.6  8.230453       6.956237 1.00 
1 1 1 -35 11 15 o 147.2429 3.969980 303.9481  124.6 -14.79742      7.939960 0.99 
1 1 1 -35 11 16 o 119.0155 4.509325 219.0195  166.5 -4.943054      9.018650 0.97 
1 1 1 -35 11 17 o 62.57454 8.186707 97.47269  243.8 -16.36911      16.37341 0.86 
1 1 1 -35 11 18 o 32.03607 9.759107 28.14808  32.8  10.07744       19.51821 0.28 
1 1 1 -35 11 19 o 60.19607 11.41479 79.94266  334.1 -3.753784      22.82958 0.82 
1 1 1 -35 11 20 o 30.30393 9.514101 89.07024  73.5  17.58948       19.02820 0.69 
1 1 1 -35 11 21 o 92.54253 5.992481 173.0677  185.5 8.820961       11.98496 0.96 
1 1 1 -35 11 22 o 78.25653 6.967242 136.6440  239.3 4.771866       13.93448 0.95 
1 1 1 -35 11 23 o 99.64935 6.551624 197.4384  224.7 11.68766       13.10325 0.98 
1 1 1 -35 11 24 o 72.49597 10.33821 106.0468  213.0 -15.80352      20.67642 0.94 
1 1 1 -35 11 25 o 31.48321 10.62542 25.85690  344.6 13.29930       21.25084 0.46 
1 1 1 -35 11 26 o 124.8752 8.881545 226.4941  343.3 1.068604       17.76309 0.99 
1 1 1 -35 11 27 o 47.34752 12.15027 147.6817  281.2 -3.157597      24.30054 0.94 
1 1 1 -35 11 28 o 58.92444 12.15791 143.0181  310.8 ?              ?        0.95 
1 1 1 -35 11 29 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -35 13 1  o 68.21365 8.412649 138.9996  112.0 -31.09954      16.82530 0.93 
1 1 1 -35 13 2  o 79.37045 6.946493 153.7352  326.5 14.37237       13.89299 0.94 
1 1 1 -35 13 3  o 186.0250 4.039433 324.3647  315.6 2.035507       8.078867 0.99 
1 1 1 -35 13 4  f 46.70600 10.23727 96.24006  349.1 6.026379       20.47453 0.00 
1 1 1 -35 13 5  o 43.70684 8.874113 98.42854  91.3  20.33104       17.74823 0.81 
1 1 1 -35 13 6  o 46.10023 9.331884 33.03583  276.0 -19.92967      18.66377 0.47 
1 1 1 -35 13 7  o 138.6394 5.371380 247.8807  247.2 -5.100357      10.74276 0.98 
1 1 1 -35 13 8  o 35.41053 10.56811 36.39520  100.8 16.55292       21.13622 0.41 
1 1 1 -35 13 9  f 55.54424 10.88401 124.5614  92.1  -5.320023      21.76801 0.00 
1 1 1 -35 13 10 f 73.32851 8.108551 175.7025  165.6 30.14743       16.21710 0.00 
1 1 1 -35 13 11 o 115.9874 6.907798 156.6389  241.8 52.30956       13.81560 0.96 
1 1 1 -35 13 12 o 157.6082 6.013690 251.8074  291.3 -4.718948      12.02738 0.99 
1 1 1 -35 13 13 o 30.58323 9.881872 12.29753  204.9 -9.354517      19.76374 0.15 
1 1 1 -35 13 14 f 42.62453 11.48677 79.27451  217.3 6.157665       22.97354 0.00 
1 1 1 -35 13 15 o 97.87502 8.580139 153.2259  289.5 2.538475       17.16028 0.97 
1 1 1 -35 13 16 o 36.30624 11.17572 55.47190  157.0 6.681366       22.35144 0.69 
1 1 1 -35 13 17 o 75.96155 10.83215 137.3252  90.1  -17.16331      21.66430 0.95 
1 1 1 -35 13 18 o 43.35265 8.685665 65.84220  5.4   -30.48257      17.37133 0.85 
1 1 1 -35 13 19 o 63.65241 8.760061 109.3470  225.4 6.161793       17.52012 0.95 
1 1 1 -35 13 20 o 103.6064 6.249716 218.6853  194.9 -4.746628      12.49943 0.99 
1 1 1 -35 13 21 o 78.78995 8.319314 158.9777  161.6 -4.526436      16.63863 0.97 
1 1 1 -35 13 22 o 28.78776 9.468482 57.79561  103.1 15.42515       18.93696 0.74 
1 1 1 -35 13 23 o 44.87685 9.296015 103.3306  282.9 -15.84742      18.59203 0.92 
1 1 1 -35 13 24 o 26.66091 9.155322 65.36162  240.5 ?              ?        0.79 
1 1 1 -35 15 1  o 40.32519 9.931147 68.35525  103.2 21.76356       19.86229 0.85 
1 1 1 -35 15 2  f 36.54826 10.56268 57.69732  243.6 -8.754585      21.12536 0.00 
1 1 1 -35 15 3  o 33.72318 10.08572 26.61924  103.3 5.776070       20.17144 0.51 
1 1 1 -35 15 4  o 37.25120 10.59500 61.56054  20.2  -8.292870      21.19000 0.81 
1 1 1 -35 15 5  o 61.51934 10.85034 89.93903  289.6 -13.59253      21.70068 0.93 
1 1 1 -35 15 6  o 54.34809 10.23762 72.76004  234.7 -27.79898      20.47525 0.90 
1 1 1 -35 15 7  f 48.05708 10.92700 81.02241  352.5 -19.96550      21.85400 0.00 
1 1 1 -35 15 8  f 67.12907 10.67900 147.1654  335.5 -8.720482      21.35799 0.00 
1 1 1 -35 15 9  o 36.75883 11.19042 36.17261  310.4 29.30141       22.38083 0.64 
1 1 1 -35 15 10 o 73.38995 11.24212 150.0144  330.5 -13.49480      22.48424 0.96 
1 1 1 -35 15 11 o 98.24568 10.56380 211.9559  349.7 -40.24251      21.12761 0.98 
1 1 1 -35 15 12 o 35.69843 10.91914 17.08970  308.6 -2.212994      21.83829 0.36 
1 1 1 -35 15 13 o 32.23441 10.93138 68.92836  343.3 13.44037       21.86276 0.80 
1 1 1 -35 15 14 o 48.71029 11.16137 92.43819  297.2 -23.58281      22.32274 0.91 
1 1 1 -35 15 15 o 57.03331 12.71852 129.7441  185.2 -4.920544      25.43705 0.94 
1 1 1 -35 15 16 o 65.80832 13.35776 182.9951  140.0 -9.029762      26.71552 0.96 
1 1 1 -35 15 17 o 42.12794 12.27495 66.87302  90.7  ?              ?        0.85 
1 1 1 -35 15 18 o 38.78382 11.80650 61.08847  196.4 ?              ?        0.83 
1 1 1 -34 0  1  o 278.5275 4.729244 318.0193  180.0 -0.000000      0.000000 0.99 
1 1 1 -34 0  2  o 510.5575 7.215529 654.2158  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  3  o 67.72253 8.491672 101.3709  0.0   -0.000000      0.000000 0.08 
1 1 1 -34 0  4  o 197.5509 4.643116 192.1232  0.0   -0.000000      0.000000 0.91 
1 1 1 -34 0  5  o 379.5193 6.308191 725.1638  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  6  o 446.2400 6.980002 680.2638  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  7  o 273.0139 5.282156 397.2179  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  8  o 90.02362 9.786518 112.8099  0.0   -0.000000      0.000000 0.50 
1 1 1 -34 0  9  o 198.1376 5.621265 166.1004  360.0 -0.000000      0.000000 0.95 
1 1 1 -34 0  10 o 440.8125 7.025712 683.0925  0.0   -0.000000      0.000000 1.00 
1 1 1 -34 0  11 o 447.3124 6.963231 682.1998  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  12 o 30.67056 16.82303 106.1893  180.0 -0.000000      0.000000 0.14 
1 1 1 -34 0  13 o 583.2070 8.361341 862.1323  360.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  14 o 206.8288 4.994913 531.9512  0.0   -0.000000      0.000000 1.00 
1 1 1 -34 0  15 o 159.6994 5.191669 237.4774  180.0 -0.000000      0.000000 0.92 
1 1 1 -34 0  16 o 162.2105 4.889895 222.2001  0.0   -0.000000      0.000000 0.97 
1 1 1 -34 0  17 o 22.06211 13.13724 143.8051  360.0 -0.000000      0.000000 0.24 
1 1 1 -34 0  18 o 428.8700 6.681659 717.3361  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  19 o 52.00850 10.86694 47.71796  180.0 -0.000000      0.000000 0.19 
1 1 1 -34 0  20 o 257.5006 5.116631 370.8789  360.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  21 o 79.35957 6.937763 3.484762  180.0 -0.000000      0.000000 0.00 
1 1 1 -34 0  22 o 162.0727 4.507807 215.9645  360.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  23 o 89.37080 6.744227 249.2288  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  24 o 67.31622 8.124721 112.1087  180.0 -0.000000      0.000000 0.93 
1 1 1 -34 0  25 o 31.78274 15.10068 6.854260  180.0 -0.000000      0.000000 0.05 
1 1 1 -34 0  26 o 54.41162 10.61962 67.86672  0.0   -0.000000      0.000000 0.75 
1 1 1 -34 0  27 o 52.83837 19.75764 68.00802  180.0 -0.000000      0.000000 0.76 
1 1 1 -34 0  28 o 36.80421 15.86547 99.19736  180.0 -0.000000      0.000000 0.88 
1 1 1 -34 0  29 o 137.7485 5.899225 177.6150  0.0   -0.000000      0.000000 1.00 
1 1 1 -34 0  30 o 15.21284 10.90177 106.2473  0.0   -0.000000      0.000000 0.44 
1 1 1 -34 0  31 o 187.9606 5.309279 221.1581  0.0   -0.000000      0.000000 1.00 
1 1 1 -34 0  32 o 148.8633 6.600304 122.3499  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  33 o 32.60987 16.80256 48.58061  180.0 -0.000000      0.000000 0.62 
1 1 1 -34 0  34 o 93.25941 10.02774 125.4373  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  35 o 35.35695 18.31851 40.62263  0.0   -0.000000      0.000000 0.64 
1 1 1 -34 0  36 o 83.09776 12.59092 127.4287  180.0 -0.000000      0.000000 1.00 
1 1 1 -34 0  37 o 31.88364 16.93618 107.0546  180.0 ?              ?        0.98 
1 1 1 -34 2  1  f 577.9304 5.311692 414.2387  233.6 4.980652       10.62338 0.00 
1 1 1 -34 2  2  o 76.78985 5.523689 128.0582  357.0 -16.93350      11.04738 0.14 
1 1 1 -34 2  3  o 306.9123 3.608061 502.8236  328.3 38.49744       7.216122 0.96 
1 1 1 -34 2  4  o 241.5119 3.399720 279.6830  161.5 -9.745453      6.799441 0.90 
1 1 1 -34 2  5  o 419.2003 4.645506 524.8865  338.3 46.65176       9.291013 0.97 
1 1 1 -34 2  6  o 423.5978 5.035900 438.3174  29.2  23.98578       10.07180 0.96 
1 1 1 -34 2  7  f 414.6677 5.745978 572.2049  214.9 23.91818       11.49196 0.00 
1 1 1 -34 2  8  o 175.2272 5.058774 442.6742  222.1 23.05179       10.11755 0.90 
1 1 1 -34 2  9  o 454.0709 5.949801 582.1748  88.3  49.03879       11.89960 0.98 
1 1 1 -34 2  10 o 364.9989 5.317847 464.1898  170.9 9.283325       10.63569 0.96 
1 1 1 -34 2  11 o 380.3237 5.318679 512.8414  89.6  -21.67554      10.63736 0.97 
1 1 1 -34 2  12 f 623.8090 7.889842 830.7570  119.1 -48.31079      15.77968 0.00 
1 1 1 -34 2  13 o 175.8971 3.709960 334.2293  30.3  -2.484192      7.419919 0.88 
1 1 1 -34 2  14 o 261.5251 3.679819 300.0401  129.4 9.141205       7.359638 0.94 
1 1 1 -34 2  15 o 92.48218 4.689811 80.28645  75.8  12.71072       9.379622 0.37 
1 1 1 -34 2  16 o 225.6809 3.354651 390.4092  134.7 -22.81483      6.709301 0.96 
1 1 1 -34 2  17 o 136.4248 3.376954 227.6852  228.3 39.56438       6.753909 0.89 
1 1 1 -34 2  18 o 75.41248 4.879013 117.4566  243.8 -0.5249023E-02 9.758025 0.52 
1 1 1 -34 2  19 o 76.85391 4.788339 121.8926  190.7 3.542068       9.576678 0.77 
1 1 1 -34 2  20 o 147.0905 3.459432 149.1832  223.6 14.57608       6.918865 0.92 
1 1 1 -34 2  21 o 234.9565 3.348083 338.1198  72.8  1.083298       6.696167 0.98 
1 1 1 -34 2  22 o 113.1547 3.925938 115.6568  21.9  26.59698       7.851877 0.87 
1 1 1 -34 2  23 o 47.61740 7.957617 8.820387  119.3 21.15726       15.91523 0.12 
1 1 1 -34 2  24 o 153.2360 3.360854 237.1133  121.0 16.48428       6.721708 0.97 
1 1 1 -34 2  25 o 157.5557 3.954968 211.2893  96.3  27.43266       7.909935 0.97 
1 1 1 -34 2  26 o 43.93021 8.719872 123.9628  145.6 0.8760834E-01  17.43974 0.81 
1 1 1 -34 2  27 o 33.57300 8.999718 79.51851  293.2 -8.129358      17.99944 0.66 
1 1 1 -34 2  28 o 79.55676 5.257571 115.6190  279.3 4.091576       10.51514 0.93 
1 1 1 -34 2  29 o 47.58762 8.262431 85.50307  238.1 -26.17825      16.52486 0.76 
1 1 1 -34 2  30 o 118.2751 5.084925 179.8821  263.3 -3.177414      10.16985 0.96 
1 1 1 -34 2  31 o 97.95538 5.698115 118.5263  327.5 -33.14230      11.39623 0.94 
1 1 1 -34 2  32 o 145.6846 7.825501 190.6239  331.6 4.423676       15.65100 0.98 
1 1 1 -34 2  33 o 79.69658 7.933444 59.10235  125.1 25.73443       15.86689 0.90 
1 1 1 -34 2  34 o 66.94009 8.151853 92.01490  191.4 11.44533       16.30371 0.93 
1 1 1 -34 2  35 o 38.81964 10.62329 42.50276  338.8 3.112484       21.24658 0.69 
1 1 1 -34 2  36 o 67.25845 9.109727 101.7927  54.2  ?              ?        0.95 
1 1 1 -34 4  1  o 284.0384 3.285728 359.6506  195.3 12.93762       6.571456 0.95 
1 1 1 -34 4  2  o 229.7673 3.204162 234.0277  163.0 41.27440       6.408325 0.89 
1 1 1 -34 4  3  o 263.5549 3.379699 163.5542  222.6 17.13208       6.759397 0.87 
1 1 1 -34 4  4  o 213.5886 3.057730 323.8079  108.4 -46.49342      6.115460 0.89 
1 1 1 -34 4  5  o 299.6116 3.567261 483.7908  357.6 -19.98273      7.134522 0.96 
1 1 1 -34 4  6  o 401.7210 4.009195 556.4246  53.7  10.53751       8.018390 0.97 
1 1 1 -34 4  7  o 416.3390 4.305707 441.9955  190.2 -20.65854      8.611414 0.97 
1 1 1 -34 4  8  o 527.8019 5.461621 676.2430  183.8 36.99252       10.92324 0.98 
1 1 1 -34 4  9  o 194.6230 3.590711 264.3937  247.7 26.39644       7.181421 0.88 
1 1 1 -34 4  10 o 301.6293 4.122631 318.7784  319.6 -32.26889      8.245262 0.94 
1 1 1 -34 4  11 o 67.64005 6.886285 219.6948  308.4 28.35369       13.77257 0.65 
1 1 1 -34 4  12 o 304.3160 4.063777 392.8734  300.1 1.052002       8.127554 0.96 
1 1 1 -34 4  13 o 563.5948 5.711891 822.7244  71.6  -23.00732      11.42378 0.99 
1 1 1 -34 4  14 o 148.5010 3.332525 94.45242  319.4 3.790604       6.665051 0.77 
1 1 1 -34 4  15 o 352.7636 4.216481 535.2159  14.8  1.029938       8.432962 0.98 
1 1 1 -34 4  16 o 186.6274 3.733483 176.8453  278.7 21.07680       7.466966 0.91 
1 1 1 -34 4  17 o 166.6315 4.683037 199.9770  335.1 33.44704       9.366075 0.94 
1 1 1 -34 4  18 o 200.9923 3.261428 196.1873  41.3  7.444168       6.522855 0.96 
1 1 1 -34 4  19 o 43.14212 8.322312 97.82019  358.6 11.95341       16.64462 0.52 
1 1 1 -34 4  20 o 219.9169 3.793150 330.1231  226.5 1.605011       7.586301 0.98 
1 1 1 -34 4  21 o 182.0988 3.290379 163.2593  83.2  29.76585       6.580759 0.95 
1 1 1 -34 4  22 o 105.0237 4.162019 228.1603  244.4 -5.553314      8.324038 0.95 
1 1 1 -34 4  23 o 301.6592 4.060437 413.9375  284.0 35.67798       8.120873 0.99 
1 1 1 -34 4  24 o 164.4957 3.552050 227.5788  316.1 16.32404       7.104100 0.97 
1 1 1 -34 4  25 f 138.9046 3.884285 137.5029  227.7 -2.536148      7.768569 0.00 
1 1 1 -34 4  26 o 76.76299 7.055719 118.8558  268.6 -34.79006      14.11144 0.92 
1 1 1 -34 4  27 o 111.2212 4.625886 149.7937  271.2 -5.790421      9.251772 0.96 
1 1 1 -34 4  28 o 155.2464 3.772621 194.9047  344.7 13.07800       7.545242 0.97 
1 1 1 -34 4  29 o 93.53242 5.241934 109.8193  15.6  9.698189       10.48387 0.92 
1 1 1 -34 4  30 o 103.2389 5.491930 143.8304  65.2  -0.2260818     10.98386 0.95 
1 1 1 -34 4  31 o 202.7540 4.182582 273.9863  149.1 -5.439880      8.365165 0.99 
1 1 1 -34 4  32 o 94.10098 6.836521 103.0581  190.7 -10.52753      13.67304 0.95 
1 1 1 -34 4  33 o 41.89091 9.990427 45.62461  224.1 -2.876003      19.98085 0.74 
1 1 1 -34 4  34 o 33.09584 9.433531 34.18459  129.2 5.465235       18.86706 0.57 
1 1 1 -34 4  35 o 29.60022 9.328201 54.25489  199.2 -4.741423      18.65640 0.72 
1 1 1 -34 4  36 o 49.76660 11.10822 87.35396  217.6 ?              ?        0.91 
1 1 1 -34 6  1  f 467.9796 3.925190 562.8434  245.5 -59.26721      7.850380 0.00 
1 1 1 -34 6  2  o 352.5942 3.364822 568.0470  326.6 7.418854       6.729644 0.99 
1 1 1 -34 6  3  o 226.5882 3.081341 219.5600  29.2  14.46439       6.162682 0.93 
1 1 1 -34 6  4  o 43.17144 8.087081 31.80692  66.7  -20.40257      16.17416 0.09 
1 1 1 -34 6  5  o 197.4164 3.054202 351.9262  316.3 -13.43834      6.108405 0.95 
1 1 1 -34 6  6  o 199.4071 3.282067 159.8967  165.5 9.097137       6.564133 0.88 
1 1 1 -34 6  7  o 357.3959 3.831498 566.7177  313.0 2.467743       7.662996 0.98 
1 1 1 -34 6  8  o 186.2295 3.391711 290.4380  328.9 -15.53311      6.783422 0.94 
1 1 1 -34 6  9  o 119.9253 3.550606 152.2008  53.0  -17.04258      7.101213 0.82 
1 1 1 -34 6  10 o 163.4638 3.651646 198.9107  290.2 -32.67804      7.303292 0.91 
1 1 1 -34 6  11 o 80.02084 5.914201 111.6531  60.0  26.95035       11.82840 0.64 
1 1 1 -34 6  12 o 103.4460 4.566375 46.45102  193.7 -7.208885      9.132750 0.43 
1 1 1 -34 6  13 o 208.5692 3.393409 419.5347  210.9 14.10201       6.786817 0.98 
1 1 1 -34 6  14 o 150.5953 4.105558 156.5256  25.8  -55.40323      8.211117 0.92 
1 1 1 -34 6  15 o 155.1203 3.423840 332.5941  108.8 -15.55251      6.847680 0.97 
1 1 1 -34 6  16 o 224.6364 3.248389 330.1855  131.3 24.81114       6.496778 0.98 
1 1 1 -34 6  17 o 112.2144 4.202719 207.2383  48.6  -8.179840      8.405438 0.93 
1 1 1 -34 6  18 o 36.45234 8.028152 91.48542  103.1 -9.307791      16.05630 0.46 
1 1 1 -34 6  19 o 119.3939 4.085802 147.1802  231.9 12.84330       8.171603 0.92 
1 1 1 -34 6  20 o 28.98234 8.356754 99.47346  20.3  0.9287586      16.71351 0.52 
1 1 1 -34 6  21 o 89.17258 5.975173 169.4659  222.6 29.67668       11.95035 0.93 
1 1 1 -34 6  22 o 48.25552 7.866777 33.55640  170.0 18.10976       15.73355 0.39 
1 1 1 -34 6  23 o 62.02359 8.649240 91.96349  127.8 -16.96200      17.29848 0.82 
1 1 1 -34 6  24 o 233.4634 3.704233 375.2435  127.5 9.729324       7.408467 0.99 
1 1 1 -34 6  25 o 70.86199 8.468596 127.8378  138.5 -22.40317      16.93719 0.93 
1 1 1 -34 6  26 o 121.6740 4.968949 161.2276  157.2 -31.33782      9.937899 0.96 
1 1 1 -34 6  27 f 95.02882 5.681565 88.18561  184.1 17.08640       11.36313 0.00 
1 1 1 -34 6  28 o 26.87261 8.567847 110.2382  166.2 -2.315695      17.13569 0.69 
1 1 1 -34 6  29 o 36.71326 9.928160 82.31332  175.3 -4.733212      19.85632 0.73 
1 1 1 -34 6  30 o 38.40617 10.54040 86.52747  83.7  3.272942       21.08081 0.81 
1 1 1 -34 6  31 o 55.87057 9.176718 71.32745  45.7  -35.03967      18.35344 0.88 
1 1 1 -34 6  32 o 37.13991 10.66258 47.28837  229.4 7.398945       21.32516 0.71 
1 1 1 -34 6  33 o 119.9874 5.729462 161.4656  243.1 11.41796       11.45892 0.98 
1 1 1 -34 6  34 o 55.69682 10.86836 96.74278  210.8 20.93002       21.73673 0.93 
1 1 1 -34 8  1  o 109.2033 4.809358 114.5537  37.5  11.67519       9.618716 0.87 
1 1 1 -34 8  2  o 157.5019 3.177075 267.8065  50.7  -14.54483      6.354149 0.96 
1 1 1 -34 8  3  o 108.7749 3.501195 149.6774  169.3 -35.74292      7.002390 0.89 
1 1 1 -34 8  4  f 187.3616 3.667382 335.7958  354.3 -3.668518      7.334763 0.00 
1 1 1 -34 8  5  o 161.6700 2.933510 265.3384  59.6  -17.71773      5.867020 0.96 
1 1 1 -34 8  6  o 77.04411 4.696744 83.95622  218.4 -4.034218      9.393488 0.67 
1 1 1 -34 8  7  o 113.8014 3.827974 216.7440  278.2 -13.74520      7.655948 0.94 
1 1 1 -34 8  8  o 171.9088 3.786846 295.9827  290.0 11.65460       7.573692 0.97 
1 1 1 -34 8  9  o 62.05156 7.347432 166.4117  209.6 22.05585       14.69486 0.83 
1 1 1 -34 8  10 o 182.7474 3.383404 372.0281  236.3 9.011292       6.766808 0.98 
1 1 1 -34 8  11 o 174.9668 3.336472 331.6762  225.4 -2.307785      6.672943 0.97 
1 1 1 -34 8  12 o 252.0847 3.529235 431.8240  104.8 12.62775       7.058470 0.99 
1 1 1 -34 8  13 o 84.97651 4.664475 221.5231  161.3 -19.55833      9.328951 0.92 
1 1 1 -34 8  14 o 129.2628 3.815515 203.4364  247.9 -13.29325      7.631030 0.95 
1 1 1 -34 8  15 o 31.76011 8.759116 29.91213  252.5 6.656982       17.51823 0.16 
1 1 1 -34 8  16 o 134.8559 4.038762 170.0568  245.9 4.509567       8.077524 0.95 
1 1 1 -34 8  17 o 133.2316 3.804762 296.8799  302.3 9.310989       7.609524 0.98 
1 1 1 -34 8  18 o 130.5674 3.610984 244.5491  39.8  9.746857       7.221968 0.97 
1 1 1 -34 8  19 o 97.91974 5.279384 189.3180  118.2 -26.28883      10.55877 0.95 
1 1 1 -34 8  20 o 75.78319 6.039683 77.46291  236.5 5.396812       12.07937 0.85 
1 1 1 -34 8  21 o 187.1663 3.897161 233.6324  227.3 -9.004257      7.794321 0.98 
1 1 1 -34 8  22 o 140.2923 3.812054 273.7711  246.6 -33.39265      7.624109 0.99 
1 1 1 -34 8  23 o 224.8498 3.691894 343.2638  353.0 24.29910       7.383789 0.99 
1 1 1 -34 8  24 o 144.1617 4.079465 217.0151  72.1  -5.664444      8.158931 0.98 
1 1 1 -34 8  25 o 118.4902 6.093514 194.2201  141.0 -39.97816      12.18703 0.97 
1 1 1 -34 8  26 o 101.9242 6.975382 138.4810  297.6 -24.42982      13.95076 0.95 
1 1 1 -34 8  27 o 43.59961 10.90338 98.01414  224.8 2.254665       21.80676 0.83 
1 1 1 -34 8  28 o 78.05679 8.939855 118.7235  3.0   -29.40451      17.87971 0.94 
1 1 1 -34 8  29 o 89.19141 9.398987 181.7184  31.4  -22.65814      18.79797 0.97 
1 1 1 -34 8  30 o 68.10856 10.46859 130.8098  86.6  12.81776       20.93718 0.95 
1 1 1 -34 8  31 o 30.11134 10.06482 38.20855  157.5 10.23347       20.12964 0.58 
1 1 1 -34 8  32 o 38.41679 10.52830 78.66969  48.2  -10.97774      21.05661 0.86 
1 1 1 -34 8  33 o 59.17094 10.78327 91.10064  66.2  ?              ?        0.93 
1 1 1 -34 10 1  o 167.0168 3.559387 285.2316  166.7 35.04387       7.118774 0.98 
1 1 1 -34 10 2  o 80.83670 6.010185 147.4815  114.4 -18.84690      12.02037 0.92 
1 1 1 -34 10 3  o 88.87573 5.908761 128.5452  82.8  4.912773       11.81752 0.91 
1 1 1 -34 10 4  o 234.4453 3.291990 353.1128  220.6 1.477859       6.583980 0.99 
1 1 1 -34 10 5  o 151.7485 3.725273 303.1917  226.3 16.81444       7.450547 0.98 
1 1 1 -34 10 6  o 129.2037 4.419905 204.7927  78.0  12.75717       8.839810 0.96 
1 1 1 -34 10 7  o 71.35892 7.603258 142.3416  100.4 ?              ?        0.90 
1 1 1 -34 10 8  o 34.10231 8.152664 24.39528  211.8 14.40924       16.30533 0.21 
1 1 1 -34 10 9  o 140.8863 3.440984 244.6665  151.0 -28.99020      6.881968 0.97 
1 1 1 -34 10 10 o 176.8186 3.873413 308.4112  118.9 33.63918       7.746825 0.98 
1 1 1 -34 10 11 o 80.92838 5.373876 132.5709  336.0 -20.28666      10.74775 0.91 
1 1 1 -34 10 12 o 39.63184 9.160075 67.65781  155.4 -3.588814      18.32015 0.59 
1 1 1 -34 10 13 o 156.3990 3.720170 217.7496  234.6 8.012512       7.440340 0.98 
1 1 1 -34 10 14 o 63.77527 7.406608 112.9059  134.3 49.11135       14.81322 0.88 
1 1 1 -34 10 15 o 85.17152 5.130377 140.1104  116.5 4.397430       10.26075 0.94 
1 1 1 -34 10 16 o 45.28766 9.940465 106.3319  4.9   0.4985237      19.88093 0.83 
1 1 1 -34 10 17 o 121.0278 7.377929 203.8717  331.1 -49.29563      14.75586 0.98 
1 1 1 -34 10 18 o 37.90853 10.11970 77.90287  295.5 0.9298439      20.23940 0.75 
1 1 1 -34 10 19 o 168.6999 3.812923 240.1020  132.8 -7.718262      7.625847 0.98 
1 1 1 -34 10 20 o 216.3538 3.866272 332.3273  57.1  18.84543       7.732544 0.99 
1 1 1 -34 10 21 o 71.34927 6.263043 81.73317  130.6 3.770103       12.52609 0.86 
1 1 1 -34 10 22 o 79.34963 9.969889 105.5387  147.4 12.15094       19.93978 0.91 
1 1 1 -34 10 23 o 103.2302 8.098852 135.6697  44.5  -3.121216      16.19770 0.95 
1 1 1 -34 10 24 f 107.1711 7.510597 182.1210  283.1 -25.16303      15.02119 0.00 
1 1 1 -34 10 25 o 108.6431 5.922274 163.5577  223.2 -10.42984      11.84455 0.97 
1 1 1 -34 10 26 o 78.18405 9.875359 125.4093  44.6  -16.13702      19.75072 0.96 
1 1 1 -34 10 27 o 36.21107 10.76549 49.23109  2.2   10.95822       21.53099 0.73 
1 1 1 -34 10 28 o 34.76288 11.04539 34.45497  243.9 23.14789       22.09079 0.58 
1 1 1 -34 10 29 o 31.34431 10.82965 47.94458  331.5 16.39528       21.65930 0.69 
1 1 1 -34 10 30 o 58.54134 13.65225 86.64062  112.9 ?              ?        0.91 
1 1 1 -34 12 1  o 117.7916 4.541921 135.7220  71.4  13.85833       9.083842 0.96 
1 1 1 -34 12 2  o 207.0731 3.802168 308.5408  79.9  42.99254       7.604336 0.99 
1 1 1 -34 12 3  o 103.5918 5.077819 188.0322  96.4  44.00393       10.15564 0.97 
1 1 1 -34 12 4  o 41.97193 9.168146 71.86227  37.2  9.590828       18.33629 0.75 
1 1 1 -34 12 5  o 183.4624 3.711987 289.7282  324.8 -10.90359      7.423974 0.99 
1 1 1 -34 12 6  o 138.4434 4.212027 199.3963  301.6 -29.00241      8.424054 0.98 
1 1 1 -34 12 7  o 106.0357 5.123022 149.5258  308.9 2.381500       10.24604 0.96 
1 1 1 -34 12 8  o 65.50822 9.335563 174.9751  31.0  38.45676       18.67113 0.94 
1 1 1 -34 12 9  f 36.40293 9.611367 27.68587  121.6 -20.40549      19.22273 0.00 
1 1 1 -34 12 10 o 114.3076 5.060605 120.7184  97.6  8.868179       10.12121 0.95 
1 1 1 -34 12 11 o 60.79701 11.24129 61.75232  68.6  -11.29217      22.48259 0.77 
1 1 1 -34 12 12 f 111.5799 6.099052 282.9855  262.7 0.2836685      12.19810 0.00 
1 1 1 -34 12 13 o 40.22862 10.27252 31.38966  24.7  -11.13682      20.54504 0.36 
1 1 1 -34 12 14 o 140.9607 4.931282 187.6725  72.9  -5.434662      9.862563 0.97 
1 1 1 -34 12 15 o 128.2108 4.515620 184.8144  42.0  4.617943       9.031240 0.97 
1 1 1 -34 12 16 o 73.33240 10.68717 170.0303  23.5  -18.29134      21.37433 0.94 
1 1 1 -34 12 17 o 54.36894 9.353027 151.4461  19.7  -27.44131      18.70605 0.91 
1 1 1 -34 12 18 o 40.07183 9.595554 59.20064  102.2 -7.294373      19.19111 0.68 
1 1 1 -34 12 19 o 51.91045 8.890372 56.08062  167.0 -4.779121      17.78074 0.78 
1 1 1 -34 12 20 o 118.2011 5.350477 205.8631  207.3 9.296585       10.70095 0.98 
1 1 1 -34 12 21 o 38.45471 10.15111 45.49455  212.3 25.68163       20.30222 0.68 
1 1 1 -34 12 22 o 53.13689 9.535444 107.3652  17.0  -18.54566      19.07089 0.93 
1 1 1 -34 12 23 o 68.39095 9.391159 100.7214  238.6 13.06950       18.78232 0.94 
1 1 1 -34 12 24 o 88.70486 9.198816 165.7236  215.8 -32.08291      18.39763 0.97 
1 1 1 -34 12 25 o 31.63974 10.27316 16.47063  143.9 18.46695       20.54633 0.33 
1 1 1 -34 12 26 o 34.89835 9.680783 63.39792  18.2  -9.008520      19.36157 0.83 
1 1 1 -34 12 27 o 62.34449 11.01317 126.3863  267.2 ?              ?        0.96 
1 1 1 -34 14 1  f 118.2650 5.158062 163.6705  187.1 6.724411       10.31612 0.00 
1 1 1 -34 14 2  o 96.82359 5.367535 136.8844  151.8 -7.135681      10.73507 0.97 
1 1 1 -34 14 3  o 147.2339 4.710361 233.4719  69.6  -14.12511      9.420721 0.99 
1 1 1 -34 14 4  o 135.2978 4.944074 192.7514  343.7 15.96069       9.888148 0.98 
1 1 1 -34 14 5  o 114.2144 5.687835 190.1529  325.3 8.466942       11.37567 0.98 
1 1 1 -34 14 6  o 59.11081 9.742395 134.5635  32.1  -27.98307      19.48479 0.93 
1 1 1 -34 14 7  o 133.2156 5.264453 199.2268  134.6 -0.5536346     10.52891 0.98 
1 1 1 -34 14 8  o 48.90159 11.23007 25.58577  274.2 2.754742       22.46014 0.50 
1 1 1 -34 14 9  o 34.28260 10.38190 62.39388  256.7 -6.493752      20.76381 0.71 
1 1 1 -34 14 10 o 101.4713 9.644921 205.3250  240.9 -20.70243      19.28984 0.98 
1 1 1 -34 14 11 o 52.88551 12.31908 70.00606  23.7  17.50147       24.63817 0.84 
1 1 1 -34 14 12 o 28.75287 9.493384 68.74361  87.4  0.8686962      18.98677 0.73 
1 1 1 -34 14 13 o 65.87730 11.46991 74.58892  197.8 -21.90184      22.93982 0.90 
1 1 1 -34 14 14 o 99.25174 11.53343 163.9566  261.1 -48.57812      23.06686 0.97 
1 1 1 -34 14 15 o 57.48737 12.24934 45.32683  121.8 38.92242       24.49868 0.81 
1 1 1 -34 14 16 o 71.51170 12.27507 110.6512  128.7 14.60502       24.55013 0.95 
1 1 1 -34 14 17 o 44.21230 12.22610 87.62741  175.3 2.640724       24.45220 0.88 
1 1 1 -34 14 18 o 60.99698 13.24368 128.3141  236.2 13.59907       26.48737 0.94 
1 1 1 -34 14 19 o 64.01707 11.11138 109.7336  273.7 -27.14050      22.22277 0.94 
1 1 1 -34 14 20 o 39.53653 11.78356 95.42464  314.3 8.085960       23.56711 0.89 
1 1 1 -34 14 21 o 20.89724 9.605510 87.65582  108.6 ?              ?        0.80 
1 1 1 -34 14 22 o 26.78167 9.692541 28.29455  95.2  ?              ?        0.52 
1 1 1 -34 16 1  o 39.00592 10.70854 66.19677  76.7  ?              ?        0.85 
1 1 1 -34 16 2  o 37.13757 10.67016 70.23192  204.8 ?              ?        0.85 
1 1 1 -34 16 3  o 41.28437 10.68983 44.36437  219.5 26.19346       21.37967 0.78 
1 1 1 -34 16 4  f 35.11952 10.73788 56.42820  38.1  -8.539787      21.47576 0.00 
1 1 1 -34 16 5  o 81.74576 9.597367 123.2914  97.6  13.72520       19.19473 0.97 
1 1 1 -34 16 6  o 92.43806 8.262613 179.6257  154.1 2.686508       16.52523 0.98 
1 1 1 -34 16 7  f 49.82200 11.85438 109.4100  181.7 -0.4440689E-01 23.70876 0.00 
1 1 1 -34 16 8  o 34.74529 11.30454 34.11037  230.2 13.44108       22.60908 0.62 
1 1 1 -34 16 9  o 33.45824 10.82639 20.88687  246.7 -0.5940247     21.65279 0.45 
1 1 1 -34 16 10 o 24.79302 8.745979 32.31284  109.5 ?              ?        0.55 
1 1 1 -34 16 11 o 36.87684 11.49173 44.03595  243.4 ?              ?        0.74 
1 1 1 -34 16 12 o 65.59848 14.22564 123.7826  252.4 ?              ?        0.95 
1 1 1 -34 16 13 f 33.34016 11.48057 79.21272  196.6 ?              ?        0.00 
1 1 1 -33 1  1  o 346.5432 3.844688 499.9761  296.1 62.78088       7.689376 0.97 
1 1 1 -33 1  2  o 389.1443 4.029173 577.4826  162.5 -82.18051      8.058346 0.97 
1 1 1 -33 1  3  o 699.1887 6.171443 903.1871  216.4 -34.29169      12.34289 0.99 
1 1 1 -33 1  4  o 228.4486 4.624560 401.6802  204.8 -61.63966      9.249121 0.90 
1 1 1 -33 1  5  o 596.1381 7.163014 862.0560  277.8 -5.388977      14.32603 0.98 
1 1 1 -33 1  6  o 230.2011 4.418493 229.9276  356.8 60.47366       8.836987 0.90 
1 1 1 -33 1  7  o 631.8051 7.660019 950.6333  163.3 -65.40045      15.32004 0.99 
1 1 1 -33 1  8  o 186.1378 3.928070 529.6041  317.9 59.34650       7.856140 0.92 
1 1 1 -33 1  9  o 189.4693 3.929526 153.5079  301.2 22.56046       7.859052 0.66 
1 1 1 -33 1  10 o 392.8887 4.786941 445.8680  283.7 2.316864       9.573882 0.96 
1 1 1 -33 1  11 o 374.7777 4.422877 560.5722  304.2 46.64258       8.845755 0.97 
1 1 1 -33 1  12 o 106.9532 6.601815 80.82162  40.7  1.869415       13.20363 0.20 
1 1 1 -33 1  13 o 653.8406 8.190701 905.7402  291.7 -7.894104      16.38140 0.99 
1 1 1 -33 1  14 o 254.2234 3.862128 264.1901  342.4 51.22275       7.724256 0.89 
1 1 1 -33 1  15 o 143.8727 3.389534 240.8156  227.9 -22.17693      6.779068 0.81 
1 1 1 -33 1  16 o 153.6460 3.357064 305.5057  289.3 -12.31941      6.714128 0.88 
1 1 1 -33 1  17 o 156.3357 3.179162 245.5755  165.2 -10.57356      6.358325 0.88 
1 1 1 -33 1  18 o 173.2599 3.255897 244.1139  186.6 -83.87572      6.511794 0.92 
1 1 1 -33 1  19 o 165.0537 2.984653 268.1416  186.4 -7.085220      5.969307 0.94 
1 1 1 -33 1  20 o 63.37964 6.603330 150.5938  338.0 -46.54688      13.20666 0.77 
1 1 1 -33 1  21 o 175.8771 3.168780 320.7932  309.6 -6.485291      6.337561 0.97 
1 1 1 -33 1  22 o 93.74832 3.938683 157.4349  358.6 29.84150       7.877367 0.88 
1 1 1 -33 1  23 o 79.40263 4.848417 152.2836  255.6 16.66637       9.696834 0.86 
1 1 1 -33 1  24 o 119.9357 3.290655 235.3849  83.7  -4.270447      6.581311 0.96 
1 1 1 -33 1  25 f 71.47576 5.068550 80.22299  102.3 11.49890       10.13710 0.00 
1 1 1 -33 1  26 o 143.8080 3.685100 246.0279  226.3 -12.68602      7.370200 0.97 
1 1 1 -33 1  27 o 128.3273 3.836704 167.9880  233.5 -2.615425      7.673407 0.96 
1 1 1 -33 1  28 o 78.52664 6.466870 118.3852  288.3 -18.72462      12.93374 0.93 
1 1 1 -33 1  29 o 122.9113 4.446477 145.4379  315.7 -1.145798      8.892954 0.96 
1 1 1 -33 1  30 o 250.2718 3.834435 313.9378  175.0 38.72124       7.668869 0.99 
1 1 1 -33 1  31 o 54.78269 9.043133 37.94713  230.7 -5.878250      18.08627 0.55 
1 1 1 -33 1  32 o 57.98304 8.265278 45.96159  212.9 27.04330       16.53056 0.72 
1 1 1 -33 1  33 o 110.9390 5.726556 130.3587  161.8 2.004349       11.45311 0.97 
1 1 1 -33 1  34 o 133.2987 5.080880 171.6560  138.7 -19.07409      10.16176 0.98 
1 1 1 -33 1  35 o 112.2602 5.546600 159.8237  98.5  6.730309       11.09320 0.98 
1 1 1 -33 1  36 o 59.27591 9.173334 76.11430  84.9  42.08339       18.34667 0.91 
1 1 1 -33 1  37 o 31.09314 9.830342 75.10024  53.6  ?              ?        0.84 
1 1 1 -33 3  1  o 499.1981 4.689307 610.2864  195.7 7.401581       9.378614 0.98 
1 1 1 -33 3  2  o 641.2562 5.569931 908.2993  83.7  24.54980       11.13986 0.99 
1 1 1 -33 3  3  o 245.3704 3.325290 246.4862  185.4 3.206635       6.650580 0.89 
1 1 1 -33 3  4  o 438.0354 4.851037 626.4355  322.6 -25.62286      9.702074 0.97 
1 1 1 -33 3  5  f 622.0238 5.452766 589.8370  306.2 -55.13055      10.90553 0.00 
1 1 1 -33 3  6  o 276.4785 3.695292 391.9029  176.4 15.10410       7.390583 0.94 
1 1 1 -33 3  7  o 550.6649 5.472210 773.8435  251.9 -21.48975      10.94442 0.98 
1 1 1 -33 3  8  o 242.3121 3.884665 450.5388  79.9  -8.119568      7.769330 0.93 
1 1 1 -33 3  9  o 222.1623 3.692067 427.0030  196.7 27.36208       7.384134 0.92 
1 1 1 -33 3  10 o 458.0184 5.001364 627.9968  235.7 -35.78589      10.00273 0.98 
1 1 1 -33 3  11 o 491.9815 5.159446 553.5422  170.1 5.712158       10.31889 0.98 
1 1 1 -33 3  12 o 304.1533 4.095479 366.6653  338.5 -8.385712      8.190958 0.95 
1 1 1 -33 3  13 o 341.0050 4.142602 377.8917  23.7  -13.83850      8.285204 0.96 
1 1 1 -33 3  14 o 265.2847 3.841601 275.3288  309.6 9.048676       7.683201 0.93 
1 1 1 -33 3  15 o 142.7905 3.393025 382.5626  92.7  13.56725       6.786050 0.92 
1 1 1 -33 3  16 f 213.5770 3.358622 258.6801  237.1 29.07561       6.717245 0.00 
1 1 1 -33 3  17 o 499.1039 6.258502 804.4987  318.4 4.577118       12.51700 0.99 
1 1 1 -33 3  18 o 174.1845 3.053534 441.5515  330.0 10.76201       6.107067 0.97 
1 1 1 -33 3  19 o 51.82137 6.698384 107.9026  96.7  -2.145435      13.39677 0.58 
1 1 1 -33 3  20 o 236.6890 3.232433 367.2485  211.4 36.76347       6.464865 0.98 
1 1 1 -33 3  21 o 170.3978 3.059859 231.9809  266.6 -23.71762      6.119717 0.96 
1 1 1 -33 3  22 o 152.9827 3.326722 272.6955  319.0 -21.76591      6.653444 0.96 
1 1 1 -33 3  23 o 125.1527 4.146544 225.8384  274.3 27.23444       8.293088 0.96 
1 1 1 -33 3  24 f 99.25963 4.027131 119.0640  244.3 27.91354       8.054262 0.00 
1 1 1 -33 3  25 o 114.4961 3.973086 216.6297  33.1  21.76183       7.946172 0.96 
1 1 1 -33 3  26 o 144.6548 3.658164 170.9237  314.6 -27.54630      7.316328 0.97 
1 1 1 -33 3  27 o 166.9248 3.556798 176.1789  282.7 15.51196       7.113595 0.98 
1 1 1 -33 3  28 o 48.28307 8.153575 59.69991  234.6 -30.27221      16.30715 0.72 
1 1 1 -33 3  29 o 66.78856 7.536170 72.58782  11.6  -12.68570      15.07234 0.80 
1 1 1 -33 3  30 o 185.7330 4.011595 215.2219  355.5 14.43436       8.023190 0.98 
1 1 1 -33 3  31 o 35.43552 9.719771 47.10521  280.3 14.72538       19.43954 0.50 
1 1 1 -33 3  32 o 73.73039 6.922517 91.34392  209.1 -1.909378      13.84503 0.92 
1 1 1 -33 3  33 o 40.72085 9.332098 56.51814  154.5 -30.83314      18.66420 0.77 
1 1 1 -33 3  34 o 84.75053 6.790771 110.2162  155.5 -20.58881      13.58154 0.96 
1 1 1 -33 3  35 o 110.7087 6.268521 158.8474  213.6 -26.96311      12.53704 0.98 
1 1 1 -33 3  36 o 27.17640 8.960009 60.84173  211.8 ?              ?        0.75 
1 1 1 -33 5  1  o 226.4337 2.777541 330.3120  290.7 4.357040       5.555082 0.94 
1 1 1 -33 5  2  o 336.6646 3.457478 558.8864  255.3 6.882599       6.914956 0.97 
1 1 1 -33 5  3  o 129.0548 3.417989 115.4622  108.8 28.42222       6.835977 0.64 
1 1 1 -33 5  4  o 392.6877 3.973844 693.2062  108.3 -7.764893      7.947689 0.98 
1 1 1 -33 5  5  o 95.66457 4.640033 149.9242  97.1  -24.27270      9.280066 0.55 
1 1 1 -33 5  6  o 158.3527 2.998166 43.90916  228.7 5.722351       5.996332 0.45 
1 1 1 -33 5  7  o 178.9065 3.115879 323.1212  341.1 -15.60638      6.231759 0.90 
1 1 1 -33 5  8  o 57.20769 6.437445 108.9294  212.7 15.57012       12.87489 0.35 
1 1 1 -33 5  9  o 221.8653 3.019306 375.1617  109.8 5.089844       6.038612 0.93 
1 1 1 -33 5  10 o 165.4084 3.525544 175.3557  2.0   -45.65001      7.051089 0.80 
1 1 1 -33 5  11 o 212.2778 3.408331 338.2204  186.6 3.054321       6.816662 0.94 
1 1 1 -33 5  12 o 99.71778 4.621964 163.8304  82.3  -40.69379      9.243927 0.71 
1 1 1 -33 5  13 o 246.8338 4.201672 347.3076  144.5 2.652740       8.403344 0.96 
1 1 1 -33 5  14 o 83.65503 4.879469 189.5449  128.3 11.19051       9.758938 0.78 
1 1 1 -33 5  15 o 201.3999 3.089337 324.1872  41.0  -22.47701      6.178673 0.96 
1 1 1 -33 5  16 o 83.47701 4.331710 69.34961  231.8 18.96122       8.663421 0.52 
1 1 1 -33 5  17 o 134.6558 4.456792 154.8435  271.0 -29.86059      8.913584 0.92 
1 1 1 -33 5  18 o 52.02763 6.999681 137.1660  202.6 9.320065       13.99936 0.73 
1 1 1 -33 5  19 o 207.3300 3.199873 345.1904  242.1 16.12646       6.399747 0.98 
1 1 1 -33 5  20 o 142.2033 3.448967 294.5070  255.4 15.06575       6.897935 0.96 
1 1 1 -33 5  21 o 191.5342 3.285102 285.8622  67.8  -20.93599      6.570205 0.98 
1 1 1 -33 5  22 o 51.34894 7.842757 82.93369  238.8 38.73154       15.68551 0.69 
1 1 1 -33 5  23 o 308.0962 3.443873 426.5045  258.4 -14.02374      6.887746 0.99 
1 1 1 -33 5  24 o 141.4641 3.690747 223.1049  162.1 3.778122       7.381494 0.97 
1 1 1 -33 5  25 o 187.0410 3.900624 171.8152  135.8 5.783859       7.801247 0.98 
1 1 1 -33 5  26 o 142.2771 4.146298 182.9169  68.3  -21.96693      8.292597 0.98 
1 1 1 -33 5  27 o 126.0215 4.305088 174.0554  8.2   5.847359       8.610175 0.97 
1 1 1 -33 5  28 o 47.63994 8.002238 138.3696  242.8 -34.57194      16.00448 0.86 
1 1 1 -33 5  29 o 107.3523 5.365350 122.9498  232.8 1.966019       10.73070 0.94 
1 1 1 -33 5  30 o 43.61653 10.15031 68.03220  192.9 7.102524       20.30062 0.72 
1 1 1 -33 5  31 o 96.72089 6.062127 140.3948  349.6 -0.8015442E-01 12.12425 0.96 
1 1 1 -33 5  32 o 35.48363 10.19921 48.79155  170.5 4.355995       20.39843 0.68 
1 1 1 -33 5  33 o 65.25285 8.070470 86.39403  193.5 16.87118       16.14094 0.93 
1 1 1 -33 5  34 o 104.0725 6.499960 152.9695  259.3 1.784378       12.99992 0.98 
1 1 1 -33 5  35 o 32.40760 9.788778 3.301656  197.7 ?              ?        0.07 
1 1 1 -33 7  1  o 174.9467 2.838027 350.0058  10.7  49.97588       5.676055 0.97 
1 1 1 -33 7  2  o 79.14134 4.716361 96.05167  161.2 38.43150       9.432722 0.63 
1 1 1 -33 7  3  o 251.2109 2.876632 385.5536  247.3 -21.18713      5.753264 0.97 
1 1 1 -33 7  4  o 59.26604 6.415715 68.32941  272.7 -10.45041      12.83143 0.35 
1 1 1 -33 7  5  o 125.0542 3.450493 86.54556  274.4 -24.82609      6.900986 0.73 
1 1 1 -33 7  6  o 45.97486 7.668589 90.00833  20.2  -9.923203      15.33718 0.33 
1 1 1 -33 7  7  o 141.6908 4.080368 267.7012  306.3 -22.11813      8.160735 0.93 
1 1 1 -33 7  8  o 110.0224 3.719654 221.0951  179.8 -25.19469      7.439308 0.90 
1 1 1 -33 7  9  o 37.07333 8.561473 55.79161  167.0 -1.941166      17.12295 0.26 
1 1 1 -33 7  10 o 274.2432 3.314564 385.0360  96.7  -6.648315      6.629128 0.98 
1 1 1 -33 7  11 o 101.9548 4.544722 197.2097  46.3  25.00103       9.089444 0.90 
1 1 1 -33 7  12 o 415.8727 4.166702 593.5153  270.9 -37.77740      8.333405 0.99 
1 1 1 -33 7  13 o 278.4403 3.650446 494.2525  249.9 -40.27115      7.300891 0.99 
1 1 1 -33 7  14 o 164.0340 3.660912 288.9657  39.2  28.75330       7.321825 0.97 
1 1 1 -33 7  15 o 190.4850 3.494675 249.3879  22.6  23.00276       6.989350 0.97 
1 1 1 -33 7  16 f 101.3915 4.296288 158.3723  190.9 -14.27116      8.592576 0.00 
1 1 1 -33 7  17 o 134.9312 3.532586 199.1971  71.0  6.534454       7.065172 0.95 
1 1 1 -33 7  18 o 158.1411 3.410046 302.8732  96.9  25.22107       6.820093 0.97 
1 1 1 -33 7  19 o 278.5673 3.628156 401.7899  137.1 -39.62683      7.256311 0.99 
1 1 1 -33 7  20 o 84.58656 5.624379 141.1811  143.6 1.068588       11.24876 0.92 
1 1 1 -33 7  21 o 211.8745 3.442768 372.6014  288.5 30.99706       6.885536 0.99 
1 1 1 -33 7  22 o 194.6629 3.448946 294.4332  252.9 -2.437637      6.897893 0.99 
1 1 1 -33 7  23 f 144.9054 4.282698 225.8109  303.0 -7.838089      8.565395 0.00 
1 1 1 -33 7  24 o 64.04963 9.339650 89.62006  129.0 41.00086       18.67930 0.89 
1 1 1 -33 7  25 f 107.6886 4.824750 172.9913  169.9 -4.167000      9.649501 0.00 
1 1 1 -33 7  26 o 108.1256 5.879438 237.7873  245.2 -2.982208      11.75888 0.97 
1 1 1 -33 7  27 f 107.9431 5.911420 134.9359  110.7 4.077896       11.82284 0.00 
1 1 1 -33 7  28 o 36.01862 10.17538 82.12149  132.9 -0.1227379     20.35076 0.72 
1 1 1 -33 7  29 o 121.7201 5.012362 139.1725  3.5   2.999603       10.02472 0.97 
1 1 1 -33 7  30 o 102.6626 6.692547 151.1460  17.5  11.91686       13.38509 0.97 
1 1 1 -33 7  31 o 61.58840 10.87986 47.55539  339.9 6.087936       21.75971 0.84 
1 1 1 -33 7  32 o 65.28458 10.51370 111.1012  336.9 43.83231       21.02739 0.94 
1 1 1 -33 7  33 o 73.74796 9.768257 67.22730  39.2  -14.79732      19.53651 0.92 
1 1 1 -33 7  34 o 42.94076 9.882629 82.09554  92.7  ?              ?        0.90 
1 1 1 -33 9  1  o 146.4010 4.360073 225.3457  323.5 -13.46783      8.720146 0.96 
1 1 1 -33 9  2  o 23.66550 7.501046 38.08942  85.1  -0.6101532     15.00209 0.14 
1 1 1 -33 9  3  o 117.2766 3.913463 148.9275  187.6 9.378517       7.826925 0.91 
1 1 1 -33 9  4  o 177.7914 4.150736 198.1796  241.7 39.42784       8.301472 0.96 
1 1 1 -33 9  5  o 147.3925 5.501552 183.2374  67.5  -70.04638      11.00310 0.94 
1 1 1 -33 9  6  o 152.7182 3.274060 330.0164  217.0 25.03368       6.548119 0.97 
1 1 1 -33 9  7  f 176.8780 3.138561 277.2087  205.8 41.10835       6.277122 0.00 
1 1 1 -33 9  8  o 113.8070 4.435598 190.3312  265.1 30.47662       8.871197 0.92 
1 1 1 -33 9  9  o 143.4022 3.351530 149.0148  314.2 18.96974       6.703060 0.93 
1 1 1 -33 9  10 o 115.9901 3.899359 230.1981  269.1 34.46147       7.798718 0.95 
1 1 1 -33 9  11 f 150.0524 3.533338 244.3317  238.8 46.13042       7.066677 0.00 
1 1 1 -33 9  12 o 144.4764 3.738362 329.1351  137.4 18.73230       7.476724 0.97 
1 1 1 -33 9  13 o 61.93288 5.980669 127.9840  67.3  -10.44934      11.96134 0.84 
1 1 1 -33 9  14 o 39.74221 8.817163 176.7570  4.3   -14.83900      17.63433 0.84 
1 1 1 -33 9  15 o 101.9798 5.604896 158.0258  296.8 11.82864       11.20979 0.94 
1 1 1 -33 9  16 o 172.1974 3.729499 330.3818  263.9 13.25453       7.458999 0.98 
1 1 1 -33 9  17 o 54.99513 8.332975 94.08479  22.4  -12.29616      16.66595 0.80 
1 1 1 -33 9  18 o 48.11794 9.024619 72.88052  59.8  22.14457       18.04924 0.71 
1 1 1 -33 9  19 o 120.6308 4.394686 190.0697  236.3 -9.684837      8.789372 0.97 
1 1 1 -33 9  20 o 171.8953 3.842191 305.2574  266.3 1.227753       7.684382 0.99 
1 1 1 -33 9  21 o 45.89644 11.20644 48.53954  134.9 26.94875       22.41289 0.64 
1 1 1 -33 9  22 o 121.6129 5.958776 95.18476  165.3 14.71468       11.91755 0.94 
1 1 1 -33 9  23 o 43.00093 10.47623 49.62162  32.6  24.70597       20.95246 0.53 
1 1 1 -33 9  24 o 43.52613 9.246385 63.14421  212.8 -11.68842      18.49277 0.66 
1 1 1 -33 9  25 o 75.59138 8.904178 133.6714  72.3  -18.61408      17.80836 0.93 
1 1 1 -33 9  26 o 33.80100 10.13351 76.64996  310.1 6.625086       20.26701 0.72 
1 1 1 -33 9  27 o 45.66195 10.45233 70.41942  315.1 -10.79501      20.90466 0.82 
1 1 1 -33 9  28 o 73.50424 9.568501 96.73504  57.2  -2.901894      19.13700 0.94 
1 1 1 -33 9  29 o 48.81480 10.44174 33.33832  303.3 -25.62175      20.88348 0.70 
1 1 1 -33 9  30 o 89.36250 9.150984 132.5025  9.8   1.438766       18.30197 0.97 
1 1 1 -33 9  31 o 32.73578 10.94954 80.13447  260.5 7.129084       21.89908 0.84 
1 1 1 -33 9  32 o 56.46404 10.14185 66.57762  108.9 ?              ?        0.91 
1 1 1 -33 11 1  o 113.6603 4.099927 140.5838  99.0  -4.638069      8.199855 0.95 
1 1 1 -33 11 2  o 368.2336 4.075912 575.4663  110.6 12.83456       8.151823 1.00 
1 1 1 -33 11 3  o 94.96494 5.076743 189.9175  162.3 -18.27573      10.15349 0.95 
1 1 1 -33 11 4  o 275.1509 3.385860 389.7953  274.0 0.2885437      6.771721 0.99 
1 1 1 -33 11 5  o 198.1874 3.484951 374.5369  265.5 -7.386749      6.969902 0.99 
1 1 1 -33 11 6  o 86.50592 5.661537 208.2285  191.1 12.08080       11.32307 0.95 
1 1 1 -33 11 7  o 131.6385 4.438399 196.7745  255.5 4.338058       8.876799 0.97 
1 1 1 -33 11 8  o 203.3657 3.769581 298.7507  334.1 25.69215       7.539163 0.99 
1 1 1 -33 11 9  o 99.59749 5.752554 226.5997  57.2  25.90731       11.50511 0.96 
1 1 1 -33 11 10 o 163.4413 4.432709 269.2698  63.6  17.16319       8.865417 0.98 
1 1 1 -33 11 11 o 138.4687 3.766835 262.5875  333.4 15.10429       7.533670 0.98 
1 1 1 -33 11 12 o 56.41607 8.587541 76.26585  182.1 24.93086       17.17508 0.82 
1 1 1 -33 11 13 o 236.7982 3.673776 345.4258  280.8 -14.90996      7.347551 0.99 
1 1 1 -33 11 14 o 224.9298 4.000031 402.1466  314.5 -13.84790      8.000063 0.99 
1 1 1 -33 11 15 o 215.9567 3.865389 339.1390  23.6  10.06065       7.730778 0.99 
1 1 1 -33 11 16 o 61.39926 7.725435 115.7277  76.8  19.76079       15.45087 0.91 
1 1 1 -33 11 17 o 48.47837 9.487147 76.40052  189.9 4.067726       18.97429 0.77 
1 1 1 -33 11 18 f 31.24830 9.121633 68.17225  130.6 14.25410       18.24327 0.00 
1 1 1 -33 11 19 o 41.10693 9.277050 39.14851  147.5 6.638031       18.55410 0.46 
1 1 1 -33 11 20 o 75.11833 6.916798 99.39211  61.1  24.24568       13.83360 0.90 
1 1 1 -33 11 21 o 30.57074 9.400626 37.84632  53.3  6.906317       18.80125 0.40 
1 1 1 -33 11 22 o 50.26942 9.929452 56.32991  115.8 19.81907       19.85890 0.75 
1 1 1 -33 11 23 o 41.65644 8.896470 103.5205  42.1  -14.99533      17.79294 0.88 
1 1 1 -33 11 24 o 105.3906 5.977267 164.5388  231.5 0.2895584      11.95453 0.98 
1 1 1 -33 11 25 o 59.66420 10.23927 118.4940  259.2 -25.50518      20.47853 0.94 
1 1 1 -33 11 26 o 70.50687 10.47827 105.5446  58.5  -24.43371      20.95654 0.95 
1 1 1 -33 11 27 o 34.36930 10.60915 47.40830  259.7 26.97048       21.21830 0.71 
1 1 1 -33 11 28 o 87.89076 10.29621 155.9020  257.8 -22.11292      20.59241 0.97 
1 1 1 -33 11 29 o 41.19958 12.09286 80.41425  257.9 ?              ?        0.88 
1 1 1 -33 13 1  o 51.45682 9.380184 78.17297  33.3  17.76400       18.76037 0.79 
1 1 1 -33 13 2  o 38.73813 8.561382 82.43109  140.4 25.91569       17.12276 0.72 
1 1 1 -33 13 3  o 146.2051 4.429787 223.9738  264.0 8.934906       8.859573 0.98 
1 1 1 -33 13 4  o 57.46474 8.554534 120.7083  348.8 38.98871       17.10907 0.88 
1 1 1 -33 13 5  o 165.5441 4.154336 321.5377  74.2  21.68477       8.308673 0.99 
1 1 1 -33 13 6  f 84.18263 6.676945 38.00173  103.1 -6.017632      13.35389 0.00 
1 1 1 -33 13 7  f 40.18359 10.62416 101.2582  281.9 5.266861       21.24833 0.00 
1 1 1 -33 13 8  o 130.4608 4.851165 273.4843  280.5 -4.764633      9.702330 0.98 
1 1 1 -33 13 9  o 36.87403 10.55012 38.73756  90.4  25.36878       21.10024 0.42 
1 1 1 -33 13 10 o 202.8170 5.333247 367.0113  98.0  -9.887619      10.66649 0.99 
1 1 1 -33 13 11 o 151.8954 5.310000 205.1924  19.1  5.193024       10.62000 0.98 
1 1 1 -33 13 12 o 45.25874 12.01443 55.77797  245.5 24.66156       24.02887 0.64 
1 1 1 -33 13 13 o 144.7155 6.708047 211.3806  132.1 -4.896683      13.41609 0.98 
1 1 1 -33 13 14 o 54.23576 11.06540 83.98120  221.5 9.399704       22.13079 0.84 
1 1 1 -33 13 15 o 115.6449 7.800034 186.7321  306.3 -26.03958      15.60007 0.97 
1 1 1 -33 13 16 o 96.24129 10.79401 191.4459  307.6 -55.37468      21.58801 0.97 
1 1 1 -33 13 17 o 36.74763 12.88632 43.29817  222.9 ?              ?        0.58 
1 1 1 -33 13 18 o 40.27804 11.73900 84.37103  173.6 7.267380       23.47800 0.84 
1 1 1 -33 13 19 f 75.25090 8.306392 137.7204  24.2  -3.994835      16.61278 0.00 
1 1 1 -33 13 20 o 150.8761 4.568168 269.9593  348.2 2.631470       9.136336 0.99 
1 1 1 -33 13 21 o 52.08887 9.411589 118.6776  19.6  -1.522728      18.82318 0.94 
1 1 1 -33 13 22 o 56.55036 8.303970 123.9586  172.1 -41.31052      16.60794 0.95 
1 1 1 -33 13 23 o 39.70453 8.437057 89.60049  181.6 -21.69936      16.87411 0.90 
1 1 1 -33 13 24 o 23.91793 8.271616 48.92432  219.8 9.991083       16.54323 0.68 
1 1 1 -33 13 25 o 32.79845 8.760375 69.94075  233.0 ?              ?        0.86 
1 1 1 -33 15 1  o 85.69800 6.755518 179.1908  32.9  24.79171       13.51104 0.98 
1 1 1 -33 15 2  o 85.77159 7.251521 151.9937  129.8 15.76223       14.50304 0.97 
1 1 1 -33 15 3  o 85.40231 8.168340 143.1490  171.8 -10.54446      16.33668 0.97 
1 1 1 -33 15 4  o 78.91533 7.930571 154.6644  328.1 -9.427299      15.86114 0.97 
1 1 1 -33 15 5  o 70.83572 9.515253 92.83586  0.7   -0.3203049     19.03051 0.94 
1 1 1 -33 15 6  o 93.44398 6.923754 152.0418  206.8 -2.091049      13.84751 0.98 
1 1 1 -33 15 7  o 117.0608 5.949862 180.3925  209.0 -1.954277      11.89972 0.99 
1 1 1 -33 15 8  o 49.02829 12.34564 82.19058  8.2   -4.714752      24.69129 0.89 
1 1 1 -33 15 9  o 75.41578 9.851020 157.5830  161.7 -36.91652      19.70204 0.97 
1 1 1 -33 15 10 o 101.2705 9.966656 198.0450  166.9 -3.402527      19.93331 0.98 
1 1 1 -33 15 11 o 40.40668 11.66052 30.27692  118.5 0.1873512      23.32104 0.60 
1 1 1 -33 15 12 o 82.40897 11.44995 119.5376  299.8 14.24908       22.89991 0.96 
1 1 1 -33 15 13 o 32.47478 10.61698 47.10980  140.3 3.719196       21.23396 0.70 
1 1 1 -33 15 14 o 32.07320 10.59950 73.56805  101.8 7.157640       21.19900 0.82 
1 1 1 -33 15 15 o 66.83221 12.36403 77.85706  116.7 -17.25926      24.72807 0.92 
1 1 1 -33 15 16 o 36.54512 11.96848 52.26846  286.7 15.51504       23.93696 0.75 
1 1 1 -33 15 17 o 44.08579 13.28042 105.2941  295.4 14.60913       26.56084 0.90 
1 1 1 -33 15 18 o 59.45148 13.01561 111.0259  256.8 ?              ?        0.94 
1 1 1 -33 15 19 o 44.36469 12.96271 54.19369  96.5  ?              ?        0.82 
1 1 1 -32 0  1  o 803.9106 10.60340 1103.406  0.0   -0.000000      0.000000 1.00 
1 1 1 -32 0  2  o 82.40775 10.64579 19.45902  180.0 -0.000000      0.000000 0.16 
1 1 1 -32 0  3  o 12.31043 8.915391 39.76799  180.0 -0.000000      0.000000 0.01 
1 1 1 -32 0  4  o 271.6143 5.243808 183.2576  0.0   -0.000000      0.000000 0.98 
1 1 1 -32 0  5  o 325.9213 5.762238 415.6435  180.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  6  f 734.0320 10.00087 1224.408  360.0 -0.000000      0.000000 0.00 
1 1 1 -32 0  7  o 1573.965 18.49005 1967.209  180.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  8  o 36.42910 17.19847 239.6442  180.0 -0.000000      0.000000 0.25 
1 1 1 -32 0  9  f 449.7226 7.143743 795.9167  0.0   -0.000000      0.000000 0.00 
1 1 1 -32 0  10 o 194.1245 5.415861 127.0129  360.0 -0.000000      0.000000 0.87 
1 1 1 -32 0  11 o 97.71490 5.497920 184.1879  180.0 -0.000000      0.000000 0.21 
1 1 1 -32 0  12 f 91.68324 13.26098 164.3716  180.0 -0.000000      0.000000 0.00 
1 1 1 -32 0  13 o 109.5801 6.293317 183.8680  180.0 -0.000000      0.000000 0.58 
1 1 1 -32 0  14 o 457.6354 6.650127 439.9775  360.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  15 o 153.8317 4.983945 201.6639  0.0   -0.000000      0.000000 0.78 
1 1 1 -32 0  16 o 230.6786 5.017781 321.9023  360.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  17 o 120.2164 4.377895 371.7797  0.0   -0.000000      0.000000 0.98 
1 1 1 -32 0  18 o 410.3469 6.202334 508.4512  0.0   -0.000000      0.000000 1.00 
1 1 1 -32 0  19 o 48.23422 11.02381 24.38318  0.0   -0.000000      0.000000 0.11 
1 1 1 -32 0  20 o 338.5540 5.546684 532.2464  180.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  21 o 111.5658 4.641344 212.8358  0.0   -0.000000      0.000000 1.00 
1 1 1 -32 0  22 o 169.9261 4.666301 256.7181  360.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  23 o 124.8755 4.428208 91.19816  0.0   -0.000000      0.000000 0.97 
1 1 1 -32 0  24 o 56.78685 11.48357 63.11293  0.0   -0.000000      0.000000 0.61 
1 1 1 -32 0  25 f 37.65940 13.66599 69.13492  180.0 -0.000000      0.000000 0.00 
1 1 1 -32 0  26 o 115.8176 5.478797 84.54816  0.0   -0.000000      0.000000 0.99 
1 1 1 -32 0  27 o 377.1780 9.990500 542.4987  0.0   -0.000000      0.000000 1.00 
1 1 1 -32 0  28 o 19.56919 12.43332 114.1699  0.0   -0.000000      0.000000 0.67 
1 1 1 -32 0  29 o 85.17433 8.947607 72.67020  180.0 -0.000000      0.000000 0.98 
1 1 1 -32 0  30 o 291.4927 7.639972 348.1047  180.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  31 o 82.98816 8.071340 86.76530  180.0 -0.000000      0.000000 0.98 
1 1 1 -32 0  32 o 17.06696 12.08243 23.85850  360.0 -0.000000      0.000000 0.15 
1 1 1 -32 0  33 o 297.2538 6.590046 394.3351  180.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  34 o 96.42278 8.616653 118.4239  180.0 -0.000000      0.000000 1.00 
1 1 1 -32 0  35 o 18.12120 12.58596 22.70327  180.0 -0.000000      0.000000 0.25 
1 1 1 -32 0  36 o 43.51568 19.10818 36.53433  0.0   -0.000000      0.000000 0.70 
1 1 1 -32 0  37 o 18.91798 12.95567 32.91326  360.0 ?              ?        0.44 
1 1 1 -32 2  1  o 602.2972 6.920879 808.9995  124.0 -3.081970      13.84176 0.98 
1 1 1 -32 2  2  f 439.2614 5.807312 407.9371  341.2 -7.296173      11.61462 0.00 
1 1 1 -32 2  3  o 871.5964 9.202472 1305.351  255.8 20.41925       18.40494 0.99 
1 1 1 -32 2  4  o 480.3908 4.441110 571.9453  101.3 -1.082062      8.882220 0.97 
1 1 1 -32 2  5  o 141.8806 3.783268 355.2288  122.1 12.60254       7.566536 0.85 
1 1 1 -32 2  6  o 195.3159 4.298629 255.0758  298.1 -5.279358      8.597258 0.86 
1 1 1 -32 2  7  o 735.8839 8.318225 1096.264  285.7 32.75220       16.63645 0.99 
1 1 1 -32 2  8  f 663.0178 7.708463 864.8993  307.0 7.884766       15.41693 0.00 
1 1 1 -32 2  9  o 949.1942 8.421275 1281.044  272.6 44.77295       16.84255 0.99 
1 1 1 -32 2  10 o 788.8900 7.144877 1027.382  304.8 6.697449       14.28975 0.99 
1 1 1 -32 2  11 o 377.7201 4.600807 453.6463  21.9  2.995300       9.201613 0.96 
1 1 1 -32 2  12 o 601.2042 5.955509 678.2574  253.5 -33.36322      11.91102 0.99 
1 1 1 -32 2  13 o 336.4078 3.915395 380.1105  221.9 -21.68466      7.830789 0.95 
1 1 1 -32 2  14 o 79.81369 5.847430 159.7989  328.2 80.64970       11.69486 0.46 
1 1 1 -32 2  15 o 628.3667 6.123305 837.0262  59.2  34.38666       12.24661 0.99 
1 1 1 -32 2  16 o 266.1799 4.361176 552.9913  325.1 42.12907       8.722352 0.97 
1 1 1 -32 2  17 f 90.18810 3.913190 183.2329  270.0 -12.06459      7.826381 0.00 
1 1 1 -32 2  18 f 223.9528 3.176558 443.5854  343.3 39.50342       6.353117 0.00 
1 1 1 -32 2  19 o 234.6885 3.407604 240.6184  6.4   36.67732       6.815208 0.95 
1 1 1 -32 2  20 o 107.5292 3.400061 244.7405  345.5 22.71122       6.800122 0.93 
1 1 1 -32 2  21 o 318.8031 3.638096 429.9485  282.2 -41.86328      7.276193 0.99 
1 1 1 -32 2  22 o 85.77325 4.549081 189.0217  119.2 38.84309       9.098162 0.89 
1 1 1 -32 2  23 o 118.6242 3.797083 240.4112  135.1 -28.07356      7.594166 0.95 
1 1 1 -32 2  24 o 134.1298 3.138908 197.0621  25.5  20.81625       6.277816 0.95 
1 1 1 -32 2  25 o 56.62169 7.538729 170.4767  74.1  12.37696       15.07746 0.89 
1 1 1 -32 2  26 o 53.65213 7.726517 111.9840  322.6 16.83078       15.45303 0.82 
1 1 1 -32 2  27 f 48.51097 8.890633 142.3566  16.5  -1.704239      17.78127 0.00 
1 1 1 -32 2  28 o 34.05527 8.704638 87.20294  2.2   17.04531       17.40928 0.75 
1 1 1 -32 2  29 o 61.29784 8.248495 36.16019  228.5 -36.27806      16.49699 0.58 
1 1 1 -32 2  30 o 202.3478 3.702967 216.1905  172.1 -23.86514      7.405934 0.98 
1 1 1 -32 2  31 o 63.37780 9.067639 81.88093  126.8 9.764122       18.13528 0.83 
1 1 1 -32 2  32 o 111.1504 7.960141 175.0665  138.2 -10.76071      15.92028 0.97 
1 1 1 -32 2  33 o 71.63378 6.894860 93.95139  320.6 8.227310       13.78972 0.93 
1 1 1 -32 2  34 o 102.2596 5.863513 102.2672  97.5  12.09809       11.72703 0.96 
1 1 1 -32 2  35 o 70.23190 8.169653 110.8691  138.2 10.38882       16.33931 0.95 
1 1 1 -32 2  36 o 42.68914 9.396855 49.61657  70.4  -23.96756      18.79371 0.80 
1 1 1 -32 2  37 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -32 4  1  o 437.1253 3.804995 538.3321  287.1 16.07034       7.609991 0.97 
1 1 1 -32 4  2  o 206.8452 2.968568 266.5332  127.2 6.776199       5.937136 0.83 
1 1 1 -32 4  3  o 71.98767 6.028798 265.4478  171.5 23.35573       12.05760 0.56 
1 1 1 -32 4  4  o 626.8705 5.269108 705.8932  350.1 1.754395       10.53822 0.99 
1 1 1 -32 4  5  o 406.3210 3.904488 527.9635  304.9 -20.79462      7.808977 0.97 
1 1 1 -32 4  6  o 192.8181 3.083815 59.95560  205.2 -0.3242493E-01 6.167630 0.64 
1 1 1 -32 4  7  o 613.1156 5.429487 709.7159  45.6  0.2033691      10.85897 0.99 
1 1 1 -32 4  8  o 108.3785 4.806661 317.4252  124.9 -55.28178      9.613322 0.75 
1 1 1 -32 4  9  o 573.4775 5.713847 719.7039  148.2 6.164856       11.42769 0.98 
1 1 1 -32 4  10 f 426.6329 4.638317 576.1420  123.1 21.27356       9.276633 0.00 
1 1 1 -32 4  11 o 627.8148 6.175729 972.0210  137.9 27.16364       12.35146 0.99 
1 1 1 -32 4  12 o 291.3058 3.717171 378.0987  354.4 2.889374       7.434342 0.95 
1 1 1 -32 4  13 o 295.7661 3.713016 605.4695  234.2 -10.98801      7.426032 0.97 
1 1 1 -32 4  14 o 159.9886 2.987371 278.3136  35.2  -10.15028      5.974742 0.89 
1 1 1 -32 4  15 f 110.5924 3.575153 152.7769  359.6 -31.01320      7.150307 0.00 
1 1 1 -32 4  16 o 94.91936 4.552457 81.93163  328.9 19.87350       9.104915 0.51 
1 1 1 -32 4  17 o 176.5822 3.180053 275.0186  186.8 41.42105       6.360106 0.94 
1 1 1 -32 4  18 o 155.8423 3.069742 265.9869  202.5 69.40096       6.139484 0.95 
1 1 1 -32 4  19 o 165.3881 3.022217 346.9752  142.4 14.13348       6.044435 0.97 
1 1 1 -32 4  20 o 199.2193 3.685572 336.8231  48.0  -7.902924      7.371145 0.98 
1 1 1 -32 4  21 o 118.3300 4.395890 239.5045  27.2  -62.86040      8.791780 0.94 
1 1 1 -32 4  22 o 261.4578 3.348570 430.1992  98.3  34.41653       6.697140 0.99 
1 1 1 -32 4  23 o 48.22511 7.409663 91.52509  246.3 30.29406       14.81933 0.68 
1 1 1 -32 4  24 o 184.4148 3.436250 258.8384  195.8 2.336334       6.872499 0.98 
1 1 1 -32 4  25 o 75.35078 6.268367 189.7881  128.9 51.60250       12.53673 0.93 
1 1 1 -32 4  26 o 95.15504 4.683497 149.6582  158.3 32.01964       9.366994 0.94 
1 1 1 -32 4  27 o 102.4121 5.020599 134.2850  191.3 18.34418       10.04120 0.96 
1 1 1 -32 4  28 o 109.3088 4.642474 155.4868  213.0 19.72385       9.284947 0.96 
1 1 1 -32 4  29 o 28.17978 8.683077 40.69501  52.4  -5.710625      17.36615 0.32 
1 1 1 -32 4  30 o 90.58321 5.460192 96.55689  76.4  20.32088       10.92038 0.91 
1 1 1 -32 4  31 o 187.6216 4.047014 264.4786  340.5 -6.598694      8.094028 0.99 
1 1 1 -32 4  32 o 31.29819 9.453863 71.73933  224.8 -1.523008      18.90773 0.72 
1 1 1 -32 4  33 o 47.77527 9.599419 80.92764  140.1 18.42572       19.19884 0.88 
1 1 1 -32 4  34 o 38.74059 10.29717 27.21959  186.5 12.53011       20.59435 0.53 
1 1 1 -32 4  35 f 45.85717 9.862114 75.67469  118.0 8.602436       19.72423 0.00 
1 1 1 -32 4  36 o 34.21755 9.906261 55.72966  122.8 ?              ?        0.79 
1 1 1 -32 6  1  o 190.5292 2.788616 272.3514  42.3  -8.716141      5.577233 0.92 
1 1 1 -32 6  2  o 361.6078 3.217277 426.8967  197.6 -18.14877      6.434554 0.97 
1 1 1 -32 6  3  o 164.6236 2.685257 179.2238  246.0 43.42500       5.370515 0.82 
1 1 1 -32 6  4  o 304.1227 3.350364 476.5240  83.8  18.45529       6.700728 0.97 
1 1 1 -32 6  5  o 227.4547 3.114858 255.0844  80.4  -25.57762      6.229717 0.92 
1 1 1 -32 6  6  o 148.8886 3.296509 72.01340  300.3 -3.050369      6.593017 0.65 
1 1 1 -32 6  7  o 44.41988 7.914901 82.73976  202.3 -3.738972      15.82980 0.19 
1 1 1 -32 6  8  o 68.37587 6.274530 103.0523  285.8 -69.05621      12.54906 0.42 
1 1 1 -32 6  9  o 141.2532 3.326779 327.7950  268.5 -19.13188      6.653558 0.91 
1 1 1 -32 6  10 o 71.34708 5.983589 109.6581  121.3 -4.142334      11.96718 0.46 
1 1 1 -32 6  11 o 201.9709 3.420982 230.2561  310.1 6.546463       6.841964 0.92 
1 1 1 -32 6  12 o 140.6017 3.739031 188.7008  36.2  43.49021       7.478063 0.87 
1 1 1 -32 6  13 o 47.37249 7.314608 55.97384  179.2 -29.15680      14.62922 0.26 
1 1 1 -32 6  14 o 133.6099 4.477655 182.9539  354.8 38.46227       8.955311 0.89 
1 1 1 -32 6  15 o 105.0183 4.344747 177.7304  8.5   34.47493       8.689493 0.89 
1 1 1 -32 6  16 o 286.5261 3.613958 491.6702  117.4 4.319977       7.227917 0.99 
1 1 1 -32 6  17 o 181.6139 3.286921 279.1914  83.9  16.83377       6.573842 0.97 
1 1 1 -32 6  18 o 48.61035 7.870243 130.3646  323.7 13.35548       15.74049 0.67 
1 1 1 -32 6  19 o 137.0684 3.744199 269.3223  266.2 -40.78580      7.488398 0.96 
1 1 1 -32 6  20 o 189.5187 3.353952 348.8344  259.8 -37.06378      6.707904 0.98 
1 1 1 -32 6  21 o 203.3271 3.245039 295.4352  270.0 13.36119       6.490078 0.98 
1 1 1 -32 6  22 o 123.2545 4.106282 295.0080  241.6 10.33039       8.212564 0.97 
1 1 1 -32 6  23 o 182.2897 4.194229 285.2262  288.6 -27.95493      8.388458 0.98 
1 1 1 -32 6  24 o 142.1443 3.923384 248.6763  9.1   40.85985       7.846769 0.98 
1 1 1 -32 6  25 o 55.65233 8.449293 99.41543  295.2 -29.99978      16.89859 0.87 
1 1 1 -32 6  26 o 64.14244 7.891889 102.4733  271.7 35.76696       15.78378 0.89 
1 1 1 -32 6  27 o 182.2788 3.907460 251.7727  19.4  -8.026474      7.814921 0.98 
1 1 1 -32 6  28 o 62.98383 9.041877 99.21022  241.9 -23.80666      18.08375 0.86 
1 1 1 -32 6  29 o 99.96353 5.698560 143.8699  231.8 -7.969986      11.39712 0.95 
1 1 1 -32 6  30 o 29.81833 9.100884 44.71422  208.2 -7.795511      18.20177 0.50 
1 1 1 -32 6  31 o 73.60336 8.097369 45.61148  57.6  26.90110       16.19474 0.85 
1 1 1 -32 6  32 o 46.65871 10.57803 43.73282  119.3 6.781094       21.15607 0.76 
1 1 1 -32 6  33 o 70.29665 9.799355 86.35386  29.3  -16.75341      19.59871 0.93 
1 1 1 -32 6  34 o 39.23409 10.60525 44.96299  260.5 17.63059       21.21051 0.74 
1 1 1 -32 6  35 o 42.49082 10.43067 94.68325  166.6 ?              ?        0.91 
1 1 1 -32 8  1  o 206.6835 4.128715 300.4365  150.9 15.41223       8.257429 0.98 
1 1 1 -32 8  2  o 201.5688 2.931042 335.2744  210.2 -18.71355      5.862084 0.98 
1 1 1 -32 8  3  o 57.69691 5.782869 87.52065  197.9 4.457958       11.56574 0.67 
1 1 1 -32 8  4  o 81.22763 5.127691 90.11699  134.3 -20.70086      10.25538 0.70 
1 1 1 -32 8  5  o 109.7240 3.651728 231.9663  35.7  -28.27917      7.303455 0.94 
1 1 1 -32 8  6  o 164.6332 3.582209 271.9923  160.1 -22.89813      7.164417 0.96 
1 1 1 -32 8  7  o 101.4814 3.632846 174.0796  81.9  4.516060       7.265692 0.90 
1 1 1 -32 8  8  o 220.2954 3.758762 347.4075  42.9  18.35022       7.517524 0.98 
1 1 1 -32 8  9  o 285.1898 3.377451 476.4660  49.6  13.06046       6.754901 0.99 
1 1 1 -32 8  10 o 161.0475 3.368005 237.0453  64.2  -34.17851      6.736010 0.96 
1 1 1 -32 8  11 o 59.68469 6.871690 89.07414  5.1   -31.11510      13.74338 0.64 
1 1 1 -32 8  12 o 168.5808 3.726592 268.5998  353.5 13.36545       7.453183 0.97 
1 1 1 -32 8  13 o 102.5558 4.810116 209.5419  63.4  -11.29594      9.620233 0.93 
1 1 1 -32 8  14 o 60.65166 7.120282 252.5063  36.4  -18.49678      14.24056 0.89 
1 1 1 -32 8  15 o 166.3852 3.571529 321.2439  17.6  5.838623       7.143058 0.97 
1 1 1 -32 8  16 o 79.83559 4.933628 118.3290  234.5 4.103607       9.867255 0.86 
1 1 1 -32 8  17 o 216.3336 3.431868 430.6557  116.8 -25.27863      6.863736 0.99 
1 1 1 -32 8  18 o 51.91784 8.164048 14.68098  62.6  10.80591       16.32810 0.19 
1 1 1 -32 8  19 o 87.55724 5.866813 166.0502  15.6  -14.41714      11.73363 0.93 
1 1 1 -32 8  20 o 54.65110 9.164975 122.8077  247.6 -7.616474      18.32995 0.85 
1 1 1 -32 8  21 o 106.9533 6.944006 235.4326  23.2  -39.48785      13.88801 0.97 
1 1 1 -32 8  22 o 25.02206 7.869549 62.02599  181.1 4.325321       15.73910 0.50 
1 1 1 -32 8  23 o 175.4009 3.918643 265.8537  284.8 -15.49867      7.837285 0.99 
1 1 1 -32 8  24 o 52.46216 8.973495 74.73247  298.2 23.19757       17.94699 0.78 
1 1 1 -32 8  25 o 100.4899 5.837123 142.7635  113.3 -3.097755      11.67425 0.94 
1 1 1 -32 8  26 o 170.0084 4.790169 261.0696  151.2 -29.56001      9.580338 0.98 
1 1 1 -32 8  27 o 39.07711 10.60831 108.9989  242.6 -15.26841      21.21662 0.82 
1 1 1 -32 8  28 o 126.7635 5.691069 191.8296  291.5 1.776154       11.38214 0.98 
1 1 1 -32 8  29 o 54.20094 11.28979 72.22188  290.8 -8.221027      22.57958 0.86 
1 1 1 -32 8  30 o 62.56758 10.71522 81.53074  324.6 -4.077431      21.43044 0.92 
1 1 1 -32 8  31 o 31.20669 9.971959 18.27325  144.2 2.806385       19.94392 0.33 
1 1 1 -32 8  32 o 36.86527 11.03903 50.03496  348.0 11.63107       22.07806 0.74 
1 1 1 -32 8  33 o 31.55179 10.09968 29.07474  306.4 ?              ?        0.56 
1 1 1 -32 10 1  f 40.77343 8.946468 118.5963  6.2   -0.6748352     17.89294 0.00 
1 1 1 -32 10 2  o 181.2421 3.471416 322.3506  142.3 41.65190       6.942831 0.98 
1 1 1 -32 10 3  o 76.58679 5.605064 138.2675  262.9 -23.77654      11.21013 0.89 
1 1 1 -32 10 4  o 46.80444 8.534464 175.3500  261.3 4.551136       17.06893 0.85 
1 1 1 -32 10 5  o 151.7939 3.398163 227.5420  349.8 3.398529       6.796326 0.97 
1 1 1 -32 10 6  o 146.3071 3.294819 294.2691  270.5 17.29442       6.589638 0.97 
1 1 1 -32 10 7  o 218.4471 4.234530 359.1653  126.6 ?              ?        0.99 
1 1 1 -32 10 8  o 172.9654 4.399447 351.8865  100.3 -5.107605      8.798895 0.98 
1 1 1 -32 10 9  o 235.0382 3.582436 372.4906  54.6  1.195694       7.164872 0.99 
1 1 1 -32 10 10 o 68.26190 6.156316 138.4662  187.4 -16.40461      12.31263 0.89 
1 1 1 -32 10 11 o 82.61217 5.525746 52.76365  336.0 18.66730       11.05149 0.75 
1 1 1 -32 10 12 o 253.6431 3.567811 456.2520  53.8  -17.32079      7.135622 0.99 
1 1 1 -32 10 13 o 33.24819 9.590688 88.09415  125.3 21.54059       19.18138 0.61 
1 1 1 -32 10 14 o 165.0625 3.393880 288.5164  201.4 34.05016       6.787760 0.98 
1 1 1 -32 10 15 o 40.10699 9.362955 33.66161  310.3 4.933765       18.72591 0.36 
1 1 1 -32 10 16 o 59.38142 7.576397 175.3078  185.8 -45.23790      15.15279 0.92 
1 1 1 -32 10 17 o 50.22416 8.023764 84.40582  124.1 -28.01504      16.04753 0.81 
1 1 1 -32 10 18 o 47.66808 8.967032 30.99970  292.7 15.69957       17.93406 0.52 
1 1 1 -32 10 19 o 93.65995 5.194611 130.9998  193.4 13.27376       10.38922 0.95 
1 1 1 -32 10 20 o 50.08155 8.830628 115.8519  188.8 -13.79047      17.66126 0.87 
1 1 1 -32 10 21 o 79.27692 5.980651 118.9250  344.5 29.98628       11.96130 0.91 
1 1 1 -32 10 22 o 65.51990 8.151331 168.9762  228.0 1.762276       16.30266 0.93 
1 1 1 -32 10 23 o 53.71739 9.116982 124.5579  206.2 -22.74433      18.23396 0.89 
1 1 1 -32 10 24 o 40.42190 10.19352 47.69882  236.1 0.2383423      20.38704 0.60 
1 1 1 -32 10 25 f 71.73338 9.128416 137.5831  18.0  -14.01561      18.25683 0.00 
1 1 1 -32 10 26 o 64.18733 10.28859 120.5729  212.9 29.99938       20.57718 0.94 
1 1 1 -32 10 27 o 54.64578 11.71399 140.1918  208.3 -2.023891      23.42798 0.94 
1 1 1 -32 10 28 o 53.96766 11.50306 123.1336  245.2 3.592278       23.00612 0.93 
1 1 1 -32 10 29 o 61.07920 11.80787 115.6674  296.0 -24.07205      23.61573 0.94 
1 1 1 -32 10 30 o 63.70605 11.65612 135.5353  334.9 ?              ?        0.95 
1 1 1 -32 10 31 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -32 12 1  o 139.6060 3.816390 225.0473  289.3 17.27525       7.632779 0.98 
1 1 1 -32 12 2  o 176.9848 3.541919 248.0967  187.1 -8.574036      7.083838 0.99 
1 1 1 -32 12 3  o 169.1129 3.522623 272.2129  126.8 -14.50574      7.045246 0.99 
1 1 1 -32 12 4  o 216.8559 3.555104 341.0848  69.1  -5.692169      7.110208 0.99 
1 1 1 -32 12 5  o 145.5089 4.007383 177.3600  151.9 -20.43683      8.014767 0.98 
1 1 1 -32 12 6  o 182.3824 3.431509 348.6133  196.1 0.2126770      6.863018 0.99 
1 1 1 -32 12 7  o 42.66850 10.40544 115.9895  248.2 -1.153114      20.81087 0.87 
1 1 1 -32 12 8  o 45.47149 8.661189 62.38853  284.5 21.68320       17.32238 0.77 
1 1 1 -32 12 9  o 68.18666 9.687155 48.43990  122.1 -1.946548      19.37431 0.81 
1 1 1 -32 12 10 o 107.0534 5.833345 165.2391  143.5 -26.93848      11.66669 0.97 
1 1 1 -32 12 11 o 73.48615 9.476489 201.0782  331.8 -13.94121      18.95298 0.96 
1 1 1 -32 12 12 o 44.02147 9.902814 86.95824  243.5 17.12399       19.80563 0.80 
1 1 1 -32 12 13 o 172.7695 5.270533 296.8984  262.0 -35.77246      10.54107 0.99 
1 1 1 -32 12 14 o 163.9514 5.093517 311.4157  246.9 -10.19623      10.18703 0.99 
1 1 1 -32 12 15 o 28.21561 8.741016 130.4154  279.3 10.84264       17.48203 0.75 
1 1 1 -32 12 16 o 212.3940 3.815743 341.9298  292.1 -32.30473      7.631486 0.99 
1 1 1 -32 12 17 f 54.71106 9.282050 91.48077  356.3 -12.50982      18.56410 0.00 
1 1 1 -32 12 18 o 166.6037 4.157894 254.9448  38.7  3.860962       8.315787 0.99 
1 1 1 -32 12 19 o 64.96304 7.469890 83.33150  358.6 19.84255       14.93978 0.88 
1 1 1 -32 12 20 o 50.33336 8.452408 162.4586  244.7 -23.29535      16.90482 0.93 
1 1 1 -32 12 21 o 48.79677 10.38140 79.12733  267.7 11.97240       20.76280 0.86 
1 1 1 -32 12 22 o 45.94673 10.41188 94.35808  89.1  2.682537       20.82376 0.89 
1 1 1 -32 12 23 o 40.81796 10.53556 125.2510  43.6  4.942291       21.07112 0.92 
1 1 1 -32 12 24 o 63.66196 9.651379 140.1776  297.6 -35.77439      19.30276 0.96 
1 1 1 -32 12 25 o 44.43441 11.64406 107.7735  6.5   13.13835       23.28811 0.91 
1 1 1 -32 12 26 o 75.90436 10.39277 170.0756  62.8  -33.86647      20.78555 0.97 
1 1 1 -32 12 27 o 84.00742 9.894688 152.5976  18.1  ?              ?        0.97 
1 1 1 -32 14 1  o 86.65701 6.905716 134.3644  38.1  29.76781       13.81143 0.95 
1 1 1 -32 14 2  o 91.43865 6.327382 155.9032  201.7 3.039536       12.65476 0.96 
1 1 1 -32 14 3  o 174.5244 4.073459 293.1202  238.3 -1.361526      8.146917 0.99 
1 1 1 -32 14 4  o 78.79977 7.129932 144.5437  193.6 9.707550       14.25986 0.95 
1 1 1 -32 14 5  o 57.12058 9.345995 128.7939  87.1  -9.728622      18.69199 0.92 
1 1 1 -32 14 6  o 202.2136 3.805257 317.1378  330.7 9.305313       7.610514 0.99 
1 1 1 -32 14 7  o 54.94358 10.92624 80.83791  307.6 6.062050       21.85248 0.85 
1 1 1 -32 14 8  o 50.54428 11.08513 84.76881  257.3 11.94455       22.17027 0.84 
1 1 1 -32 14 9  o 45.51360 11.16885 118.7638  219.5 -12.64686      22.33770 0.88 
1 1 1 -32 14 10 o 44.18766 12.31205 98.61470  34.8  14.75999       24.62410 0.85 
1 1 1 -32 14 11 o 146.4054 5.965019 259.5758  347.0 -13.69014      11.93004 0.99 
1 1 1 -32 14 12 f 77.25399 10.64176 140.4254  9.8   -49.15622      21.28353 0.00 
1 1 1 -32 14 13 o 62.12132 9.490030 133.7642  90.9  -43.80004      18.98006 0.94 
1 1 1 -32 14 14 o 46.93364 12.09378 84.77882  289.6 13.31823       24.18757 0.87 
1 1 1 -32 14 15 o 48.01939 12.30151 83.78876  229.1 0.9888077      24.60302 0.87 
1 1 1 -32 14 16 o 107.6978 8.982121 207.8287  145.6 -13.62193      17.96424 0.98 
1 1 1 -32 14 17 o 66.15874 10.76748 160.9615  108.2 -36.68047      21.53496 0.96 
1 1 1 -32 14 18 o 64.87296 11.71917 84.01083  294.5 -18.71351      23.43834 0.92 
1 1 1 -32 14 19 o 41.83967 9.798923 83.91647  22.2  -16.91231      19.59785 0.89 
1 1 1 -32 14 20 f 57.49359 11.09660 92.72730  61.3  -19.69657      22.19319 0.00 
1 1 1 -32 14 21 o 46.71223 12.77182 45.69150  247.7 13.88524       25.54364 0.77 
1 1 1 -32 14 22 o 65.66327 12.24948 130.4084  218.0 ?              ?        0.95 
1 1 1 -32 14 23 x ?        ?        72.63531  145.4 ?              ?        0.00 
1 1 1 -32 16 1  o 33.10808 10.27225 71.68289  343.2 4.000874       20.54449 0.83 
1 1 1 -32 16 2  o 67.26605 10.29546 110.1562  289.4 -9.470665      20.59091 0.95 
1 1 1 -32 16 3  o 86.69719 9.020357 173.4227  270.2 34.46821       18.04071 0.98 
1 1 1 -32 16 4  o 66.58405 9.852201 106.0163  24.6  -46.20374      19.70440 0.95 
1 1 1 -32 16 5  o 126.0175 6.192600 244.6560  10.1  -12.44065      12.38520 0.99 
1 1 1 -32 16 6  o 90.65622 8.510808 166.9739  320.3 -2.457466      17.02162 0.98 
1 1 1 -32 16 7  o 48.30183 11.25072 80.74910  184.5 5.060669       22.50143 0.90 
1 1 1 -32 16 8  o 48.66113 12.01283 51.54706  140.9 15.52547       24.02566 0.82 
1 1 1 -32 16 9  o 44.67599 12.52129 95.68343  69.0  -1.407875      25.04258 0.90 
1 1 1 -32 16 10 o 118.0125 9.184532 247.8511  92.3  -26.66352      18.36906 0.99 
1 1 1 -32 16 11 o 81.26662 12.30000 162.0000  86.6  -51.47899      24.60001 0.97 
1 1 1 -32 16 12 o 60.50040 13.03558 140.4421  346.1 13.41116       26.07115 0.95 
1 1 1 -32 16 13 o 51.69862 11.90139 122.5396  296.8 ?              ?        0.94 
1 1 1 -32 16 14 o 39.00659 12.60294 80.64798  221.0 ?              ?        0.87 
1 1 1 -32 16 15 x ?        ?        37.73994  259.0 ?              ?        0.00 
1 1 1 -31 1  1  o 663.4113 6.017523 863.8852  68.0  13.44519       12.03505 0.99 
1 1 1 -31 1  2  o 314.4705 3.570647 546.4599  30.5  -62.54050      7.141295 0.96 
1 1 1 -31 1  3  o 656.0338 6.234683 729.9668  48.4  -47.10602      12.46937 0.99 
1 1 1 -31 1  4  o 475.6008 5.036060 695.6039  49.9  -17.19540      10.07212 0.98 
1 1 1 -31 1  5  o 337.7583 4.310936 326.2735  313.5 7.328918       8.621872 0.93 
1 1 1 -31 1  6  o 304.9634 3.925668 185.4238  332.0 -24.09161      7.851336 0.92 
1 1 1 -31 1  7  o 817.3202 7.442181 1080.158  180.7 45.07642       14.88436 0.99 
1 1 1 -31 1  8  o 1130.399 9.789430 1387.703  29.5  -9.298218      19.57886 1.00 
1 1 1 -31 1  9  o 366.6486 4.693796 568.2430  58.1  -59.99490      9.387592 0.97 
1 1 1 -31 1  10 o 672.8495 6.571690 873.3947  275.5 15.50574       13.14338 0.99 
1 1 1 -31 1  11 o 344.4350 4.463768 379.3965  77.7  35.73413       8.927537 0.95 
1 1 1 -31 1  12 o 374.1664 5.962048 337.1809  94.4  73.76721       11.92410 0.95 
1 1 1 -31 1  13 o 343.5742 4.117106 546.8464  59.6  -29.32877      8.234213 0.96 
1 1 1 -31 1  14 o 261.0916 3.709800 582.8015  296.8 -2.861572      7.419601 0.95 
1 1 1 -31 1  15 o 318.7589 4.092418 632.1506  67.3  18.35178       8.184836 0.97 
1 1 1 -31 1  16 f 156.6529 3.436320 119.2046  48.3  4.887436       6.872640 0.00 
1 1 1 -31 1  17 o 123.1834 3.352240 200.1904  239.2 -13.78573      6.704480 0.75 
1 1 1 -31 1  18 o 312.1146 3.646804 397.0320  2.4   11.54498       7.293607 0.97 
1 1 1 -31 1  19 o 377.2557 3.927327 541.3175  31.5  -2.397095      7.854654 0.98 
1 1 1 -31 1  20 o 238.9023 3.211808 362.7408  315.3 -4.646774      6.423616 0.97 
1 1 1 -31 1  21 o 257.2698 3.442105 347.8818  324.8 29.91167       6.884211 0.98 
1 1 1 -31 1  22 o 120.8829 3.443854 196.3260  168.0 -39.46320      6.887707 0.93 
1 1 1 -31 1  23 o 233.2332 3.397414 504.8060  169.4 -5.954453      6.794828 0.99 
1 1 1 -31 1  24 o 29.96278 9.215416 62.30154  97.8  12.70611       18.43083 0.31 
1 1 1 -31 1  25 o 70.16937 5.242473 127.2870  56.6  -22.58921      10.48495 0.87 
1 1 1 -31 1  26 o 190.9289 3.424422 244.2395  3.0   42.72302       6.848844 0.98 
1 1 1 -31 1  27 o 241.0776 3.393465 400.2162  12.4  9.131454       6.786930 0.99 
1 1 1 -31 1  28 o 113.1544 4.514963 126.8408  152.3 -22.47289      9.029926 0.95 
1 1 1 -31 1  29 o 43.31128 7.788400 35.11696  183.9 -31.62449      15.57680 0.48 
1 1 1 -31 1  30 o 116.3489 4.329604 152.5991  121.6 4.137749       8.659207 0.95 
1 1 1 -31 1  31 o 98.05949 5.889692 102.9439  142.8 -35.80557      11.77938 0.92 
1 1 1 -31 1  32 o 75.22294 6.546835 108.4475  353.0 1.880096       13.09367 0.92 
1 1 1 -31 1  33 o 203.3483 3.833321 261.2727  270.4 -3.317413      7.666643 0.99 
1 1 1 -31 1  34 o 47.01715 9.356337 46.95399  339.8 12.44463       18.71267 0.78 
1 1 1 -31 1  35 o 47.88191 11.30953 35.73711  264.5 -19.05719      22.61906 0.69 
1 1 1 -31 1  36 o 93.93146 6.590414 116.2913  343.2 -8.290764      13.18083 0.97 
1 1 1 -31 1  37 o 64.63075 9.841429 70.76453  329.7 ?              ?        0.92 
1 1 1 -31 3  1  o 1030.887 8.867726 1213.385  354.9 -31.41382      17.73545 0.99 
1 1 1 -31 3  2  o 267.5114 3.156909 241.1889  308.5 11.77869       6.313818 0.90 
1 1 1 -31 3  3  o 263.7075 3.567988 322.4652  177.7 -22.64999      7.135976 0.90 
1 1 1 -31 3  4  o 670.1646 5.876077 704.7711  55.7  -6.356567      11.75215 0.99 
1 1 1 -31 3  5  o 803.2642 6.761446 927.2643  111.1 -51.02008      13.52289 0.99 
1 1 1 -31 3  6  o 270.2472 3.642742 318.6138  171.6 -61.21681      7.285485 0.87 
1 1 1 -31 3  7  o 112.4956 6.337732 138.1812  279.1 5.313171       12.67546 0.13 
1 1 1 -31 3  8  o 536.5933 6.586346 729.7377  225.6 56.46628       13.17269 0.98 
1 1 1 -31 3  9  f 541.0353 5.509058 705.5396  25.2  68.95972       11.01812 0.00 
1 1 1 -31 3  10 o 454.2366 4.668512 505.4894  109.4 -21.03549      9.337024 0.97 
1 1 1 -31 3  11 o 524.6155 5.243358 706.5121  198.7 14.29663       10.48672 0.98 
1 1 1 -31 3  12 o 561.4630 5.529321 573.3790  166.2 -26.83630      11.05864 0.98 
1 1 1 -31 3  13 o 550.6846 5.424687 741.8196  152.1 -72.30737      10.84937 0.99 
1 1 1 -31 3  14 o 433.9813 4.602137 624.9551  82.6  -18.27795      9.204274 0.98 
1 1 1 -31 3  15 o 292.1456 3.546986 334.2043  71.0  -31.57547      7.093972 0.95 
1 1 1 -31 3  16 o 385.8491 4.097960 448.5510  38.4  20.68359       8.195920 0.97 
1 1 1 -31 3  17 o 339.5019 3.872457 581.2301  131.2 0.3997803E-02  7.744915 0.98 
1 1 1 -31 3  18 o 249.5466 3.276119 310.2236  20.2  -6.539444      6.552239 0.96 
1 1 1 -31 3  19 o 229.8053 4.228506 392.4360  103.7 -12.12189      8.457012 0.97 
1 1 1 -31 3  20 o 55.11329 6.288271 38.18941  109.3 -33.21457      12.57654 0.19 
1 1 1 -31 3  21 o 125.0212 3.118873 280.0051  287.4 -11.90235      6.237746 0.95 
1 1 1 -31 3  22 o 150.8621 3.279413 349.8330  169.2 -1.109268      6.558827 0.97 
1 1 1 -31 3  23 o 39.52216 8.062746 78.39165  105.6 -10.43075      16.12549 0.50 
1 1 1 -31 3  24 o 123.4931 3.666787 163.0293  104.0 -26.28888      7.333574 0.94 
1 1 1 -31 3  25 o 93.81929 4.407416 158.4579  226.5 19.43429       8.814833 0.93 
1 1 1 -31 3  26 o 89.49977 4.408752 140.0224  80.9  -2.950432      8.817505 0.93 
1 1 1 -31 3  27 o 67.07822 6.933072 66.42584  330.7 -10.80930      13.86614 0.81 
1 1 1 -31 3  28 o 226.3091 3.530223 353.1573  279.9 3.282211       7.060446 0.99 
1 1 1 -31 3  29 o 91.25931 5.959455 88.52310  130.9 -9.812035      11.91891 0.90 
1 1 1 -31 3  30 o 215.2977 3.841171 366.4919  137.9 5.176361       7.682341 0.99 
1 1 1 -31 3  31 o 141.9726 4.091283 159.9279  359.4 -8.558731      8.182567 0.97 
1 1 1 -31 3  32 o 101.2753 5.004733 159.9205  245.5 -12.12228      10.00947 0.97 
1 1 1 -31 3  33 o 79.50259 7.411960 90.74775  99.0  -0.5053253     14.82392 0.94 
1 1 1 -31 3  34 o 85.20644 6.593937 163.9780  99.4  18.10110       13.18787 0.97 
1 1 1 -31 3  35 o 93.79866 6.422073 150.5231  93.9  4.003906       12.84415 0.97 
1 1 1 -31 3  36 o 87.90414 7.932412 113.7856  87.5  ?              ?        0.97 
1 1 1 -31 5  1  o 373.3758 3.383074 442.7131  155.7 -19.15970      6.766148 0.96 
1 1 1 -31 5  2  o 266.3883 2.986616 371.7780  1.3   -6.407104      5.973232 0.94 
1 1 1 -31 5  3  o 234.9034 2.975164 374.5428  316.7 -16.70833      5.950328 0.92 
1 1 1 -31 5  4  o 58.70501 6.647258 212.0439  266.4 -19.02064      13.29452 0.42 
1 1 1 -31 5  5  o 257.8819 3.380447 502.2210  248.6 -22.43472      6.760894 0.95 
1 1 1 -31 5  6  o 129.5041 3.165495 225.6110  335.8 -39.28869      6.330991 0.71 
1 1 1 -31 5  7  o 110.3981 3.622620 203.1009  125.7 29.64193       7.245240 0.62 
1 1 1 -31 5  8  o 456.4128 4.324079 620.5400  244.9 7.157410       8.648158 0.98 
1 1 1 -31 5  9  o 228.2582 3.340533 282.1788  356.4 33.22235       6.681066 0.89 
1 1 1 -31 5  10 o 537.8755 6.630071 760.3345  70.4  46.30328       13.26014 0.99 
1 1 1 -31 5  11 o 263.9962 4.245688 403.1325  176.4 35.66220       8.491376 0.95 
1 1 1 -31 5  12 o 447.8750 5.636271 698.2706  2.4   31.01791       11.27254 0.98 
1 1 1 -31 5  13 o 46.96937 7.358718 144.5396  350.4 -13.19669      14.71744 0.34 
1 1 1 -31 5  14 o 306.7112 4.212849 507.0933  118.1 22.01361       8.425697 0.97 
1 1 1 -31 5  15 o 195.2900 3.659064 293.8670  269.7 6.818039       7.318127 0.94 
1 1 1 -31 5  16 o 128.2354 3.428392 282.9407  56.2  49.37223       6.856784 0.92 
1 1 1 -31 5  17 o 98.36259 5.456432 224.1691  43.6  -35.16095      10.91286 0.90 
1 1 1 -31 5  18 o 131.3264 3.399364 171.7948  328.9 -16.03071      6.798728 0.92 
1 1 1 -31 5  19 o 112.8753 3.627893 151.3443  133.9 24.75665       7.255787 0.90 
1 1 1 -31 5  20 o 126.5300 3.164173 269.2264  125.3 12.18221       6.328346 0.95 
1 1 1 -31 5  21 o 151.4310 3.293162 349.6900  295.4 3.350403       6.586324 0.97 
1 1 1 -31 5  22 o 162.0155 3.808199 237.6714  14.4  -24.00920      7.616399 0.97 
1 1 1 -31 5  23 o 169.4037 3.716851 261.6993  346.3 -20.99416      7.433702 0.98 
1 1 1 -31 5  24 o 231.6595 3.770230 393.4359  305.5 36.58487       7.540460 0.99 
1 1 1 -31 5  25 o 66.86185 7.950064 139.0142  197.7 -2.184799      15.90013 0.90 
1 1 1 -31 5  26 o 244.5131 3.590172 373.0445  115.0 -3.004532      7.180345 0.99 
1 1 1 -31 5  27 o 203.8085 3.714485 279.5705  59.9  -6.108749      7.428970 0.99 
1 1 1 -31 5  28 o 187.4716 3.811358 251.5292  358.8 12.73166       7.622717 0.98 
1 1 1 -31 5  29 o 46.24360 8.269782 42.68602  43.9  -35.12879      16.53956 0.52 
1 1 1 -31 5  30 o 97.59779 5.488748 205.9082  133.4 -7.478210      10.97750 0.97 
1 1 1 -31 5  31 o 91.26793 6.283831 169.7676  247.1 22.85590       12.56766 0.96 
1 1 1 -31 5  32 o 35.07471 10.02085 48.34000  295.5 -13.22015      20.04170 0.66 
1 1 1 -31 5  33 f 75.30439 7.643200 113.2080  76.3  -26.22742      15.28640 0.00 
1 1 1 -31 5  34 o 71.57600 8.343470 76.80401  163.9 -2.760162      16.68694 0.93 
1 1 1 -31 5  35 o 71.70490 9.326943 122.0777  190.7 ?              ?        0.96 
1 1 1 -31 7  1  o 52.25784 7.624222 61.90111  234.7 10.59630       15.24844 0.27 
1 1 1 -31 7  2  o 198.3848 2.668243 360.9682  268.5 17.57025       5.336486 0.96 
1 1 1 -31 7  3  o 307.3544 2.883992 336.9346  331.7 -18.19266      5.767984 0.97 
1 1 1 -31 7  4  o 41.75328 8.066466 146.0251  75.4  1.180084       16.13293 0.40 
1 1 1 -31 7  5  o 90.44812 3.996439 87.19663  200.8 -9.221817      7.992877 0.57 
1 1 1 -31 7  6  o 103.2340 3.979162 95.84589  188.2 55.53365       7.958324 0.56 
1 1 1 -31 7  7  o 202.8758 3.478848 293.4702  87.9  -21.98134      6.957696 0.95 
1 1 1 -31 7  8  o 339.5904 3.567556 586.7325  61.1  37.01584       7.135112 0.98 
1 1 1 -31 7  9  o 302.5927 3.533812 431.1047  46.9  -1.402954      7.067623 0.98 
1 1 1 -31 7  10 o 137.5887 4.217309 300.3493  119.4 -18.86319      8.434617 0.93 
1 1 1 -31 7  11 o 175.0743 3.998652 282.0299  100.4 -26.02771      7.997304 0.94 
1 1 1 -31 7  12 o 146.3461 3.149136 133.0182  17.4  -15.76505      6.298272 0.87 
1 1 1 -31 7  13 o 37.48334 8.780366 164.2599  117.7 -4.777855      17.56073 0.60 
1 1 1 -31 7  14 o 173.1976 3.385630 267.3181  195.7 -22.11166      6.771260 0.97 
1 1 1 -31 7  15 o 139.1682 3.660417 290.9070  126.7 4.820557       7.320834 0.96 
1 1 1 -31 7  16 o 230.7641 3.416929 356.7281  70.0  -33.71190      6.833858 0.98 
1 1 1 -31 7  17 o 165.8833 3.336276 327.7895  81.2  -46.09074      6.672552 0.97 
1 1 1 -31 7  18 o 183.6538 3.093909 346.5783  271.9 2.379456       6.187817 0.98 
1 1 1 -31 7  19 o 155.2845 3.296858 215.6464  297.6 -25.36714      6.593717 0.96 
1 1 1 -31 7  20 o 90.64412 6.408852 127.1333  65.3  11.93056       12.81770 0.91 
1 1 1 -31 7  21 o 198.7761 3.295540 272.7300  106.8 1.920242       6.591081 0.98 
1 1 1 -31 7  22 o 229.6967 3.598086 293.3126  103.3 -39.61070      7.196172 0.99 
1 1 1 -31 7  23 o 129.8236 3.956958 190.1288  346.1 -8.833000      7.913917 0.97 
1 1 1 -31 7  24 o 175.2379 3.880900 254.8571  339.8 -12.00822      7.761801 0.99 
1 1 1 -31 7  25 o 172.4930 3.938579 245.7020  272.2 -29.23187      7.877158 0.99 
1 1 1 -31 7  26 o 30.64967 9.293495 31.53340  103.7 23.05785       18.58699 0.28 
1 1 1 -31 7  27 o 73.91640 9.171597 107.5612  213.3 -47.08877      18.34319 0.89 
1 1 1 -31 7  28 o 38.58512 10.09661 93.98035  173.1 24.75632       20.19322 0.76 
1 1 1 -31 7  29 o 43.95517 10.47970 118.6798  156.8 -4.488438      20.95940 0.87 
1 1 1 -31 7  30 o 31.46729 9.815996 58.95179  25.3  11.47570       19.63199 0.68 
1 1 1 -31 7  31 o 71.34159 9.324442 118.2340  64.4  15.42281       18.64888 0.95 
1 1 1 -31 7  32 o 47.87565 10.67622 83.63406  232.1 -19.40784      21.35243 0.89 
1 1 1 -31 7  33 o 48.72757 11.35026 62.39283  313.6 18.93685       22.70053 0.85 
1 1 1 -31 7  34 o 37.08276 10.72476 18.81568  329.1 ?              ?        0.44 
1 1 1 -31 9  1  o 29.62095 8.889199 93.01815  293.1 15.22170       17.77840 0.44 
1 1 1 -31 9  2  o 159.1294 3.016105 299.4566  76.7  29.30618       6.032210 0.97 
1 1 1 -31 9  3  o 250.4269 3.306168 526.2894  60.4  10.87788       6.612336 0.99 
1 1 1 -31 9  4  o 111.4619 3.849441 217.8513  10.4  26.77039       7.698881 0.93 
1 1 1 -31 9  5  o 111.0697 5.691507 105.6583  319.4 -4.977425      11.38301 0.85 
1 1 1 -31 9  6  o 57.45943 6.150508 62.81523  228.3 -6.583614      12.30102 0.47 
1 1 1 -31 9  7  o 354.2317 3.663913 603.0190  93.8  18.38019       7.327826 0.99 
1 1 1 -31 9  8  o 180.8985 3.091753 352.3700  69.0  16.51904       6.183505 0.98 
1 1 1 -31 9  9  o 167.1688 3.058352 181.0411  337.4 -3.987350      6.116704 0.95 
1 1 1 -31 9  10 o 49.59172 6.484788 124.9201  210.9 -46.00710      12.96958 0.70 
1 1 1 -31 9  11 o 121.6011 3.754038 132.5258  142.0 12.50398       7.508076 0.90 
1 1 1 -31 9  12 o 76.20248 5.390368 110.1505  44.4  -16.33566      10.78074 0.81 
1 1 1 -31 9  13 o 26.91545 7.990106 72.17738  288.8 -0.7395382     15.98021 0.33 
1 1 1 -31 9  14 o 135.3730 3.559155 244.7621  64.9  2.426605       7.118309 0.97 
1 1 1 -31 9  15 o 132.9332 3.706886 229.0850  117.3 1.681061       7.413773 0.97 
1 1 1 -31 9  16 o 266.5439 3.592313 574.8391  209.1 9.536621       7.184627 0.99 
1 1 1 -31 9  17 o 138.0206 3.722228 265.0591  193.5 -21.44898      7.444455 0.98 
1 1 1 -31 9  18 o 146.4974 3.705622 275.9886  107.8 -21.16476      7.411244 0.98 
1 1 1 -31 9  19 o 54.49710 8.034449 34.35521  58.3  -25.96988      16.06890 0.49 
1 1 1 -31 9  20 o 239.5660 3.710283 389.8931  253.5 -15.64880      7.420566 0.99 
1 1 1 -31 9  21 o 65.55035 8.212805 124.9776  347.5 -20.84692      16.42561 0.93 
1 1 1 -31 9  22 o 86.32838 6.132761 107.2304  359.5 -2.957794      12.26552 0.93 
1 1 1 -31 9  23 o 157.4842 4.157095 276.5282  207.9 -9.749969      8.314191 0.98 
1 1 1 -31 9  24 o 153.2854 4.373749 281.7961  158.5 -4.506668      8.747498 0.98 
1 1 1 -31 9  25 o 52.87119 12.24663 71.31822  2.8   2.253143       24.49326 0.75 
1 1 1 -31 9  26 o 102.3445 7.476089 179.1663  180.6 -13.75900      14.95218 0.97 
1 1 1 -31 9  27 o 37.24654 10.58454 53.58019  114.8 3.784992       21.16908 0.67 
1 1 1 -31 9  28 f 37.94050 11.05853 52.16582  296.3 13.12339       22.11706 0.00 
1 1 1 -31 9  29 o 71.86610 9.210525 91.54363  197.3 12.27507       18.42105 0.94 
1 1 1 -31 9  30 o 61.92371 11.63186 114.2765  223.6 19.30032       23.26371 0.94 
1 1 1 -31 9  31 o 36.53883 12.02584 48.21341  113.3 -7.085777      24.05168 0.72 
1 1 1 -31 9  32 o 40.13920 11.79869 88.59863  231.6 ?              ?        0.89 
1 1 1 -31 11 1  o 42.75640 7.363484 69.93760  116.6 37.98502       14.72697 0.65 
1 1 1 -31 11 2  o 265.9726 3.506802 397.3048  102.1 -10.59247      7.013604 0.99 
1 1 1 -31 11 3  o 214.4485 3.226058 350.6518  55.4  -3.843582      6.452116 0.99 
1 1 1 -31 11 4  o 43.63529 9.306746 25.95441  160.9 6.173302       18.61349 0.29 
1 1 1 -31 11 5  o 88.85118 4.824569 151.8391  278.3 -23.61458      9.649138 0.93 
1 1 1 -31 11 6  o 91.09319 5.464243 119.2347  18.3  9.724876       10.92849 0.92 
1 1 1 -31 11 7  o 99.15962 5.698787 202.4217  97.5  -4.428452      11.39757 0.96 
1 1 1 -31 11 8  o 153.6869 3.956579 242.7986  178.0 28.39413       7.913158 0.98 
1 1 1 -31 11 9  o 79.63097 6.277384 154.6875  165.1 22.13075       12.55477 0.93 
1 1 1 -31 11 10 o 69.30540 8.085216 130.8641  139.6 ?              ?        0.90 
1 1 1 -31 11 11 o 61.77558 7.964985 82.84780  304.9 -5.208027      15.92997 0.81 
1 1 1 -31 11 12 o 31.26318 8.894344 55.29417  75.1  13.13083       17.78869 0.47 
1 1 1 -31 11 13 o 35.51868 9.328970 102.7041  264.7 -8.308331      18.65794 0.76 
1 1 1 -31 11 14 o 77.82054 6.479056 142.0037  251.1 37.61491       12.95811 0.94 
1 1 1 -31 11 15 o 72.62715 5.865153 140.8042  19.8  -2.120720      11.73031 0.94 
1 1 1 -31 11 16 o 147.6690 3.958170 263.3145  248.6 -18.42183      7.916339 0.99 
1 1 1 -31 11 17 o 34.32246 9.353289 34.52147  279.8 -1.008774      18.70658 0.42 
1 1 1 -31 11 18 o 169.2941 3.956839 337.1865  338.0 -7.853180      7.913678 0.99 
1 1 1 -31 11 19 o 132.1191 4.086466 200.0941  20.6  -17.44988      8.172933 0.97 
1 1 1 -31 11 20 o 77.55976 8.443315 107.3528  45.4  -28.20992      16.88663 0.91 
1 1 1 -31 11 21 o 143.2931 4.331862 205.9026  313.8 -7.703430      8.663724 0.98 
1 1 1 -31 11 22 o 68.09881 9.352262 125.3119  255.2 -10.11258      18.70452 0.92 
1 1 1 -31 11 23 o 42.92561 10.53964 47.57919  77.7  17.62923       21.07927 0.66 
1 1 1 -31 11 24 o 44.81288 11.56697 42.02454  217.4 0.7562218      23.13394 0.67 
1 1 1 -31 11 25 f 45.60341 11.24008 47.26772  334.2 29.62212       22.48016 0.00 
1 1 1 -31 11 26 o 32.57748 9.981196 34.98520  271.6 6.265863       19.96239 0.59 
1 1 1 -31 11 27 o 29.96957 9.790747 52.07665  69.1  8.643307       19.58149 0.70 
1 1 1 -31 11 28 o 34.15427 10.70366 30.69563  87.0  11.37082       21.40731 0.57 
1 1 1 -31 11 29 o 33.85162 11.29389 61.09911  356.6 ?              ?        0.80 
1 1 1 -31 13 1  o 83.19997 5.978355 113.3109  89.7  9.167938       11.95671 0.92 
1 1 1 -31 13 2  o 45.17597 9.051592 86.79250  178.3 -0.6109695     18.10318 0.76 
1 1 1 -31 13 3  o 119.7154 4.560863 180.3480  224.7 1.513893       9.121726 0.97 
1 1 1 -31 13 4  o 127.3848 4.356761 223.5933  285.8 -2.858955      8.713523 0.98 
1 1 1 -31 13 5  o 79.80791 7.284285 171.7264  325.8 -0.8282394     14.56857 0.95 
1 1 1 -31 13 6  o 201.6208 3.777000 333.0905  25.4  36.97102       7.554000 0.99 
1 1 1 -31 13 7  o 97.71860 6.205136 192.0919  104.4 2.089607       12.41027 0.96 
1 1 1 -31 13 8  o 90.27773 6.927807 130.2042  287.2 31.16656       13.85561 0.94 
1 1 1 -31 13 9  o 190.2385 5.042965 273.5557  301.7 12.81346       10.08593 0.99 
1 1 1 -31 13 10 o 77.95660 7.700076 161.8377  285.8 12.75177       15.40015 0.94 
1 1 1 -31 13 11 o 159.0264 5.027163 228.7656  353.3 27.09682       10.05433 0.98 
1 1 1 -31 13 12 o 164.4678 5.020133 308.5982  11.2  18.89966       10.04027 0.99 
1 1 1 -31 13 13 o 53.32806 12.08577 65.29903  327.1 4.549168       24.17155 0.74 
1 1 1 -31 13 14 o 150.4231 5.879723 273.5542  153.9 -32.13594      11.75945 0.98 
1 1 1 -31 13 15 o 192.6483 5.898816 268.3815  120.3 -39.75186      11.79763 0.99 
1 1 1 -31 13 16 o 55.36481 10.94578 78.23044  340.5 -10.08392      21.89155 0.84 
1 1 1 -31 13 17 o 80.92199 7.364214 121.1613  248.0 ?              ?        0.95 
1 1 1 -31 13 18 o 51.63709 11.15666 148.6791  220.8 -9.635124      22.31332 0.93 
1 1 1 -31 13 19 o 64.92136 11.45598 121.6393  142.5 -16.85075      22.91197 0.94 
1 1 1 -31 13 20 o 89.87737 5.812476 162.5959  108.7 12.48289       11.62495 0.98 
1 1 1 -31 13 21 o 48.02872 9.216412 106.6159  69.9  -9.258717      18.43282 0.93 
1 1 1 -31 13 22 o 70.17791 9.343003 115.0292  59.3  -25.58017      18.68601 0.95 
1 1 1 -31 13 23 o 74.15448 8.334025 87.97184  18.9  15.76582       16.66805 0.95 
1 1 1 -31 13 24 o 89.33836 8.791529 159.8911  343.6 -21.41418      17.58306 0.98 
1 1 1 -31 13 25 o 46.01834 9.619107 86.02149  48.4  ?              ?        0.91 
1 1 1 -31 15 1  o 49.47498 10.62616 59.51559  255.1 4.524113       21.25233 0.85 
1 1 1 -31 15 2  o 44.63652 10.23099 124.7039  337.0 -18.10220      20.46198 0.92 
1 1 1 -31 15 3  o 63.08661 9.445419 141.2647  11.9  -22.33096      18.89084 0.95 
1 1 1 -31 15 4  o 90.27704 7.282135 135.3782  112.2 -6.412689      14.56427 0.97 
1 1 1 -31 15 5  o 99.35863 6.355890 168.4371  68.8  18.80334       12.71178 0.98 
1 1 1 -31 15 6  o 107.9216 6.134098 160.9267  14.9  -14.36880      12.26820 0.98 
1 1 1 -31 15 7  o 48.51975 10.77480 98.73882  335.4 -8.479614      21.54960 0.91 
1 1 1 -31 15 8  o 78.60327 8.179648 142.0941  314.1 6.005646       16.35930 0.97 
1 1 1 -31 15 9  o 34.19896 11.10471 36.01405  58.8  22.57112       22.20942 0.59 
1 1 1 -31 15 10 o 138.6523 6.575429 260.2683  132.3 21.96495       13.15086 0.99 
1 1 1 -31 15 11 o 52.54431 12.09326 90.74767  123.4 -3.401752      24.18652 0.91 
1 1 1 -31 15 12 o 59.28944 12.07553 132.4292  355.6 -0.1803856     24.15106 0.95 
1 1 1 -31 15 13 o 37.08891 12.04400 125.2802  306.7 30.42009       24.08800 0.91 
1 1 1 -31 15 14 o 46.90777 12.71102 86.07309  264.9 15.24523       25.42204 0.89 
1 1 1 -31 15 15 o 46.16340 12.04926 106.7033  257.7 -7.346523      24.09852 0.91 
1 1 1 -31 15 16 o 58.33205 13.41008 81.43394  169.0 19.14143       26.82016 0.90 
1 1 1 -31 15 17 o 59.04956 12.99451 99.66241  127.9 -6.006432      25.98903 0.92 
1 1 1 -31 15 18 o 66.10749 13.51455 107.5863  334.0 18.24279       27.02909 0.94 
1 1 1 -31 15 19 o 34.78427 10.91978 48.07994  195.8 ?              ?        0.76 
1 1 1 -31 15 20 o 46.98146 11.84023 83.42129  124.5 ?              ?        0.91 
1 1 1 -30 0  1  o 443.4426 5.638252 657.7465  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  2  o 415.2390 6.558189 612.6482  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  3  f 845.8110 10.85638 1384.144  0.0   -0.000000      0.000000 0.00 
1 1 1 -30 0  4  o 574.9307 8.048162 914.2675  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  5  o 119.1217 6.005764 7.699858  0.0   -0.000000      0.000000 0.09 
1 1 1 -30 0  6  f 366.3707 6.000051 145.3802  0.0   -0.000000      0.000000 0.00 
1 1 1 -30 0  7  o 413.9365 6.557348 393.4850  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  8  o 310.4328 5.907025 552.8942  360.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  9  o 938.6903 12.13301 1270.371  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  10 o 665.5689 9.278412 883.1431  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  11 o 43.59056 13.33967 402.2105  180.0 -0.000000      0.000000 0.57 
1 1 1 -30 0  12 o 440.7560 6.905333 701.8845  360.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  13 o 149.7337 5.061820 40.99473  0.0   -0.000000      0.000000 0.25 
1 1 1 -30 0  14 o 617.5609 8.328049 924.3460  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  15 o 465.1327 10.24151 724.2487  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  16 o 698.5381 9.133002 1034.953  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  17 o 415.2989 6.192578 553.7997  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  18 o 215.4087 4.463694 460.8510  360.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  19 o 420.2585 6.352506 553.7495  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  20 o 167.9674 4.614639 234.9451  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  21 o 342.5837 5.689361 462.7090  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  22 o 55.74223 8.351163 34.35196  180.0 -0.000000      0.000000 0.30 
1 1 1 -30 0  23 o 22.54679 12.75131 24.57829  180.0 -0.000000      0.000000 0.08 
1 1 1 -30 0  24 o 221.8422 4.856493 325.4200  360.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  25 o 42.68788 12.92199 1.936933  180.0 -0.000000      0.000000 0.03 
1 1 1 -30 0  26 o 211.1567 4.722966 325.5623  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  27 o 47.23412 12.45230 36.89630  180.0 -0.000000      0.000000 0.43 
1 1 1 -30 0  28 o 22.24743 13.63808 2.636851  180.0 -0.000000      0.000000 0.02 
1 1 1 -30 0  29 o 273.8486 5.591648 324.5287  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  30 o 233.9843 5.327952 277.8184  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  31 o 119.6987 6.580805 181.0448  180.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  32 o 30.98044 16.57431 70.14978  0.0   -0.000000      0.000000 0.62 
1 1 1 -30 0  33 o 284.4597 6.354417 336.6378  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  34 o 127.5460 6.805171 168.1097  360.0 -0.000000      0.000000 1.00 
1 1 1 -30 0  35 o 27.48594 15.82368 15.33741  180.0 -0.000000      0.000000 0.23 
1 1 1 -30 0  36 o 159.3432 7.515551 196.4934  0.0   -0.000000      0.000000 1.00 
1 1 1 -30 0  37 o 14.79407 10.68875 13.58556  0.0   ?              ?        0.16 
1 1 1 -30 2  1  o 505.9116 4.889923 1001.341  46.6  30.34253       9.779845 0.98 
1 1 1 -30 2  2  o 536.5053 4.991295 766.9360  138.9 3.160889       9.982590 0.98 
1 1 1 -30 2  3  o 269.6252 3.450019 316.6209  97.8  52.85359       6.900037 0.93 
1 1 1 -30 2  4  o 423.9482 4.285859 607.9684  346.5 -32.30609      8.571718 0.97 
1 1 1 -30 2  5  o 302.2563 3.938547 572.7285  137.3 -32.23383      7.877094 0.95 
1 1 1 -30 2  6  o 588.4116 5.835718 668.7189  141.5 11.66534       11.67144 0.98 
1 1 1 -30 2  7  o 256.3696 4.002622 358.5838  339.7 -81.91769      8.005244 0.93 
1 1 1 -30 2  8  o 877.1027 7.897196 1123.967  15.9  -96.45117      15.79439 0.99 
1 1 1 -30 2  9  o 412.4138 4.597802 508.4619  129.2 -13.51038      9.195603 0.97 
1 1 1 -30 2  10 o 571.5005 5.795245 777.3501  170.2 1.133057       11.59049 0.99 
1 1 1 -30 2  11 o 221.2469 4.827718 265.6175  236.9 6.579605       9.655437 0.90 
1 1 1 -30 2  12 o 531.7681 5.587121 597.2507  58.6  -73.09692      11.17424 0.98 
1 1 1 -30 2  13 o 742.0325 6.788867 984.9177  62.4  -13.02814      13.57773 0.99 
1 1 1 -30 2  14 o 351.2272 4.108899 351.0899  99.4  17.25064       8.217797 0.95 
1 1 1 -30 2  15 f 225.1627 3.078881 301.8438  163.6 38.48254       6.157763 0.00 
1 1 1 -30 2  16 o 422.7096 4.445179 465.3005  62.2  -35.62509      8.890357 0.97 
1 1 1 -30 2  17 o 197.9117 3.352690 218.8098  126.1 0.3613281      6.705379 0.89 
1 1 1 -30 2  18 o 371.4522 4.715816 454.6631  239.4 19.83185       9.431633 0.98 
1 1 1 -30 2  19 o 276.2294 3.522953 426.8246  154.0 35.37775       7.045906 0.97 
1 1 1 -30 2  20 o 252.1026 3.129832 351.9790  144.1 -61.76564      6.259664 0.97 
1 1 1 -30 2  21 o 303.6103 3.472793 561.3642  305.9 48.54486       6.945586 0.99 
1 1 1 -30 2  22 o 267.6782 3.396967 395.5773  240.7 42.19966       6.793934 0.98 
1 1 1 -30 2  23 o 109.0203 3.643512 136.4237  290.7 -8.892769      7.287024 0.87 
1 1 1 -30 2  24 o 182.1743 3.222953 247.3217  129.3 5.392746       6.445906 0.97 
1 1 1 -30 2  25 o 161.3690 3.992592 279.4256  219.6 -8.597290      7.985183 0.98 
1 1 1 -30 2  26 o 112.0907 4.399552 107.7805  67.4  -11.93873      8.799105 0.92 
1 1 1 -30 2  27 o 170.0877 3.472670 228.0029  270.9 15.46292       6.945341 0.98 
1 1 1 -30 2  28 o 271.5538 3.543715 416.6304  252.9 21.91318       7.087430 0.99 
1 1 1 -30 2  29 o 152.1612 3.949807 231.6262  343.8 -1.703079      7.899615 0.98 
1 1 1 -30 2  30 o 136.4133 4.003758 147.1337  63.3  16.65608       8.007516 0.96 
1 1 1 -30 2  31 o 47.94501 8.810002 99.12241  221.3 -5.684780      17.62000 0.81 
1 1 1 -30 2  32 o 156.9589 6.548012 217.3692  217.0 0.6723022      13.09602 0.98 
1 1 1 -30 2  33 o 85.40047 5.623568 117.9474  203.1 14.09529       11.24714 0.95 
1 1 1 -30 2  34 o 23.51427 7.721923 38.15238  332.4 -6.838943      15.44385 0.50 
1 1 1 -30 2  35 o 34.65292 9.944933 83.27535  42.1  -11.15580      19.88987 0.84 
1 1 1 -30 2  36 o 49.30470 10.41969 54.20243  93.8  3.424286       20.83939 0.83 
1 1 1 -30 2  37 o 108.8555 5.980699 128.6377  220.8 ?              ?        0.98 
1 1 1 -30 4  1  o 486.8680 4.856925 806.6937  43.7  -9.240356      9.713850 0.98 
1 1 1 -30 4  2  o 459.8810 4.528222 506.5970  193.9 -23.50247      9.056444 0.97 
1 1 1 -30 4  3  o 218.7010 3.184777 304.6983  143.9 -32.25905      6.369554 0.91 
1 1 1 -30 4  4  o 377.1735 3.832160 572.4750  118.9 -43.45529      7.664320 0.97 
1 1 1 -30 4  5  o 193.9163 2.834524 178.5150  71.2  49.09724       5.669047 0.86 
1 1 1 -30 4  6  o 669.0085 5.520823 610.8629  339.4 0.5691528      11.04165 0.99 
1 1 1 -30 4  7  o 153.6735 4.051512 321.6963  108.9 ?              ?        0.86 
1 1 1 -30 4  8  o 416.9593 5.286943 408.4278  256.3 3.757050       10.57389 0.97 
1 1 1 -30 4  9  o 593.2577 5.849070 954.4904  300.3 50.41022       11.69814 0.99 
1 1 1 -30 4  10 o 183.8334 3.684186 331.4431  59.1  1.463348       7.368373 0.90 
1 1 1 -30 4  11 o 64.34221 6.028301 249.4996  150.9 7.735386       12.05660 0.48 
1 1 1 -30 4  12 o 605.9212 5.843018 1092.885  108.2 -12.77087      11.68604 0.99 
1 1 1 -30 4  13 o 98.04826 3.850829 63.79375  129.5 8.702400       7.701659 0.29 
1 1 1 -30 4  14 o 606.5051 7.038860 947.9731  130.0 11.38312       14.07772 0.99 
1 1 1 -30 4  15 o 121.3812 4.018794 85.78300  204.6 -17.26746      8.037587 0.46 
1 1 1 -30 4  16 o 111.5560 4.229904 380.4824  259.2 6.543907       8.459807 0.90 
1 1 1 -30 4  17 o 141.5558 3.146289 156.7464  33.3  26.02751       6.292579 0.82 
1 1 1 -30 4  18 o 375.6976 3.992615 506.6659  67.9  9.791290       7.985230 0.99 
1 1 1 -30 4  19 o 69.74844 5.204269 57.68363  67.9  25.65491       10.40854 0.49 
1 1 1 -30 4  20 o 298.3246 3.651350 477.1764  313.2 34.71552       7.302701 0.99 
1 1 1 -30 4  21 o 207.3127 3.338584 408.5144  284.8 24.40050       6.677169 0.98 
1 1 1 -30 4  22 o 54.71618 7.575112 177.6329  273.0 -19.82257      15.15022 0.81 
1 1 1 -30 4  23 o 152.0998 3.120083 254.3324  41.2  5.317291       6.240167 0.97 
1 1 1 -30 4  24 o 86.75562 5.474678 181.9114  37.1  -8.837944      10.94936 0.93 
1 1 1 -30 4  25 o 152.6156 3.637133 209.9571  321.1 24.12436       7.274266 0.97 
1 1 1 -30 4  26 o 101.6785 4.388572 154.7401  356.2 7.829414       8.777144 0.95 
1 1 1 -30 4  27 o 31.16718 8.970414 60.34237  256.6 -3.066109      17.94083 0.56 
1 1 1 -30 4  28 o 89.62029 5.283990 110.6205  101.6 -16.14034      10.56798 0.93 
1 1 1 -30 4  29 o 115.7700 4.727836 171.0863  70.5  -5.371086      9.455671 0.96 
1 1 1 -30 4  30 o 36.81853 8.853447 42.52499  35.5  24.23308       17.70689 0.44 
1 1 1 -30 4  31 o 62.48491 7.672472 64.11742  269.1 -25.89410      15.34494 0.81 
1 1 1 -30 4  32 o 136.4957 4.729573 160.1911  293.4 -2.728470      9.459146 0.98 
1 1 1 -30 4  33 o 99.30185 5.620831 99.66350  163.4 22.84026       11.24166 0.96 
1 1 1 -30 4  34 o 113.1096 5.716853 190.1434  132.1 10.95817       11.43371 0.98 
1 1 1 -30 4  35 o 35.62001 9.362899 71.86032  48.1  -23.06386      18.72580 0.83 
1 1 1 -30 4  36 o 69.08252 9.033461 88.50713  55.0  ?              ?        0.94 
1 1 1 -30 6  1  o 143.0074 2.856573 140.8307  62.0  -58.81602      5.713145 0.68 
1 1 1 -30 6  2  o 176.9856 3.116369 87.92937  35.9  -37.12695      6.232738 0.53 
1 1 1 -30 6  3  o 488.8535 3.854387 778.6455  169.3 -51.28534      7.708774 0.99 
1 1 1 -30 6  4  o 220.1987 2.975834 156.6130  278.0 40.89449       5.951668 0.79 
1 1 1 -30 6  5  f 121.6122 3.146594 310.6627  306.9 8.636993       6.293187 0.00 
1 1 1 -30 6  6  o 111.2145 3.269484 351.8727  33.8  -37.87712      6.538968 0.84 
1 1 1 -30 6  7  o 147.3881 3.356748 191.5967  77.8  -46.52033      6.713496 0.78 
1 1 1 -30 6  8  o 394.2818 4.725192 585.5783  206.3 17.69220       9.450384 0.98 
1 1 1 -30 6  9  o 212.3615 3.321697 389.9388  97.8  9.280258       6.643394 0.94 
1 1 1 -30 6  10 o 289.7075 4.081294 317.8139  34.1  -21.50906      8.162587 0.95 
1 1 1 -30 6  11 o 323.2672 5.255207 393.8797  190.7 ?              ?        0.96 
1 1 1 -30 6  12 o 136.7041 3.367124 237.5910  345.9 -52.12369      6.734249 0.85 
1 1 1 -30 6  13 o 233.1958 3.561268 414.3383  111.2 -7.088150      7.122535 0.97 
1 1 1 -30 6  14 o 221.3637 3.850963 333.3871  205.7 -9.079193      7.701926 0.96 
1 1 1 -30 6  15 o 237.6747 4.864953 327.7646  276.3 ?              ?        0.97 
1 1 1 -30 6  16 o 105.6618 4.238150 242.2135  323.7 -60.78070      8.476299 0.92 
1 1 1 -30 6  17 o 64.44572 5.509702 149.8678  154.7 16.33176       11.01940 0.81 
1 1 1 -30 6  18 o 152.5677 3.428414 116.2965  24.5  -31.88164      6.856828 0.91 
1 1 1 -30 6  19 o 109.5950 4.521156 175.1353  337.5 -7.673553      9.042313 0.91 
1 1 1 -30 6  20 o 69.50710 5.295100 86.94930  76.0  13.89501       10.59020 0.72 
1 1 1 -30 6  21 o 177.3508 3.171499 217.0871  80.5  24.67506       6.342999 0.97 
1 1 1 -30 6  22 o 124.7923 3.865645 143.3227  126.0 2.655106       7.731290 0.94 
1 1 1 -30 6  23 o 134.7768 3.737847 242.6891  203.0 22.56191       7.475693 0.97 
1 1 1 -30 6  24 o 259.9352 3.573047 413.7066  352.5 -16.29031      7.146095 0.99 
1 1 1 -30 6  25 o 65.34182 8.808115 104.9660  79.6  -10.96870      17.61623 0.89 
1 1 1 -30 6  26 o 117.7907 4.670192 192.8776  139.9 9.412796       9.340384 0.97 
1 1 1 -30 6  27 o 93.92438 5.580148 129.8801  37.3  -3.338707      11.16030 0.94 
1 1 1 -30 6  28 o 224.0245 4.192059 321.1846  8.0   -9.736755      8.384118 0.99 
1 1 1 -30 6  29 o 65.35931 8.209050 97.96017  276.2 9.835754       16.41810 0.88 
1 1 1 -30 6  30 o 64.42532 9.575862 70.04277  277.8 4.172230       19.15172 0.85 
1 1 1 -30 6  31 o 38.07671 10.42271 61.06106  305.3 0.7807808      20.84542 0.74 
1 1 1 -30 6  32 o 68.49816 9.020202 91.08091  95.2  39.03621       18.04040 0.93 
1 1 1 -30 6  33 o 37.87128 10.69796 50.25355  23.9  8.587887       21.39591 0.73 
1 1 1 -30 6  34 o 40.14611 12.64148 18.82627  56.3  -20.27422      25.28296 0.40 
1 1 1 -30 6  35 o 67.33682 9.895011 84.77499  314.5 ?              ?        0.94 
1 1 1 -30 8  1  o 41.69205 7.082143 86.85902  312.3 6.478741       14.16429 0.44 
1 1 1 -30 8  2  o 107.0140 3.920091 188.0160  95.4  -6.201050      7.840182 0.88 
1 1 1 -30 8  3  o 293.9226 3.180073 423.0822  18.7  -0.7645569     6.360147 0.98 
1 1 1 -30 8  4  o 307.5773 5.105370 558.7112  17.3  -5.196106      10.21074 0.99 
1 1 1 -30 8  5  o 63.88668 4.881790 102.4781  95.9  6.739998       9.763579 0.56 
1 1 1 -30 8  6  o 244.8294 3.042218 347.9278  281.2 17.78769       6.084435 0.97 
1 1 1 -30 8  7  o 255.9118 3.261274 390.1754  217.6 2.639069       6.522547 0.98 
1 1 1 -30 8  8  f 282.2687 3.700196 522.8383  150.3 11.61929       7.400392 0.00 
1 1 1 -30 8  9  o 276.6232 4.062834 420.8975  98.5  -8.034851      8.125669 0.98 
1 1 1 -30 8  10 o 63.71426 5.297353 166.4418  223.4 -13.90970      10.59471 0.80 
1 1 1 -30 8  11 o 175.9121 3.017224 279.7219  234.0 3.828705       6.034448 0.97 
1 1 1 -30 8  12 o 130.9054 3.543349 293.7766  174.0 22.12699       7.086698 0.96 
1 1 1 -30 8  13 o 223.1254 3.419288 380.1228  233.9 7.654404       6.838575 0.98 
1 1 1 -30 8  14 o 86.25781 4.918126 99.12291  111.3 7.014702       9.836251 0.79 
1 1 1 -30 8  15 o 133.8452 3.630003 268.6786  155.2 -6.016205      7.260007 0.96 
1 1 1 -30 8  16 o 146.1355 3.738354 285.2990  156.1 -24.28406      7.476708 0.96 
1 1 1 -30 8  17 f 239.0875 3.418760 499.2934  226.5 -6.674591      6.837519 0.00 
1 1 1 -30 8  18 o 81.99818 5.113309 89.81691  74.7  7.354950       10.22662 0.84 
1 1 1 -30 8  19 o 100.8330 4.633979 195.7542  324.1 9.057243       9.267959 0.95 
1 1 1 -30 8  20 o 204.5693 3.284402 321.3672  306.7 -5.322601      6.568803 0.99 
1 1 1 -30 8  21 o 96.73398 4.955049 212.4999  120.6 -8.195274      9.910098 0.96 
1 1 1 -30 8  22 o 152.1109 3.885186 258.2698  91.7  -29.08141      7.770372 0.98 
1 1 1 -30 8  23 o 81.60158 8.276640 127.2262  156.7 -35.48317      16.55328 0.94 
1 1 1 -30 8  24 o 226.6045 4.840023 332.9576  245.1 -0.4761505     9.680046 0.99 
1 1 1 -30 8  25 o 291.2391 4.100666 430.4848  283.2 -9.548035      8.201331 0.99 
1 1 1 -30 8  26 o 48.51539 10.18772 117.7878  70.2  -7.486958      20.37544 0.84 
1 1 1 -30 8  27 o 44.39236 10.22534 81.84829  195.4 -6.589367      20.45068 0.76 
1 1 1 -30 8  28 o 82.40837 8.648243 168.7105  167.9 -2.596321      17.29649 0.96 
1 1 1 -30 8  29 o 67.38230 10.40369 138.4942  209.8 21.34783       20.80738 0.94 
1 1 1 -30 8  30 o 48.98988 10.84571 97.56076  183.9 -9.146351      21.69141 0.91 
1 1 1 -30 8  31 o 38.51875 11.13385 82.56223  88.8  8.649151       22.26769 0.85 
1 1 1 -30 8  32 o 34.01919 10.23300 51.51168  247.5 12.13227       20.46601 0.73 
1 1 1 -30 8  33 o 34.08934 10.44864 43.62291  227.5 ?              ?        0.71 
1 1 1 -30 10 1  o 240.5434 3.063521 421.7108  320.1 38.69348       6.127042 0.99 
1 1 1 -30 10 2  o 81.34456 5.347509 121.6042  306.0 12.25570       10.69502 0.86 
1 1 1 -30 10 3  o 259.8217 3.130947 503.7652  164.1 -7.254608      6.261894 0.99 
1 1 1 -30 10 4  o 180.7235 3.192827 235.9523  95.1  28.80492       6.385654 0.97 
1 1 1 -30 10 5  o 136.0984 3.235723 207.3423  351.6 24.17860       6.471445 0.95 
1 1 1 -30 10 6  o 202.8111 4.051254 341.5211  328.0 18.38916       8.102509 0.98 
1 1 1 -30 10 7  o 230.6957 4.163921 395.2065  273.5 ?              ?        0.99 
1 1 1 -30 10 8  o 100.8939 4.480745 184.1131  88.0  1.541801       8.961490 0.93 
1 1 1 -30 10 9  o 71.70079 4.844460 109.7240  75.9  -2.780090      9.688920 0.83 
1 1 1 -30 10 10 o 183.9702 3.533712 239.9212  258.2 -37.31342      7.067425 0.97 
1 1 1 -30 10 11 o 182.5171 3.131799 292.2674  265.8 23.09709       6.263598 0.98 
1 1 1 -30 10 12 o 65.73751 6.049116 122.3458  295.7 -1.457123      12.09823 0.87 
1 1 1 -30 10 13 o 193.0285 3.220636 344.5365  44.5  17.85974       6.441273 0.99 
1 1 1 -30 10 14 o 152.7430 3.271967 344.4385  39.9  -26.47844      6.543935 0.98 
1 1 1 -30 10 15 o 22.28677 7.476295 34.59845  23.2  9.011627       14.95259 0.21 
1 1 1 -30 10 16 o 250.7148 3.326494 477.4339  231.3 -23.82883      6.652989 0.99 
1 1 1 -30 10 17 o 41.28314 9.303073 63.98524  141.5 3.366646       18.60615 0.63 
1 1 1 -30 10 18 o 55.72285 7.832796 130.5832  344.0 -30.91302      15.66559 0.90 
1 1 1 -30 10 19 o 257.2347 3.520382 427.1612  298.1 -32.40083      7.040764 1.00 
1 1 1 -30 10 20 o 62.52815 8.451936 72.95316  271.0 -43.52111      16.90387 0.85 
1 1 1 -30 10 21 o 140.6697 4.256298 249.7876  78.1  8.284744       8.512595 0.98 
1 1 1 -30 10 22 o 78.29147 6.864779 169.6612  34.2  -2.009399      13.72956 0.94 
1 1 1 -30 10 23 o 170.6887 3.922530 241.8459  227.7 -13.07698      7.845061 0.98 
1 1 1 -30 10 24 o 114.4175 6.237196 221.1131  154.4 -28.06626      12.47439 0.97 
1 1 1 -30 10 25 o 66.22755 10.09711 113.3867  342.7 -29.31707      20.19421 0.92 
1 1 1 -30 10 26 o 26.93053 9.083091 41.77382  65.9  9.930428       18.16618 0.51 
1 1 1 -30 10 27 o 120.0811 6.513853 244.5005  113.5 2.043076       13.02771 0.99 
1 1 1 -30 10 28 o 42.91895 11.00570 14.06416  49.7  -9.802597      22.01141 0.35 
1 1 1 -30 10 29 o 46.77988 14.55126 24.22517  343.5 1.680702       29.10251 0.50 
1 1 1 -30 10 30 o 35.61816 11.86541 70.85764  143.6 11.84482       23.73082 0.82 
1 1 1 -30 10 31 o 46.36765 14.12521 72.44206  225.3 ?              ?        0.86 
1 1 1 -30 12 1  o 82.90132 5.606867 106.6920  3.9   -20.89684      11.21373 0.93 
1 1 1 -30 12 2  o 163.0056 3.433923 266.4199  282.4 0.000000       6.867847 0.99 
1 1 1 -30 12 3  o 118.7450 4.184639 230.8602  8.5   -0.1738739     8.369277 0.98 
1 1 1 -30 12 4  o 165.4052 3.769890 242.2332  307.2 -52.92596      7.539780 0.98 
1 1 1 -30 12 5  f 128.8945 3.923103 189.4150  348.5 -27.87822      7.846205 0.00 
1 1 1 -30 12 6  o 238.8099 3.452888 367.6743  7.4   6.195572       6.905777 0.99 
1 1 1 -30 12 7  o 32.63890 9.255447 28.63441  324.2 4.037701       18.51089 0.32 
1 1 1 -30 12 8  o 37.97296 9.534358 86.50816  343.3 -15.70082      19.06872 0.75 
1 1 1 -30 12 9  o 68.45633 9.036119 124.0887  161.3 25.14867       18.07224 0.92 
1 1 1 -30 12 10 o 40.28642 8.413788 84.74402  148.0 -25.47489      16.82758 0.79 
1 1 1 -30 12 11 o 30.19647 9.652994 16.82311  0.4   8.708652       19.30599 0.21 
1 1 1 -30 12 12 o 114.6736 6.082048 283.7778  40.2  -12.33758      12.16410 0.98 
1 1 1 -30 12 13 o 98.24834 5.884455 186.6653  52.1  ?              ?        0.97 
1 1 1 -30 12 14 o 169.9550 5.332266 362.8225  152.1 -15.36716      10.66453 0.99 
1 1 1 -30 12 15 f 110.4348 6.091025 233.4932  138.3 -10.74775      12.18205 0.00 
1 1 1 -30 12 16 o 69.66492 6.581053 154.7432  225.4 3.369972       13.16211 0.93 
1 1 1 -30 12 17 o 93.09231 5.656253 167.7659  157.6 -6.765747      11.31251 0.95 
1 1 1 -30 12 18 o 124.3419 4.378258 186.6479  352.6 19.09256       8.756516 0.97 
1 1 1 -30 12 19 o 127.9137 4.368354 241.5676  30.2  -6.066666      8.736709 0.98 
1 1 1 -30 12 20 o 86.21378 6.218015 163.2503  40.4  -10.99833      12.43603 0.96 
1 1 1 -30 12 21 o 73.01570 6.859724 103.9852  247.9 11.44495       13.71945 0.93 
1 1 1 -30 12 22 o 86.92677 6.243954 147.7322  180.8 5.508064       12.48791 0.97 
1 1 1 -30 12 23 o 69.01907 9.373240 90.51598  67.6  -30.63568      18.74648 0.93 
1 1 1 -30 12 24 o 80.83158 8.484010 164.8580  340.6 -12.70212      16.96802 0.97 
1 1 1 -30 12 25 o 34.32900 10.11570 38.94848  103.6 7.208956       20.23140 0.65 
1 1 1 -30 12 26 o 86.02940 9.788434 165.6874  127.8 -35.98373      19.57687 0.97 
1 1 1 -30 12 27 o 51.91006 12.51509 71.21959  128.2 ?              ?        0.88 
1 1 1 -30 12 28 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -30 14 1  o 56.42252 9.419488 71.32268  99.9  14.02871       18.83898 0.82 
1 1 1 -30 14 2  o 141.3851 4.272188 220.0200  58.0  8.766678       8.544376 0.98 
1 1 1 -30 14 3  o 89.50619 6.178785 121.6180  8.3   7.544449       12.35757 0.94 
1 1 1 -30 14 4  o 71.81537 7.879813 127.6753  231.2 51.95873       15.75963 0.93 
1 1 1 -30 14 5  o 132.9952 4.518988 231.6687  93.2  -12.30256      9.037975 0.98 
1 1 1 -30 14 6  o 145.5589 4.502889 270.3118  63.9  5.640259       9.005778 0.98 
1 1 1 -30 14 7  o 33.81978 9.745964 73.21760  300.4 -3.096386      19.49193 0.68 
1 1 1 -30 14 8  o 70.97578 7.105029 87.14065  57.2  21.57717       14.21006 0.90 
1 1 1 -30 14 9  o 175.8704 5.314719 258.1090  84.8  0.6458588      10.62944 0.99 
1 1 1 -30 14 10 o 97.06950 9.285940 157.0164  135.4 -39.02538      18.57188 0.96 
1 1 1 -30 14 11 o 29.69467 10.17144 10.49374  298.3 16.83209       20.34288 0.13 
1 1 1 -30 14 12 o 56.85895 10.29658 110.4324  300.2 -29.56998      20.59317 0.90 
1 1 1 -30 14 13 o 57.00971 12.04228 51.21392  289.6 -0.9811287     24.08457 0.77 
1 1 1 -30 14 14 o 87.94426 9.663098 146.5011  43.6  7.477448       19.32620 0.96 
1 1 1 -30 14 15 o 83.28651 10.62120 182.4161  308.6 -10.52112      21.24240 0.97 
1 1 1 -30 14 16 o 103.8810 11.11172 180.0802  304.7 -10.01931      22.22344 0.98 
1 1 1 -30 14 17 o 52.50376 11.17776 44.82477  156.5 -10.71268      22.35552 0.80 
1 1 1 -30 14 18 o 62.34077 10.77003 120.8487  286.6 -34.17374      21.54006 0.95 
1 1 1 -30 14 19 o 76.30121 11.59254 134.5815  256.3 -45.19666      23.18509 0.96 
1 1 1 -30 14 20 o 22.53778 9.613085 59.43785  183.7 ?              ?        0.67 
1 1 1 -30 14 21 o 48.18011 10.45985 103.8897  90.7  -12.56512      20.91971 0.92 
1 1 1 -30 14 22 o 54.37906 10.80587 133.9434  90.2  7.310211       21.61173 0.95 
1 1 1 -30 14 23 o 29.83811 11.83304 34.05636  28.1  ?              ?        0.57 
1 1 1 -30 16 1  o 82.04324 8.865463 142.1636  122.9 -15.51660      17.73093 0.97 
1 1 1 -30 16 2  o 29.89041 9.655145 63.99658  112.6 -3.273443      19.31029 0.78 
1 1 1 -30 16 3  o 52.66649 10.91643 22.04131  170.0 6.863983       21.83287 0.60 
1 1 1 -30 16 4  o 79.35614 9.312084 172.7388  164.0 -29.52863      18.62417 0.97 
1 1 1 -30 16 5  o 35.17544 10.18581 39.01255  91.7  -3.414219      20.37162 0.67 
1 1 1 -30 16 6  o 53.62894 10.09748 133.3673  347.9 -30.21367      20.19497 0.95 
1 1 1 -30 16 7  o 71.28667 9.517780 135.1777  271.7 -0.5041656     19.03556 0.96 
1 1 1 -30 16 8  o 161.6307 5.142018 270.3651  238.6 6.707367       10.28404 0.99 
1 1 1 -30 16 9  o 65.67603 11.62951 132.6123  224.9 -30.39986      23.25903 0.95 
1 1 1 -30 16 10 o 35.81030 11.45730 67.89933  228.7 -2.608124      22.91461 0.82 
1 1 1 -30 16 11 o 43.82327 12.53248 23.76771  72.0  30.11717       25.06495 0.53 
1 1 1 -30 16 12 o 36.31182 11.27003 33.33339  247.5 -1.545532      22.54005 0.62 
1 1 1 -30 16 13 o 41.47713 10.51833 79.15115  329.0 -19.60911      21.03665 0.89 
1 1 1 -30 16 14 o 31.16123 13.05726 67.63993  74.8  ?              ?        0.78 
1 1 1 -30 16 15 o 33.37745 11.45024 21.91857  139.5 ?              ?        0.46 
1 1 1 -30 16 16 o 30.74288 10.58330 49.48310  178.0 ?              ?        0.75 
1 1 1 -29 1  1  o 569.7151 5.228721 807.0436  265.4 30.93799       10.45744 0.99 
1 1 1 -29 1  2  o 295.5378 3.517256 455.9131  90.0  -44.27448      7.034511 0.94 
1 1 1 -29 1  3  o 96.88022 6.793831 247.7733  46.7  ?              ?        0.19 
1 1 1 -29 1  4  o 1166.651 10.22092 1725.306  236.8 16.05103       20.44185 1.00 
1 1 1 -29 1  5  o 475.6366 6.233690 758.3870  260.7 -10.14734      12.46738 0.97 
1 1 1 -29 1  6  o 351.0548 4.641450 520.0336  148.2 13.55646       9.282900 0.96 
1 1 1 -29 1  7  o 1029.248 11.29506 1504.184  348.1 -14.61078      22.59012 1.00 
1 1 1 -29 1  8  o 548.4370 6.975706 774.6682  130.0 19.61481       13.95141 0.98 
1 1 1 -29 1  9  o 1009.839 10.77298 1505.139  122.5 20.23444       21.54596 1.00 
1 1 1 -29 1  10 o 206.8823 4.241487 193.0561  12.3  -30.23514      8.482973 0.87 
1 1 1 -29 1  11 o 673.2242 6.365307 1026.202  261.1 27.94073       12.73061 0.99 
1 1 1 -29 1  12 o 387.6635 4.593742 526.0595  53.6  -39.60989      9.187485 0.97 
1 1 1 -29 1  13 o 634.7380 6.041564 1076.293  71.4  37.54297       12.08313 0.99 
1 1 1 -29 1  14 o 281.7062 5.211651 292.8247  44.8  43.15106       10.42330 0.92 
1 1 1 -29 1  15 o 257.7617 3.376088 405.8556  348.4 -54.84998      6.752176 0.92 
1 1 1 -29 1  16 o 198.2162 3.188668 429.1636  65.7  -13.22878      6.377337 0.93 
1 1 1 -29 1  17 o 442.0921 5.907429 615.2910  194.0 -40.18433      11.81486 0.98 
1 1 1 -29 1  18 o 125.7406 3.117238 243.4341  326.2 19.63509       6.234476 0.85 
1 1 1 -29 1  19 o 334.6512 3.631611 366.4376  345.4 -41.34116      7.263222 0.97 
1 1 1 -29 1  20 o 89.26479 3.771440 240.1388  228.0 34.81346       7.542881 0.86 
1 1 1 -29 1  21 o 108.0145 3.330681 161.5619  207.3 -13.08574      6.661362 0.87 
1 1 1 -29 1  22 o 37.85354 7.947704 84.46910  23.0  -4.562397      15.89541 0.40 
1 1 1 -29 1  23 o 235.4325 3.241693 383.9099  306.5 -26.67401      6.483386 0.98 
1 1 1 -29 1  24 o 136.3199 4.522670 194.1481  327.2 -7.424011      9.045340 0.94 
1 1 1 -29 1  25 o 101.9333 4.234230 176.9332  144.9 51.86021       8.468460 0.93 
1 1 1 -29 1  26 f 68.93742 4.936146 157.8768  237.9 18.24828       9.872292 0.00 
1 1 1 -29 1  27 o 224.9120 3.339647 319.2726  208.7 -15.90460      6.679295 0.99 
1 1 1 -29 1  28 o 74.35252 6.258166 95.32258  166.0 23.07010       12.51633 0.89 
1 1 1 -29 1  29 o 167.2195 5.741632 217.1391  354.9 -16.64735      11.48326 0.98 
1 1 1 -29 1  30 o 186.8542 3.835891 205.5368  3.2   11.25157       7.671783 0.98 
1 1 1 -29 1  31 o 60.01020 8.106266 117.0459  279.5 -35.87609      16.21253 0.87 
1 1 1 -29 1  32 o 65.44591 8.449556 56.26677  158.8 37.73304       16.89911 0.78 
1 1 1 -29 1  33 o 161.0139 4.045965 166.9817  46.1  -4.430664      8.091930 0.98 
1 1 1 -29 1  34 o 75.51611 8.187954 58.23592  325.0 10.25787       16.37591 0.90 
1 1 1 -29 1  35 o 95.24498 6.255075 90.13465  352.0 -28.17912      12.51015 0.96 
1 1 1 -29 1  36 o 103.1993 5.860213 95.33955  86.7  11.85626       11.72043 0.96 
1 1 1 -29 1  37 o 101.3421 6.672314 122.0536  195.8 ?              ?        0.98 
1 1 1 -29 3  1  o 371.7376 3.877326 397.6604  331.2 16.77789       7.754652 0.97 
1 1 1 -29 3  2  o 414.4652 4.221234 484.6084  134.3 11.61456       8.442468 0.97 
1 1 1 -29 3  3  o 69.10419 5.883108 226.1690  71.2  -48.85851      11.76622 0.43 
1 1 1 -29 3  4  o 430.9142 4.161927 540.2685  14.0  -58.77994      8.323853 0.97 
1 1 1 -29 3  5  f 315.8667 4.829365 502.3750  309.4 36.66443       9.658730 0.00 
1 1 1 -29 3  6  o 574.1576 5.523371 802.6776  53.2  -6.154541      11.04674 0.98 
1 1 1 -29 3  7  o 730.8181 6.715335 1037.230  93.7  81.04382       13.43067 0.99 
1 1 1 -29 3  8  o 643.7719 6.054259 811.6406  349.4 -83.63263      12.10852 0.99 
1 1 1 -29 3  9  o 379.2533 4.297642 580.1429  214.7 13.13556       8.595284 0.97 
1 1 1 -29 3  10 o 280.8753 3.682036 446.1070  70.4  7.118683       7.364072 0.94 
1 1 1 -29 3  11 o 445.6349 4.731102 795.7050  316.5 -59.70401      9.462204 0.98 
1 1 1 -29 3  12 o 204.0360 3.422149 275.0462  152.6 2.225037       6.844299 0.89 
1 1 1 -29 3  13 o 337.8468 3.728780 429.7878  281.3 -36.13867      7.457559 0.96 
1 1 1 -29 3  14 o 223.1710 3.357136 289.5569  132.0 39.43616       6.714272 0.89 
1 1 1 -29 3  15 o 21.48207 6.555305 32.97523  341.5 -9.268534      13.11061 0.05 
1 1 1 -29 3  16 o 318.9038 3.504552 402.3045  157.2 -14.00598      7.009103 0.96 
1 1 1 -29 3  17 o 336.6349 3.792631 469.9128  278.4 -3.483276      7.585262 0.97 
1 1 1 -29 3  18 o 127.6971 3.072205 218.1818  354.7 -22.87721      6.144410 0.86 
1 1 1 -29 3  19 o 486.3728 4.651157 629.4363  203.6 40.54333       9.302315 0.99 
1 1 1 -29 3  20 o 122.7826 3.229901 175.4963  198.6 10.29659       6.459801 0.90 
1 1 1 -29 3  21 o 318.3928 3.384741 428.7553  47.7  26.82346       6.769481 0.99 
1 1 1 -29 3  22 o 109.8439 3.619551 244.9130  163.5 -17.98175      7.239101 0.94 
1 1 1 -29 3  23 o 82.89706 4.341709 138.8162  133.0 24.20731       8.683418 0.86 
1 1 1 -29 3  24 o 211.4628 3.207834 250.7440  213.3 23.39198       6.415668 0.98 
1 1 1 -29 3  25 o 35.50580 8.959349 29.18333  137.3 6.343033       17.91870 0.24 
1 1 1 -29 3  26 o 247.4537 3.542819 349.7231  76.8  -8.391495      7.085638 0.99 
1 1 1 -29 3  27 o 54.36145 8.061734 122.6879  326.0 -4.590656      16.12347 0.87 
1 1 1 -29 3  28 o 70.47788 5.881443 144.5109  247.5 22.76117       11.76289 0.94 
1 1 1 -29 3  29 o 261.7821 3.672440 359.1069  288.1 23.00203       7.344880 0.99 
1 1 1 -29 3  30 o 60.80957 7.694295 67.05989  281.2 19.11514       15.38859 0.75 
1 1 1 -29 3  31 o 192.2631 3.745018 307.0387  198.1 -17.26938      7.490035 0.99 
1 1 1 -29 3  32 o 107.8754 5.568352 176.3371  255.9 38.52807       11.13670 0.97 
1 1 1 -29 3  33 o 88.68317 8.686988 128.4456  175.1 -54.20929      17.37398 0.96 
1 1 1 -29 3  34 f 91.12384 6.797865 142.2399  134.3 13.13976       13.59573 0.00 
1 1 1 -29 3  35 o 44.21596 10.42678 22.28191  252.0 1.446594       20.85355 0.50 
1 1 1 -29 3  36 o 65.76479 9.093014 58.26970  300.2 12.94018       18.18603 0.90 
1 1 1 -29 5  1  o 271.1761 2.958086 377.4265  115.6 -12.72333      5.916173 0.94 
1 1 1 -29 5  2  o 426.3463 3.666834 482.8673  194.9 -2.555206      7.333668 0.97 
1 1 1 -29 5  3  o 586.5034 5.129134 782.9944  128.7 -113.9211      10.25827 0.99 
1 1 1 -29 5  4  o 90.74335 3.510985 143.0659  32.5  27.14297       7.021970 0.36 
1 1 1 -29 5  5  o 78.23676 4.953258 18.22440  228.5 -23.19729      9.906515 0.13 
1 1 1 -29 5  6  o 135.8185 4.197574 78.68651  186.0 42.71186       8.395148 0.58 
1 1 1 -29 5  7  o 256.3788 4.179364 342.7435  262.3 83.05060       8.358727 0.91 
1 1 1 -29 5  8  o 71.08395 4.884580 158.0154  126.8 -10.75492      9.769159 0.37 
1 1 1 -29 5  9  f 121.5679 3.936209 131.2853  138.5 -49.94359      7.872419 0.00 
1 1 1 -29 5  10 o 300.1946 3.765736 411.0917  190.1 28.69846       7.531472 0.95 
1 1 1 -29 5  11 o 328.0949 5.530301 422.7956  200.0 ?              ?        0.96 
1 1 1 -29 5  12 f 302.1463 5.416499 406.7278  96.1  ?              ?        0.00 
1 1 1 -29 5  13 o 124.4664 3.718604 140.5696  339.7 24.91718       7.437208 0.70 
1 1 1 -29 5  14 o 351.9468 3.950776 523.3016  231.0 39.50357       7.901553 0.97 
1 1 1 -29 5  15 o 253.7236 3.426870 372.4072  180.4 -59.65720      6.853741 0.96 
1 1 1 -29 5  16 o 202.2393 2.985292 421.2382  206.3 -28.05161      5.970584 0.96 
1 1 1 -29 5  17 o 140.6192 4.165215 148.3914  255.9 12.73203       8.330429 0.86 
1 1 1 -29 5  18 o 58.82387 7.279809 152.4447  62.6  -36.59800      14.55962 0.73 
1 1 1 -29 5  19 o 155.1952 4.986079 253.8581  249.0 ?              ?        0.96 
1 1 1 -29 5  20 o 34.90942 8.586530 63.72875  95.8  9.339712       17.17306 0.33 
1 1 1 -29 5  21 o 73.05568 6.215028 65.95436  250.0 -33.35310      12.43006 0.58 
1 1 1 -29 5  22 o 57.75117 5.919126 85.07334  138.0 8.888580       11.83825 0.69 
1 1 1 -29 5  23 o 156.1475 3.236694 271.0543  92.7  8.094208       6.473388 0.97 
1 1 1 -29 5  24 o 110.9068 4.365544 154.8967  258.8 -9.068329      8.731089 0.94 
1 1 1 -29 5  25 o 147.3756 3.713254 297.5311  309.2 -1.589417      7.426508 0.98 
1 1 1 -29 5  26 o 277.7911 3.624097 325.0258  248.8 3.633728       7.248193 0.99 
1 1 1 -29 5  27 o 116.8796 4.699199 125.5490  214.8 -23.35207      9.398398 0.96 
1 1 1 -29 5  28 f 35.16831 9.581134 91.78046  73.2  18.99983       19.16227 0.00 
1 1 1 -29 5  29 o 161.7316 4.199361 211.7969  37.2  8.500107       8.398722 0.98 
1 1 1 -29 5  30 o 73.33614 6.887624 184.2763  351.9 -8.461494      13.77525 0.94 
1 1 1 -29 5  31 o 36.16447 10.23394 28.13731  352.4 2.605225       20.46787 0.38 
1 1 1 -29 5  32 o 94.64316 6.047245 145.5238  2.1   1.343132       12.09449 0.97 
1 1 1 -29 5  33 o 85.98111 6.736669 141.2536  313.2 20.11326       13.47334 0.97 
1 1 1 -29 5  34 f 110.7249 6.269183 106.5613  53.1  -6.798393      12.53837 0.00 
1 1 1 -29 5  35 f 61.52750 14.26580 120.9690  336.3 -4.175224      28.53161 0.00 
1 1 1 -29 5  36 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -29 7  1  o 369.7639 4.783656 532.4045  65.6  3.108795       9.567312 0.98 
1 1 1 -29 7  2  o 262.2919 3.416366 355.8836  326.5 -12.25644      6.832732 0.96 
1 1 1 -29 7  3  o 38.36695 6.836586 80.97553  338.1 -9.631882      13.67317 0.16 
1 1 1 -29 7  4  o 412.7010 3.695076 771.8605  4.3   -25.15796      7.390152 0.99 
1 1 1 -29 7  5  o 44.13374 7.434739 199.9979  128.9 -2.128815      14.86948 0.36 
1 1 1 -29 7  6  o 427.7475 4.146640 674.2721  103.5 24.71173       8.293281 0.98 
1 1 1 -29 7  7  o 165.8316 3.298564 341.8455  131.7 -0.8637238     6.597128 0.92 
1 1 1 -29 7  8  o 323.2225 3.407712 436.7476  323.5 -16.67566      6.815424 0.97 
1 1 1 -29 7  9  o 133.6721 2.964208 165.3119  354.6 2.720215       5.928415 0.81 
1 1 1 -29 7  10 o 61.69862 5.032676 146.8813  279.4 19.58010       10.06535 0.51 
1 1 1 -29 7  11 o 199.2398 4.064073 412.6445  204.6 -12.99493      8.128145 0.96 
1 1 1 -29 7  12 o 337.9189 3.843647 642.1252  86.7  3.741364       7.687295 0.99 
1 1 1 -29 7  13 o 103.5598 4.069332 204.1256  154.4 -35.78930      8.138664 0.88 
1 1 1 -29 7  14 o 242.7838 3.431833 373.1280  280.3 -13.91681      6.863665 0.98 
1 1 1 -29 7  15 o 472.8164 4.748384 803.7761  255.3 -16.24731      9.496767 1.00 
1 1 1 -29 7  16 o 98.36719 3.910244 83.09130  145.2 5.348000       7.820487 0.77 
1 1 1 -29 7  17 o 128.0102 3.613666 181.4550  273.1 -13.21973      7.227331 0.93 
1 1 1 -29 7  18 o 342.7641 3.637816 549.3541  336.1 21.12671       7.275631 0.99 
1 1 1 -29 7  19 o 249.9894 3.573552 387.4853  310.3 16.40903       7.147103 0.99 
1 1 1 -29 7  20 o 245.2727 3.345808 418.2940  274.0 -20.78392      6.691616 0.99 
1 1 1 -29 7  21 o 172.4113 3.267092 290.3032  124.4 -6.585449      6.534184 0.98 
1 1 1 -29 7  22 o 197.3029 3.512396 327.1413  103.0 -8.824478      7.024793 0.99 
1 1 1 -29 7  23 o 219.4683 3.742538 308.3908  141.0 -24.45116      7.485076 0.99 
1 1 1 -29 7  24 o 40.59023 8.603911 123.7327  51.2  -20.14137      17.20782 0.84 
1 1 1 -29 7  25 o 122.0153 4.616892 236.4106  274.5 -0.4887390E-01 9.233785 0.98 
1 1 1 -29 7  26 o 79.13770 6.143819 141.5444  284.1 31.74873       12.28764 0.93 
1 1 1 -29 7  27 o 46.35296 10.68118 82.41346  317.8 -10.60819      21.36235 0.73 
1 1 1 -29 7  28 o 59.93823 9.431683 102.6557  158.0 -28.33204      18.86337 0.87 
1 1 1 -29 7  29 o 78.15340 7.675030 108.8422  264.3 22.24952       15.35006 0.92 
1 1 1 -29 7  30 o 45.81013 9.707034 120.7571  21.9  37.63968       19.41407 0.90 
1 1 1 -29 7  31 o 47.52505 9.677689 19.60738  336.5 36.68359       19.35538 0.48 
1 1 1 -29 7  32 o 49.92962 11.34233 91.02781  98.7  6.276009       22.68466 0.90 
1 1 1 -29 7  33 o 49.78540 10.10796 80.18197  195.9 -15.24252      20.21592 0.89 
1 1 1 -29 7  34 o 30.02929 9.602068 20.64334  246.4 ?              ?        0.41 
1 1 1 -29 9  1  o 223.6725 4.200707 401.6551  238.6 -26.65744      8.401415 0.98 
1 1 1 -29 9  2  o 198.9519 3.078013 249.4099  178.6 -43.59859      6.156025 0.97 
1 1 1 -29 9  3  o 190.8806 3.029978 334.4015  86.5  -3.596069      6.059956 0.98 
1 1 1 -29 9  4  o 185.1268 4.147232 387.4269  61.1  -11.31491      8.294464 0.98 
1 1 1 -29 9  5  o 169.0912 4.644495 198.6545  254.5 -3.837158      9.288990 0.95 
1 1 1 -29 9  6  o 203.9877 3.356617 364.0967  322.0 -24.71657      6.713234 0.98 
1 1 1 -29 9  7  o 110.4383 3.118046 172.0441  167.5 13.60711       6.236093 0.92 
1 1 1 -29 9  8  o 210.6143 3.557595 285.9629  184.5 10.12057       7.115189 0.98 
1 1 1 -29 9  9  o 193.2300 3.223170 226.3523  211.4 -7.718018      6.446340 0.96 
1 1 1 -29 9  10 o 135.9080 3.149566 199.6123  205.0 -4.066879      6.299132 0.94 
1 1 1 -29 9  11 o 97.73152 3.868006 130.0986  324.1 -0.9473648     7.736012 0.88 
1 1 1 -29 9  12 o 125.9301 3.556150 313.0734  196.0 -2.711266      7.112301 0.96 
1 1 1 -29 9  13 o 36.90025 8.706904 72.91286  264.7 7.739399       17.41381 0.40 
1 1 1 -29 9  14 o 106.4150 3.989094 252.0666  6.4   3.058159       7.978188 0.95 
1 1 1 -29 9  15 o 83.01949 5.330968 127.7476  318.3 -15.09709      10.66194 0.88 
1 1 1 -29 9  16 o 57.91402 7.333899 133.8974  64.2  -15.43999      14.66780 0.85 
1 1 1 -29 9  17 o 153.9215 3.493140 306.7141  345.2 -4.601303      6.986279 0.98 
1 1 1 -29 9  18 o 30.87508 7.326055 33.20187  0.2   -17.81377      14.65211 0.27 
1 1 1 -29 9  19 o 80.04329 5.329057 83.07316  325.3 4.018486       10.65811 0.86 
1 1 1 -29 9  20 o 209.8439 3.407763 374.4727  36.1  -16.29358      6.815527 0.99 
1 1 1 -29 9  21 o 125.2739 4.498438 198.7154  90.3  -4.944687      8.996877 0.97 
1 1 1 -29 9  22 o 118.9582 4.602239 215.8618  25.4  10.34167       9.204478 0.98 
1 1 1 -29 9  23 o 77.56840 6.725601 144.4933  224.4 10.94780       13.45120 0.94 
1 1 1 -29 9  24 f 136.7251 4.788198 228.7864  257.7 8.411926       9.576397 0.00 
1 1 1 -29 9  25 o 42.95939 10.38335 50.00515  292.7 -3.845608      20.76670 0.57 
1 1 1 -29 9  26 o 104.6921 7.050259 140.1465  4.7   -0.1003342     14.10052 0.96 
1 1 1 -29 9  27 o 45.99953 11.74470 65.12397  274.4 -5.000370      23.48940 0.76 
1 1 1 -29 9  28 o 41.56136 11.32540 40.85863  275.5 6.787376       22.65081 0.64 
1 1 1 -29 9  29 o 74.11353 10.25086 83.37386  357.5 -5.577576      20.50172 0.93 
1 1 1 -29 9  30 o 43.66669 10.74877 75.51963  168.2 -21.39463      21.49755 0.86 
1 1 1 -29 9  31 o 32.14257 10.16633 77.33788  154.3 -8.311157      20.33265 0.83 
1 1 1 -29 9  32 o 40.00292 11.37383 58.05990  338.3 ?              ?        0.82 
1 1 1 -29 11 1  o 183.6496 3.155259 245.5578  262.6 -8.876480      6.310518 0.98 
1 1 1 -29 11 2  o 271.2666 3.378607 414.1471  242.9 -16.13904      6.757214 0.99 
1 1 1 -29 11 3  o 164.1473 3.074405 235.1760  178.3 -41.86975      6.148810 0.98 
1 1 1 -29 11 4  o 179.7225 3.131886 238.0684  95.6  -4.731354      6.263773 0.98 
1 1 1 -29 11 5  o 141.0648 3.209183 175.0528  167.0 8.471603       6.418365 0.96 
1 1 1 -29 11 6  o 167.6586 4.273602 253.7084  251.8 3.160538       8.547205 0.98 
1 1 1 -29 11 7  o 103.5329 4.046741 185.9863  285.0 22.27026       8.093481 0.95 
1 1 1 -29 11 8  f 141.3880 4.396256 246.3214  124.3 -41.20492      8.792512 0.00 
1 1 1 -29 11 9  o 149.7935 4.606013 224.1660  151.3 -14.62486      9.212027 0.97 
1 1 1 -29 11 10 o 91.35214 6.912859 138.8405  313.7 ?              ?        0.93 
1 1 1 -29 11 11 o 86.72292 5.396451 67.69457  271.0 -2.935417      10.79290 0.84 
1 1 1 -29 11 12 o 174.1579 4.393052 315.0023  219.8 -42.02887      8.786104 0.99 
1 1 1 -29 11 13 o 23.28425 7.472598 101.2036  253.6 3.142393       14.94520 0.58 
1 1 1 -29 11 14 o 50.81594 7.587122 72.03712  356.0 34.14250       15.17424 0.76 
1 1 1 -29 11 15 o 145.2774 3.731352 258.7335  179.7 -9.473175      7.462704 0.98 
1 1 1 -29 11 16 o 47.98753 8.193258 161.4219  202.6 -0.8596420E-01 16.38652 0.92 
1 1 1 -29 11 17 o 128.0360 4.020484 184.5461  76.6  11.64914       8.040968 0.98 
1 1 1 -29 11 18 o 80.99837 6.425824 130.0159  174.7 -13.40576      12.85165 0.94 
1 1 1 -29 11 19 o 128.2149 3.959608 218.1760  272.7 -3.819199      7.919215 0.98 
1 1 1 -29 11 20 o 25.87113 7.836246 47.85880  16.4  -0.8983040     15.67249 0.38 
1 1 1 -29 11 21 o 96.58475 5.340258 123.0655  93.1  10.47915       10.68052 0.94 
1 1 1 -29 11 22 o 52.40991 9.931743 90.07413  43.0  1.379532       19.86349 0.84 
1 1 1 -29 11 23 o 73.19269 9.056136 130.6679  305.0 -11.72698      18.11227 0.94 
1 1 1 -29 11 24 o 30.45807 9.478435 71.18734  47.9  0.4668026      18.95687 0.73 
1 1 1 -29 11 25 o 64.18707 10.41046 152.6532  103.1 -19.60912      20.82092 0.95 
1 1 1 -29 11 26 o 58.31974 11.46518 118.2766  126.6 9.999771       22.93036 0.94 
1 1 1 -29 11 27 o 67.10507 13.88221 49.33747  123.3 -12.08752      27.76442 0.84 
1 1 1 -29 11 28 o 34.00637 10.54934 27.63792  340.1 0.7478790      21.09867 0.52 
1 1 1 -29 11 29 o 43.62489 18.66530 70.81471  60.1  ?              ?        0.78 
1 1 1 -29 13 1  o 94.20111 5.425624 123.4852  291.9 -1.864632      10.85125 0.94 
1 1 1 -29 13 2  o 73.23436 6.700354 102.1511  57.3  28.05490       13.40071 0.91 
1 1 1 -29 13 3  o 195.0392 3.877490 341.1748  130.3 3.636566       7.754980 0.99 
1 1 1 -29 13 4  o 138.3790 3.967519 248.9643  223.9 23.90858       7.935037 0.98 
1 1 1 -29 13 5  o 78.07789 6.391630 153.8139  257.5 30.01166       12.78326 0.95 
1 1 1 -29 13 6  o 112.4683 5.035636 220.2934  210.2 30.86336       10.07127 0.98 
1 1 1 -29 13 7  o 235.9794 4.471107 361.4241  174.8 22.06581       8.942215 0.99 
1 1 1 -29 13 8  o 273.8406 4.335738 412.9637  112.9 20.68985       8.671476 0.99 
1 1 1 -29 13 9  o 64.69647 10.25372 142.5878  153.7 -4.668873      20.50745 0.92 
1 1 1 -29 13 10 o 40.23746 9.590395 84.89031  307.1 -13.65374      19.18079 0.75 
1 1 1 -29 13 11 o 157.0453 5.233023 270.8725  163.1 37.31529       10.46605 0.98 
1 1 1 -29 13 12 o 55.70025 8.991375 128.4764  149.7 -40.42290      17.98275 0.89 
1 1 1 -29 13 13 o 208.0235 5.101315 386.3434  327.2 -20.74753      10.20263 0.99 
1 1 1 -29 13 14 o 80.74711 10.75563 141.1468  310.2 -43.00397      21.51126 0.93 
1 1 1 -29 13 15 o 83.39969 8.359876 117.4158  105.2 -12.25834      16.71975 0.93 
1 1 1 -29 13 16 o 59.64767 10.35419 79.54632  149.3 54.59497       20.70838 0.85 
1 1 1 -29 13 17 o 46.97667 12.57408 109.1073  180.4 37.14065       25.14816 0.86 
1 1 1 -29 13 18 o 113.7171 10.85222 236.0927  338.3 -26.17979      21.70443 0.98 
1 1 1 -29 13 19 o 57.44811 12.27311 134.8772  304.1 32.04139       24.54622 0.93 
1 1 1 -29 13 20 o 45.00230 12.22785 23.00949  267.4 42.87323       24.45569 0.48 
1 1 1 -29 13 21 o 36.66604 11.98578 21.22571  310.5 37.67690       23.97156 0.42 
1 1 1 -29 13 22 o 68.75282 8.655822 127.1184  193.0 -18.23731      17.31164 0.96 
1 1 1 -29 13 23 o 54.13165 9.394214 127.4864  147.9 -14.89492      18.78843 0.95 
1 1 1 -29 13 24 o 43.38454 9.196456 50.54560  336.3 -21.50780      18.39291 0.82 
1 1 1 -29 13 25 o 62.67572 10.02206 148.5071  244.1 ?              ?        0.96 
1 1 1 -29 13 26 o 66.27595 10.37984 108.2169  186.5 ?              ?        0.95 
1 1 1 -29 15 1  o 142.5058 4.570593 189.4467  182.6 -10.81050      9.141187 0.99 
1 1 1 -29 15 2  o 34.15714 9.955563 46.30136  242.5 6.626661       19.91113 0.65 
1 1 1 -29 15 3  o 105.5808 6.022940 164.2264  352.6 34.97312       12.04588 0.98 
1 1 1 -29 15 4  o 59.71338 10.41628 126.6298  14.4  5.905396       20.83257 0.94 
1 1 1 -29 15 5  o 34.73818 10.09078 45.49783  264.9 -3.665691      20.18155 0.64 
1 1 1 -29 15 6  o 53.61169 10.21495 67.99207  185.6 -20.65211      20.42990 0.86 
1 1 1 -29 15 7  o 33.09745 9.676218 30.10752  303.8 -7.180086      19.35244 0.48 
1 1 1 -29 15 8  o 41.43173 10.71499 60.44832  317.9 30.98873       21.42998 0.79 
1 1 1 -29 15 9  o 51.81118 11.28987 141.2829  341.5 39.07302       22.57975 0.93 
1 1 1 -29 15 10 o 91.47823 11.33850 191.4317  273.8 -21.03469      22.67701 0.97 
1 1 1 -29 15 11 o 45.47713 11.26402 12.69272  162.9 -10.14270      22.52803 0.32 
1 1 1 -29 15 12 o 50.77330 9.824966 88.90395  157.3 -28.77927      19.64993 0.91 
1 1 1 -29 15 13 o 45.78516 12.02572 76.87503  348.4 -2.167503      24.05143 0.88 
1 1 1 -29 15 14 o 40.17904 11.24814 114.1330  82.4  -3.095604      22.49628 0.91 
1 1 1 -29 15 15 o 46.05878 12.43936 89.02559  246.6 -1.603321      24.87871 0.89 
1 1 1 -29 15 16 o 79.96027 12.30794 214.4915  275.0 -40.80704      24.61588 0.98 
1 1 1 -29 15 17 o 42.41928 11.64300 36.66961  104.7 3.188335       23.28600 0.69 
1 1 1 -29 15 18 o 52.22467 12.43243 139.6766  91.5  -0.3313599     24.86486 0.94 
1 1 1 -29 15 19 o 39.04869 11.70776 59.45115  244.5 12.65580       23.41551 0.82 
1 1 1 -29 15 20 o 45.95070 9.761853 94.38314  136.8 ?              ?        0.93 
1 1 1 -29 17 1  x ?        ?        84.96158  338.3 ?              ?        0.00 
1 1 1 -29 17 2  o 35.91997 10.89329 82.68845  22.8  ?              ?        0.88 
1 1 1 -29 17 3  o 42.13849 11.34357 66.36322  87.8  ?              ?        0.87 
1 1 1 -29 17 4  o 29.04367 9.319886 24.40886  44.8  ?              ?        0.51 
1 1 1 -29 17 5  o 34.63207 10.53965 75.67719  62.2  ?              ?        0.87 
1 1 1 -29 17 6  f 78.03365 9.573184 135.3317  63.0  ?              ?        0.00 
1 1 1 -29 17 7  o 37.74377 11.25684 39.87528  277.7 ?              ?        0.73 
1 1 1 -29 17 8  o 33.97924 10.28999 62.50282  31.7  ?              ?        0.84 
1 1 1 -29 17 9  x ?        ?        125.3915  63.7  ?              ?        0.00 
1 1 1 -29 17 10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -28 0  1  o 155.6803 4.464455 628.1624  0.0   -0.000000      0.000000 0.94 
1 1 1 -28 0  2  o 661.1996 13.05976 727.5171  360.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  3  o 78.34721 11.94571 36.61346  180.0 -0.000000      0.000000 0.08 
1 1 1 -28 0  4  o 958.1422 12.73203 1181.938  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  5  o 560.5033 7.763105 560.0980  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  6  o 129.3658 5.452502 253.1337  180.0 -0.000000      0.000000 0.13 
1 1 1 -28 0  7  o 1637.601 19.58097 2914.811  0.0   -0.000000      0.000000 1.00 
1 1 1 -28 0  8  o 943.0346 11.97317 944.8431  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  9  o 75.71266 9.711367 48.38688  180.0 -0.000000      0.000000 0.37 
1 1 1 -28 0  10 o 198.0564 6.075243 184.3589  180.0 -0.000000      0.000000 0.99 
1 1 1 -28 0  11 o 339.4926 5.872543 449.0377  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  12 o 13.24497 9.333327 163.5090  0.0   -0.000000      0.000000 0.10 
1 1 1 -28 0  13 o 590.4518 8.017237 899.7343  0.0   -0.000000      0.000000 1.00 
1 1 1 -28 0  14 o 191.7253 4.365837 485.1422  180.0 -0.000000      0.000000 0.99 
1 1 1 -28 0  15 o 281.9049 5.051811 154.3473  0.0   -0.000000      0.000000 0.97 
1 1 1 -28 0  16 o 204.4444 4.660459 158.5190  180.0 -0.000000      0.000000 0.81 
1 1 1 -28 0  17 o 671.7001 8.888647 1140.111  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  18 o 123.3128 6.236970 133.0529  360.0 -0.000000      0.000000 0.66 
1 1 1 -28 0  19 o 154.1155 4.336040 384.6375  360.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  20 o 112.6811 4.674539 226.4035  180.0 -0.000000      0.000000 0.97 
1 1 1 -28 0  21 o 139.3772 4.798620 292.1848  0.0   -0.000000      0.000000 1.00 
1 1 1 -28 0  22 f 265.8377 4.922111 281.7141  180.0 -0.000000      0.000000 0.00 
1 1 1 -28 0  23 o 166.4123 4.013794 216.7777  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  24 o 316.5115 5.398988 471.6608  0.0   -0.000000      0.000000 1.00 
1 1 1 -28 0  25 o 124.7504 4.720370 135.9567  0.0   -0.000000      0.000000 1.00 
1 1 1 -28 0  26 o 87.02596 5.985183 90.49702  0.0   -0.000000      0.000000 0.96 
1 1 1 -28 0  27 o 396.2536 6.153609 611.4356  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  28 o 26.87945 14.49102 74.65627  180.0 -0.000000      0.000000 0.54 
1 1 1 -28 0  29 f 62.87669 11.98155 144.4162  0.0   -0.000000      0.000000 0.00 
1 1 1 -28 0  30 o 109.1145 7.154651 77.68444  0.0   -0.000000      0.000000 0.99 
1 1 1 -28 0  31 o 24.86201 15.58693 52.77089  0.0   -0.000000      0.000000 0.36 
1 1 1 -28 0  32 o 94.34311 9.112935 144.1438  180.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  33 o 39.00969 17.77504 1.774972  180.0 -0.000000      0.000000 0.03 
1 1 1 -28 0  34 o 45.56444 17.57787 129.6101  180.0 -0.000000      0.000000 0.99 
1 1 1 -28 0  35 o 84.61292 8.237518 98.66895  360.0 -0.000000      0.000000 1.00 
1 1 1 -28 0  36 o 38.54377 18.69750 50.69772  0.0   -0.000000      0.000000 0.78 
1 1 1 -28 0  37 o 46.76541 18.34671 20.98531  180.0 ?              ?        0.53 
1 1 1 -28 2  1  o 354.1440 3.788466 621.9683  339.0 57.78366       7.576931 0.96 
1 1 1 -28 2  2  o 561.7228 5.280737 938.0941  70.7  4.162292       10.56147 0.98 
1 1 1 -28 2  3  o 232.7360 4.260849 156.8404  102.8 25.76463       8.521697 0.90 
1 1 1 -28 2  4  o 736.2568 7.024607 1102.004  278.9 -42.68713      14.04921 0.99 
1 1 1 -28 2  5  o 450.2985 4.782365 689.2454  65.1  -4.940857      9.564730 0.97 
1 1 1 -28 2  6  o 206.7433 3.195593 631.9390  131.3 -0.2186127     6.391186 0.91 
1 1 1 -28 2  7  o 677.5646 6.480697 570.5667  25.3  38.19165       12.96139 0.98 
1 1 1 -28 2  8  o 170.2193 3.148846 201.6262  73.7  9.146774       6.297691 0.75 
1 1 1 -28 2  9  o 654.4592 6.323997 910.0718  117.6 24.36945       12.64799 0.99 
1 1 1 -28 2  10 o 612.7137 6.020583 738.6789  81.2  9.888855       12.04117 0.99 
1 1 1 -28 2  11 o 315.1394 3.851318 436.3085  257.1 -48.25443      7.702637 0.95 
1 1 1 -28 2  12 f 216.0656 3.243020 318.2203  5.1   -34.74266      6.486040 0.00 
1 1 1 -28 2  13 o 548.6957 6.576014 685.6904  288.6 -50.77911      13.15203 0.98 
1 1 1 -28 2  14 o 165.6236 3.343275 220.4207  289.0 -38.88252      6.686550 0.72 
1 1 1 -28 2  15 o 521.0641 5.104637 566.6227  247.4 -22.19037      10.20927 0.98 
1 1 1 -28 2  16 f 257.9844 3.388194 392.8627  260.6 -43.75394      6.776388 0.00 
1 1 1 -28 2  17 o 289.2835 3.459722 428.1834  31.0  65.58356       6.919445 0.96 
1 1 1 -28 2  18 o 645.5599 5.770831 872.2676  58.1  30.76746       11.54166 0.99 
1 1 1 -28 2  19 o 416.7764 4.140041 577.3578  108.0 58.29730       8.280082 0.99 
1 1 1 -28 2  20 o 79.79996 3.888555 211.7893  1.6   10.81152       7.777110 0.81 
1 1 1 -28 2  21 o 156.9988 3.048541 188.2615  187.5 37.35976       6.097082 0.93 
1 1 1 -28 2  22 o 124.1187 3.450454 97.96957  46.6  15.66803       6.900909 0.84 
1 1 1 -28 2  23 o 104.3745 3.485546 112.1165  34.5  43.51125       6.971092 0.83 
1 1 1 -28 2  24 o 112.9071 3.726457 199.7031  253.6 -7.020874      7.452915 0.93 
1 1 1 -28 2  25 o 200.7099 3.603977 287.1233  77.9  11.82886       7.207953 0.98 
1 1 1 -28 2  26 o 152.9119 3.360011 199.0797  44.3  13.37117       6.720021 0.97 
1 1 1 -28 2  27 o 142.6573 3.526022 194.9122  224.4 -37.97356      7.052044 0.97 
1 1 1 -28 2  28 o 175.0283 3.364712 268.6487  136.9 -2.562988      6.729423 0.99 
1 1 1 -28 2  29 o 193.4064 3.401845 278.0709  244.5 0.6405182      6.803689 0.99 
1 1 1 -28 2  30 o 94.62753 5.493412 98.06290  12.1  10.35654       10.98682 0.90 
1 1 1 -28 2  31 o 76.12193 6.543946 106.8052  115.3 6.309608       13.08789 0.90 
1 1 1 -28 2  32 o 107.9393 5.466782 134.8002  28.7  -14.93999      10.93356 0.95 
1 1 1 -28 2  33 o 66.17537 8.746502 72.43877  87.3  49.91619       17.49300 0.88 
1 1 1 -28 2  34 o 39.47349 9.642534 29.52037  54.8  16.98670       19.28507 0.56 
1 1 1 -28 2  35 o 79.94320 8.324426 112.6894  31.8  -14.26079      16.64885 0.95 
1 1 1 -28 2  36 o 43.83864 11.28381 93.14060  317.9 -6.033859      22.56761 0.89 
1 1 1 -28 2  37 o 34.32718 10.05477 50.07893  238.8 ?              ?        0.76 
1 1 1 -28 4  1  o 394.7625 3.571653 353.4629  119.8 44.60251       7.143306 0.96 
1 1 1 -28 4  2  o 585.0242 5.245747 761.9515  119.5 22.47467       10.49149 0.98 
1 1 1 -28 4  3  o 297.3947 3.379842 437.3874  151.9 23.58536       6.759684 0.92 
1 1 1 -28 4  4  o 303.0803 4.641314 369.5426  54.3  -14.23633      9.282628 0.94 
1 1 1 -28 4  5  o 209.7504 3.066623 202.2812  133.9 50.12759       6.133246 0.80 
1 1 1 -28 4  6  o 449.5244 4.042181 558.8634  78.4  -19.98672      8.084361 0.97 
1 1 1 -28 4  7  o 232.5805 3.276829 294.2303  305.9 -12.78801      6.553659 0.89 
1 1 1 -28 4  8  o 323.1049 4.027417 441.6522  280.3 -20.58765      8.054834 0.96 
1 1 1 -28 4  9  o 371.3693 4.048998 512.9821  160.3 -8.022369      8.097996 0.97 
1 1 1 -28 4  10 o 611.1622 7.031443 842.6671  343.2 -27.70209      14.06289 0.99 
1 1 1 -28 4  11 o 730.0286 6.637558 985.5341  290.3 -20.72083      13.27512 0.99 
1 1 1 -28 4  12 o 720.8641 6.534349 1011.703  227.9 -30.09277      13.06870 0.99 
1 1 1 -28 4  13 o 443.2824 4.568549 723.8431  171.2 -16.53793      9.137097 0.98 
1 1 1 -28 4  14 o 227.1099 3.366176 324.5628  98.5  -11.78429      6.732352 0.92 
1 1 1 -28 4  15 o 152.1443 3.224462 303.8390  141.3 -31.31197      6.448924 0.87 
1 1 1 -28 4  16 o 291.2462 4.233427 466.5062  148.3 7.441254       8.466854 0.96 
1 1 1 -28 4  17 o 517.6545 4.788891 696.0879  264.9 -20.58859      9.577783 0.99 
1 1 1 -28 4  18 o 130.7334 3.230408 210.2927  182.7 26.92437       6.460815 0.88 
1 1 1 -28 4  19 o 177.0991 3.187460 332.0269  163.9 27.51068       6.374921 0.96 
1 1 1 -28 4  20 o 338.5226 3.747140 462.1228  135.0 21.35754       7.494280 0.99 
1 1 1 -28 4  21 o 427.5492 4.478090 699.5431  127.2 17.96201       8.956181 0.99 
1 1 1 -28 4  22 f 110.1071 3.562965 253.0998  179.9 17.14118       7.125929 0.00 
1 1 1 -28 4  23 f 98.18672 4.056638 82.76847  15.3  14.64473       8.113276 0.00 
1 1 1 -28 4  24 o 180.4067 3.176441 295.8776  202.6 33.71121       6.352881 0.98 
1 1 1 -28 4  25 o 108.9917 4.285931 86.69347  68.3  -21.87881      8.571861 0.89 
1 1 1 -28 4  26 o 63.28633 6.558760 130.9513  141.6 -20.32727      13.11752 0.88 
1 1 1 -28 4  27 o 168.1433 3.499322 252.7858  290.0 2.287888       6.998643 0.98 
1 1 1 -28 4  28 o 112.7802 4.363272 201.2779  263.8 -4.885223      8.726543 0.97 
1 1 1 -28 4  29 o 57.17918 8.201067 65.72694  86.9  -23.84243      16.40213 0.74 
1 1 1 -28 4  30 o 50.29423 8.850813 95.78332  75.3  14.65357       17.70163 0.80 
1 1 1 -28 4  31 o 140.3424 4.527421 137.6978  230.1 -5.489822      9.054842 0.96 
1 1 1 -28 4  32 o 64.90211 8.519620 119.5915  337.9 -13.72046      17.03924 0.93 
1 1 1 -28 4  33 o 64.70599 8.634284 88.36871  291.1 7.737202       17.26857 0.92 
1 1 1 -28 4  34 o 48.89033 10.35407 49.94082  8.2   -19.64872      20.70814 0.80 
1 1 1 -28 4  35 o 58.46483 9.074090 87.09435  9.8   13.72947       18.14818 0.92 
1 1 1 -28 4  36 o 23.71857 7.914619 13.19666  273.7 ?              ?        0.23 
1 1 1 -28 6  1  o 773.5469 5.602803 1227.712  33.7  -54.40350      11.20561 0.99 
1 1 1 -28 6  2  o 112.3502 3.023192 45.24369  343.4 -16.93256      6.046383 0.14 
1 1 1 -28 6  3  o 51.19322 5.760962 183.9818  161.2 -24.87952      11.52192 0.38 
1 1 1 -28 6  4  o 409.3281 4.017598 649.5506  28.5  -49.00067      8.035196 0.98 
1 1 1 -28 6  5  o 346.6698 4.406981 437.4016  98.7  -29.55426      8.813963 0.96 
1 1 1 -28 6  6  o 169.7974 3.519950 201.9620  69.6  17.02530       7.039901 0.69 
1 1 1 -28 6  7  o 233.9502 3.013145 315.8940  344.7 21.55676       6.026289 0.92 
1 1 1 -28 6  8  o 100.5789 3.562797 65.94634  273.0 16.61158       7.125595 0.40 
1 1 1 -28 6  9  o 557.6982 4.862588 768.9322  155.2 -36.07086      9.725177 0.99 
1 1 1 -28 6  10 o 142.4732 4.376645 177.4470  144.7 -40.13066      8.753289 0.72 
1 1 1 -28 6  11 f 40.69096 7.569032 49.31351  269.6 21.88444       15.13806 0.00 
1 1 1 -28 6  12 o 435.2729 4.406663 765.8228  94.9  -16.09021      8.813326 0.99 
1 1 1 -28 6  13 o 252.0672 3.405150 234.1805  309.8 37.46585       6.810301 0.93 
1 1 1 -28 6  14 o 140.3707 4.212074 281.6997  292.3 70.99638       8.424149 0.90 
1 1 1 -28 6  15 o 326.3899 3.799056 585.7428  162.4 -49.26273      7.598111 0.98 
1 1 1 -28 6  16 o 335.1675 3.708131 474.8122  16.4  13.22397       7.416263 0.99 
1 1 1 -28 6  17 o 224.4622 3.185148 472.9497  307.5 17.44283       6.370297 0.98 
1 1 1 -28 6  18 o 35.25926 8.180047 83.03029  270.5 17.34605       16.36009 0.40 
1 1 1 -28 6  19 o 75.79309 4.912719 116.6262  282.9 17.92893       9.825438 0.78 
1 1 1 -28 6  20 o 144.6099 3.088589 299.3451  155.8 1.935974       6.177178 0.97 
1 1 1 -28 6  21 o 133.4018 5.047963 175.1597  47.3  13.36440       10.09593 0.94 
1 1 1 -28 6  22 o 162.2881 3.308557 278.9706  20.7  18.59276       6.617113 0.98 
1 1 1 -28 6  23 o 70.37848 6.314534 110.1748  255.3 -5.543816      12.62907 0.86 
1 1 1 -28 6  24 o 164.3457 3.447939 252.4169  196.8 -1.600433      6.895878 0.98 
1 1 1 -28 6  25 o 67.21070 7.248877 70.02378  129.2 -3.989609      14.49775 0.81 
1 1 1 -28 6  26 f 98.74974 5.798398 156.5998  179.1 -28.22529      11.59680 0.00 
1 1 1 -28 6  27 o 55.43381 8.972379 101.4524  123.0 -2.378506      17.94476 0.86 
1 1 1 -28 6  28 o 88.19800 5.984560 107.0722  12.5  19.52467       11.96912 0.91 
1 1 1 -28 6  29 o 87.04266 6.496272 90.05134  353.1 12.61954       12.99254 0.90 
1 1 1 -28 6  30 o 44.94383 10.34613 63.84648  91.2  -7.341915      20.69226 0.72 
1 1 1 -28 6  31 o 39.12976 11.93552 50.14237  79.9  -17.65104      23.87105 0.65 
1 1 1 -28 6  32 o 101.1439 5.818294 114.0910  68.1  12.02121       11.63659 0.97 
1 1 1 -28 6  33 o 36.79895 10.18648 37.80658  192.9 -7.639622      20.37295 0.64 
1 1 1 -28 6  34 o 40.33376 12.19918 58.85509  5.6   -1.503117      24.39836 0.79 
1 1 1 -28 6  35 o 69.83102 8.929744 84.06357  49.6  ?              ?        0.94 
1 1 1 -28 8  1  o 274.4351 4.064629 446.2304  24.0  -35.28683      8.129258 0.98 
1 1 1 -28 8  2  o 243.6934 4.068658 336.1774  51.9  -9.470398      8.137317 0.96 
1 1 1 -28 8  3  o 166.7646 3.786803 526.7151  104.5 ?              ?        0.97 
1 1 1 -28 8  4  o 159.5137 3.968328 355.4326  33.6  -32.97319      7.936656 0.95 
1 1 1 -28 8  5  o 254.3649 2.870781 343.0937  173.0 -16.95805      5.741562 0.97 
1 1 1 -28 8  6  o 244.8974 3.176092 342.5031  52.1  44.54312       6.352185 0.96 
1 1 1 -28 8  7  o 154.6078 3.054786 197.6612  271.0 -37.08669      6.109572 0.91 
1 1 1 -28 8  8  o 79.20284 6.307748 177.5164  258.0 -10.30909      12.61550 0.77 
1 1 1 -28 8  9  o 28.48897 7.632194 100.0772  198.6 2.270395       15.26439 0.30 
1 1 1 -28 8  10 o 65.65926 6.142994 106.4072  118.6 65.13251       12.28599 0.65 
1 1 1 -28 8  11 o 268.3871 3.234504 384.1244  26.3  12.97983       6.469009 0.98 
1 1 1 -28 8  12 o 22.83893 7.156118 68.14227  78.5  -3.644602      14.31224 0.23 
1 1 1 -28 8  13 f 91.19672 4.014858 53.40307  243.0 -3.342430      8.029716 0.00 
1 1 1 -28 8  14 o 39.75914 6.687387 8.449272  297.9 -30.48152      13.37477 0.09 
1 1 1 -28 8  15 o 70.89072 5.844711 223.0589  337.4 -9.448853      11.68942 0.90 
1 1 1 -28 8  16 o 33.18989 8.234425 12.66195  165.3 -3.849489      16.46885 0.15 
1 1 1 -28 8  17 o 152.3777 3.292847 153.8835  346.9 -32.30058      6.585693 0.94 
1 1 1 -28 8  18 o 71.83695 5.301368 113.3738  61.1  29.61087       10.60274 0.83 
1 1 1 -28 8  19 o 96.77707 4.347940 111.4536  101.7 13.28558       8.695880 0.90 
1 1 1 -28 8  20 o 47.98215 7.757124 115.9981  32.6  -26.39523      15.51425 0.80 
1 1 1 -28 8  21 o 190.0885 3.432056 278.6001  146.0 19.60361       6.864112 0.98 
1 1 1 -28 8  22 o 166.7970 3.574492 374.9005  8.8   -2.262375      7.148985 0.99 
1 1 1 -28 8  23 o 175.6999 3.845589 281.1729  79.6  -12.04625      7.691179 0.99 
1 1 1 -28 8  24 o 131.7458 4.681061 186.8654  71.9  -7.513855      9.362123 0.98 
1 1 1 -28 8  25 o 51.81488 10.34333 95.61352  12.5  -16.75867      20.68667 0.82 
1 1 1 -28 8  26 o 152.1029 4.638654 246.7478  279.1 -30.87537      9.277308 0.98 
1 1 1 -28 8  27 o 49.74222 9.766462 126.3673  132.7 -15.67411      19.53292 0.87 
1 1 1 -28 8  28 o 169.5070 4.444583 281.5561  159.0 22.83122       8.889166 0.99 
1 1 1 -28 8  29 o 118.4451 6.140269 203.5335  84.0  10.24316       12.28054 0.98 
1 1 1 -28 8  30 o 37.11906 10.76733 53.22328  32.7  1.429981       21.53466 0.73 
1 1 1 -28 8  31 o 56.95184 10.40887 107.8748  230.2 -24.69058      20.81775 0.93 
1 1 1 -28 8  32 o 69.45879 15.33816 131.5764  148.5 -22.14939      30.67632 0.94 
1 1 1 -28 8  33 o 37.49004 12.44656 52.50367  190.1 ?              ?        0.76 
1 1 1 -28 10 1  o 114.9206 3.654937 180.1333  130.0 -1.148788      7.309874 0.93 
1 1 1 -28 10 2  o 213.1417 3.360278 422.7484  354.5 -20.23508      6.720556 0.98 
1 1 1 -28 10 3  o 49.91947 7.022286 116.0284  156.8 14.04896       14.04457 0.65 
1 1 1 -28 10 4  o 192.0679 3.734927 388.8404  203.8 4.871780       7.469854 0.98 
1 1 1 -28 10 5  o 169.1169 3.270569 285.2587  199.0 -7.772781      6.541137 0.97 
1 1 1 -28 10 6  o 237.7643 3.282114 329.2260  152.8 22.46866       6.564229 0.98 
1 1 1 -28 10 7  o 199.4715 3.391905 328.6975  156.6 -28.61446      6.783811 0.98 
1 1 1 -28 10 8  o 237.6632 3.955354 514.0859  266.2 -3.485535      7.910708 0.99 
1 1 1 -28 10 9  o 111.2181 4.163917 234.4351  240.4 -0.5683899     8.327834 0.95 
1 1 1 -28 10 10 o 230.5584 3.364048 452.6246  162.0 -1.351242      6.728096 0.99 
1 1 1 -28 10 11 o 131.2433 3.437364 297.3686  255.8 -21.74556      6.874728 0.97 
1 1 1 -28 10 12 o 276.3818 3.281667 522.0639  255.3 -22.60007      6.563333 0.99 
1 1 1 -28 10 13 o 102.9606 4.057904 218.7513  278.8 9.669235       8.115808 0.95 
1 1 1 -28 10 14 o 163.4837 3.417237 315.4921  17.1  17.68570       6.834473 0.98 
1 1 1 -28 10 15 o 74.62780 5.641239 47.48413  85.7  1.152267       11.28248 0.70 
1 1 1 -28 10 16 o 92.93634 4.675512 220.3573  166.7 -36.29257      9.351025 0.96 
1 1 1 -28 10 17 o 86.24503 5.220809 196.7700  38.3  -5.516510      10.44162 0.95 
1 1 1 -28 10 18 o 147.8947 3.684312 236.7471  36.5  -2.860962      7.368623 0.98 
1 1 1 -28 10 19 o 113.8996 4.195517 246.0615  205.8 -11.56466      8.391034 0.98 
1 1 1 -28 10 20 f 173.7813 3.645756 249.8929  205.4 -21.67027      7.291513 0.00 
1 1 1 -28 10 21 o 21.77940 7.557800 35.88626  109.2 14.81995       15.11560 0.28 
1 1 1 -28 10 22 o 64.50034 8.955463 106.0329  63.1  -31.57978      17.91093 0.87 
1 1 1 -28 10 23 f 34.37571 9.771917 34.73957  102.3 16.71801       19.54383 0.00 
1 1 1 -28 10 24 o 37.28481 10.72926 24.35221  100.7 16.31408       21.45852 0.30 
1 1 1 -28 10 25 o 48.91013 11.11731 32.83749  109.7 6.582264       22.23461 0.53 
1 1 1 -28 10 26 o 63.37330 10.65088 109.0975  292.4 -12.64317      21.30175 0.92 
1 1 1 -28 10 27 f 98.95700 8.000247 161.9681  350.6 12.37713       16.00049 0.00 
1 1 1 -28 10 28 o 39.27004 11.19306 63.41964  86.3  31.44319       22.38613 0.81 
1 1 1 -28 10 29 o 42.03395 19.69562 60.62424  301.7 ?              ?        0.69 
1 1 1 -28 10 30 o 34.35403 10.97493 80.76945  310.1 -0.1086922     21.94987 0.85 
1 1 1 -28 10 31 o 57.07699 12.10191 112.4427  281.0 ?              ?        0.94 
1 1 1 -28 12 1  o 135.7102 3.597310 256.7419  184.8 3.550201       7.194621 0.98 
1 1 1 -28 12 2  o 267.9021 3.158817 409.5451  131.1 -12.99084      6.317635 0.99 
1 1 1 -28 12 3  o 253.2029 3.174631 410.6992  201.7 -27.18518      6.349262 0.99 
1 1 1 -28 12 4  o 214.4030 3.268517 365.1710  249.2 16.26802       6.537034 0.99 
1 1 1 -28 12 5  o 125.5414 4.261503 264.2283  134.9 4.886993       8.523005 0.98 
1 1 1 -28 12 6  o 230.2693 3.738527 418.4940  160.8 -5.078018      7.477054 0.99 
1 1 1 -28 12 7  o 59.01759 7.299603 148.9290  277.2 3.497574       14.59921 0.91 
1 1 1 -28 12 8  o 108.0356 6.244902 221.3046  257.9 -24.72679      12.48980 0.97 
1 1 1 -28 12 9  o 180.5464 5.141005 378.4266  214.5 -12.32416      10.28201 0.99 
1 1 1 -28 12 10 o 109.4338 6.300310 189.6690  341.8 -11.32482      12.60062 0.97 
1 1 1 -28 12 11 o 88.00332 5.963087 195.1136  110.1 ?              ?        0.96 
1 1 1 -28 12 12 o 29.06651 8.952658 42.72385  342.1 3.841122       17.90532 0.45 
1 1 1 -28 12 13 o 134.2228 4.704897 306.7262  342.2 ?              ?        0.99 
1 1 1 -28 12 14 o 121.6736 6.314961 269.1631  326.3 6.426926       12.62992 0.98 
1 1 1 -28 12 15 o 170.6167 5.071611 230.6845  234.4 -8.364227      10.14322 0.98 
1 1 1 -28 12 16 o 124.1822 5.721404 197.4483  135.1 6.610687       11.44281 0.97 
1 1 1 -28 12 17 o 50.46020 8.470045 78.30556  64.3  18.62790       16.94009 0.77 
1 1 1 -28 12 18 o 57.52873 8.222269 85.74767  270.6 -3.747875      16.44454 0.84 
1 1 1 -28 12 19 o 43.74890 8.732007 27.63968  332.9 -8.092091      17.46401 0.40 
1 1 1 -28 12 20 o 44.87865 9.165197 99.53115  37.5  11.50699       18.33039 0.84 
1 1 1 -28 12 21 o 105.1188 5.522917 191.5627  311.0 -9.651833      11.04583 0.97 
1 1 1 -28 12 22 o 51.47131 9.972335 132.8575  243.1 24.03405       19.94467 0.92 
1 1 1 -28 12 23 o 31.00584 9.203828 33.66969  231.3 -4.103617      18.40766 0.52 
1 1 1 -28 12 24 o 87.15655 8.267008 164.4798  9.4   -16.38757      16.53402 0.98 
1 1 1 -28 12 25 o 49.21201 11.11862 113.4514  250.6 0.8595276      22.23724 0.92 
1 1 1 -28 12 26 o 43.93732 10.21948 84.96854  229.0 -21.03406      20.43895 0.89 
1 1 1 -28 12 27 f 36.38322 11.85907 30.45738  44.6  -3.885109      23.71813 0.00 
1 1 1 -28 12 28 o 52.15854 11.13869 129.1448  71.8  ?              ?        0.95 
1 1 1 -28 14 1  o 214.2981 3.670757 353.5889  247.4 -0.5780792     7.341514 0.99 
1 1 1 -28 14 2  o 49.63257 9.801435 75.70220  37.8  19.70629       19.60287 0.78 
1 1 1 -28 14 3  o 76.24178 7.106153 88.58804  47.9  38.04701       14.21231 0.89 
1 1 1 -28 14 4  o 68.56570 8.556244 128.8515  272.2 -11.44801      17.11249 0.92 
1 1 1 -28 14 5  o 108.5095 5.467732 164.4717  226.0 -6.135445      10.93546 0.96 
1 1 1 -28 14 6  o 138.5409 4.431029 258.2878  155.5 4.333237       8.862059 0.98 
1 1 1 -28 14 7  o 32.65137 9.676113 76.34804  167.9 8.473619       19.35223 0.66 
1 1 1 -28 14 8  o 90.88296 6.757922 128.7321  223.3 -0.5894775     13.51584 0.94 
1 1 1 -28 14 9  o 45.64636 9.833003 107.6149  211.1 -19.83149      19.66601 0.85 
1 1 1 -28 14 10 o 37.80861 11.08506 39.55290  237.6 20.91735       22.17012 0.47 
1 1 1 -28 14 11 o 36.38397 11.41408 52.35606  222.5 11.38725       22.82816 0.57 
1 1 1 -28 14 12 o 74.07093 9.598320 132.7078  134.0 24.22516       19.19664 0.94 
1 1 1 -28 14 13 o 58.10841 10.99775 110.5888  355.6 -15.73751      21.99551 0.90 
1 1 1 -28 14 14 o 52.26854 12.45100 131.8400  124.6 11.36134       24.90199 0.91 
1 1 1 -28 14 15 o 30.68006 9.531449 53.97830  91.9  -1.284445      19.06290 0.65 
1 1 1 -28 14 16 o 98.71007 8.530845 184.9264  281.2 -9.042824      17.06169 0.98 
1 1 1 -28 14 17 o 58.63943 9.285655 100.2748  133.4 -43.54588      18.57131 0.93 
1 1 1 -28 14 18 o 195.2401 7.538999 382.0408  94.9  -19.44563      15.07800 1.00 
1 1 1 -28 14 19 o 66.49289 11.21094 128.5517  222.1 -33.46478      22.42188 0.95 
1 1 1 -28 14 20 o 106.7447 3.999569 181.0826  233.2 ?              ?        0.99 
1 1 1 -28 14 21 o 53.43170 11.95396 72.95477  193.2 -4.713356      23.90791 0.89 
1 1 1 -28 14 22 o 36.32015 10.74346 47.82729  224.7 1.125019       21.48693 0.75 
1 1 1 -28 14 23 o 47.14363 11.74288 140.0721  98.9  ?              ?        0.94 
1 1 1 -28 14 24 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -28 16 1  o 51.93009 10.62430 65.20132  150.8 23.87250       21.24859 0.88 
1 1 1 -28 16 2  o 96.42744 6.448824 159.4690  60.3  -7.512260      12.89765 0.98 
1 1 1 -28 16 3  f 41.96053 10.98814 39.43031  301.7 10.34427       21.97628 0.00 
1 1 1 -28 16 4  o 70.14957 9.850970 82.68766  280.9 -9.314377      19.70194 0.94 
1 1 1 -28 16 5  o 31.10855 9.880420 48.64609  292.8 11.92226       19.76084 0.71 
1 1 1 -28 16 6  o 57.57204 9.403682 175.0477  80.3  -41.68364      18.80736 0.96 
1 1 1 -28 16 7  o 41.50585 11.23765 133.6981  30.4  -2.777462      22.47530 0.93 
1 1 1 -28 16 8  o 101.2438 6.931360 180.6295  40.0  26.45294       13.86272 0.98 
1 1 1 -28 16 9  o 33.24241 11.07557 72.02271  126.2 15.59656       22.15114 0.82 
1 1 1 -28 16 10 o 112.0781 10.41188 185.2710  252.8 -15.84452      20.82377 0.98 
1 1 1 -28 16 11 o 36.81329 11.47030 51.01131  216.1 9.265209       22.94060 0.75 
1 1 1 -28 16 12 o 44.58963 12.74914 98.43342  138.5 1.563583       25.49828 0.90 
1 1 1 -28 16 13 o 46.75236 13.27038 76.87985  28.1  38.20251       26.54075 0.87 
1 1 1 -28 16 14 o 62.13146 12.34007 158.5420  342.1 -18.89156      24.68015 0.96 
1 1 1 -28 16 15 o 54.63686 12.05305 99.89554  285.7 ?              ?        0.93 
1 1 1 -28 16 16 o 135.3451 9.570994 265.2265  236.7 ?              ?        0.99 
1 1 1 -28 16 17 x ?        ?        65.00018  216.0 ?              ?        0.00 
1 1 1 -27 1  1  f 609.4165 7.411607 839.8942  113.2 -26.97382      14.82321 0.00 
1 1 1 -27 1  2  o 308.5145 3.673802 605.8933  13.1  35.32468       7.347605 0.95 
1 1 1 -27 1  3  o 162.4211 3.298548 212.5324  248.5 30.38919       6.597095 0.66 
1 1 1 -27 1  4  o 258.1216 3.467453 588.1627  213.3 -27.30016      6.934906 0.93 
1 1 1 -27 1  5  o 385.6440 4.289230 624.8542  100.2 -38.37656      8.578461 0.96 
1 1 1 -27 1  6  f 386.8400 4.527394 472.5602  240.7 15.21564       9.054789 0.00 
1 1 1 -27 1  7  o 186.4626 3.677094 227.9490  240.1 -24.79393      7.354189 0.76 
1 1 1 -27 1  8  o 1096.752 9.730244 1724.223  183.4 38.38416       19.46049 1.00 
1 1 1 -27 1  9  o 314.8120 4.998580 209.5298  27.3  -42.15601      9.997160 0.90 
1 1 1 -27 1  10 o 657.4729 6.361335 1001.259  41.8  -0.3604736     12.72267 0.99 
1 1 1 -27 1  11 o 512.2329 5.299782 634.8334  273.0 44.67456       10.59956 0.98 
1 1 1 -27 1  12 o 555.9967 5.455141 766.0795  231.7 35.59198       10.91028 0.98 
1 1 1 -27 1  13 o 282.1315 4.091773 398.0621  287.7 32.95871       8.183545 0.94 
1 1 1 -27 1  14 o 158.0381 2.745141 420.9531  230.3 10.46388       5.490281 0.88 
1 1 1 -27 1  15 o 601.5190 5.691233 840.8560  111.4 34.40704       11.38247 0.99 
1 1 1 -27 1  16 o 214.8728 3.104858 215.1234  137.7 9.437836       6.209717 0.85 
1 1 1 -27 1  17 o 244.4342 3.216284 285.7039  167.0 -2.396530      6.432568 0.91 
1 1 1 -27 1  18 o 88.93875 3.357464 104.8146  25.8  5.692398       6.714928 0.41 
1 1 1 -27 1  19 o 91.58748 3.886019 168.9990  45.2  -25.74207      7.772039 0.64 
1 1 1 -27 1  20 o 28.73088 7.424167 72.13683  69.1  4.537209       14.84833 0.14 
1 1 1 -27 1  21 o 348.0536 3.880849 438.7563  113.2 37.57452       7.761698 0.98 
1 1 1 -27 1  22 o 157.5100 2.803735 157.2609  142.8 -20.59908      5.607471 0.93 
1 1 1 -27 1  23 o 122.8775 3.245134 211.7928  174.9 -39.25262      6.490267 0.94 
1 1 1 -27 1  24 o 66.35355 8.626298 69.79892  270.1 -8.561832      17.25260 0.59 
1 1 1 -27 1  25 o 53.76991 6.615567 107.8034  139.6 6.821976       13.23113 0.75 
1 1 1 -27 1  26 o 80.20918 4.843599 97.78429  10.3  23.96317       9.687198 0.86 
1 1 1 -27 1  27 o 212.4401 3.329533 299.2241  213.9 10.64154       6.659066 0.99 
1 1 1 -27 1  28 o 193.2581 3.228911 236.5521  348.8 -12.25963      6.457821 0.98 
1 1 1 -27 1  29 o 115.4332 6.783312 213.4211  156.9 -35.76475      13.56662 0.98 
1 1 1 -27 1  30 o 146.6794 3.988645 201.2130  194.0 -32.19736      7.977291 0.97 
1 1 1 -27 1  31 o 41.60149 8.670833 91.26939  175.3 23.43870       17.34167 0.73 
1 1 1 -27 1  32 o 54.67704 9.668711 71.13331  237.6 1.807255       19.33742 0.78 
1 1 1 -27 1  33 o 71.00956 6.556531 76.71163  77.0  7.762192       13.11306 0.89 
1 1 1 -27 1  34 o 44.61642 9.793138 36.87226  264.1 17.63440       19.58628 0.66 
1 1 1 -27 1  35 o 95.29366 6.443340 117.6318  52.6  -17.80077      12.88668 0.97 
1 1 1 -27 1  36 o 110.8688 5.825312 140.4598  273.8 -1.943893      11.65062 0.98 
1 1 1 -27 1  37 o 44.75053 10.46632 68.32787  239.5 ?              ?        0.87 
1 1 1 -27 3  1  o 680.7458 6.462666 1151.094  87.6  -7.649109      12.92533 0.99 
1 1 1 -27 3  2  o 379.2125 6.229855 372.5575  317.3 67.63403       12.45971 0.95 
1 1 1 -27 3  3  o 296.0730 5.407441 262.4059  288.9 ?              ?        0.90 
1 1 1 -27 3  4  o 554.6953 5.414326 542.8510  226.1 10.65802       10.82865 0.98 
1 1 1 -27 3  5  o 551.0560 5.496300 803.5688  355.7 19.90485       10.99260 0.98 
1 1 1 -27 3  6  o 370.3698 4.218302 688.7280  326.4 71.03909       8.436604 0.97 
1 1 1 -27 3  7  o 342.0959 3.869404 421.2237  122.6 -83.85336      7.738807 0.95 
1 1 1 -27 3  8  o 468.8217 4.815908 745.7919  121.5 -71.36121      9.631817 0.98 
1 1 1 -27 3  9  o 150.0208 3.277452 150.4478  29.8  4.629135       6.554905 0.09 
1 1 1 -27 3  10 o 624.0061 5.946222 829.7736  289.0 -22.63190      11.89244 0.99 
1 1 1 -27 3  11 o 521.9945 5.224437 886.4017  125.6 -11.46454      10.44887 0.99 
1 1 1 -27 3  12 o 535.3793 6.751939 696.6378  112.2 -49.82312      13.50388 0.98 
1 1 1 -27 3  13 o 99.42500 3.486508 114.5503  279.1 -1.078964      6.973016 0.33 
1 1 1 -27 3  14 o 273.7026 3.334659 436.3534  248.4 -42.24268      6.669318 0.95 
1 1 1 -27 3  15 o 113.8025 3.154513 231.8287  304.8 -2.114586      6.309026 0.66 
1 1 1 -27 3  16 o 405.2585 4.121142 564.8599  298.5 -24.47168      8.242284 0.97 
1 1 1 -27 3  17 o 274.3899 3.676730 521.1610  352.9 -31.31940      7.353461 0.96 
1 1 1 -27 3  18 o 444.4543 4.388143 675.2589  29.3  19.44235       8.776285 0.99 
1 1 1 -27 3  19 o 62.10973 4.902294 53.84546  154.4 8.100231       9.804588 0.29 
1 1 1 -27 3  20 o 225.9004 2.997131 357.0715  107.1 41.51949       5.994262 0.97 
1 1 1 -27 3  21 o 184.4081 2.909449 301.1710  136.7 29.79570       5.818898 0.97 
1 1 1 -27 3  22 o 156.0319 3.252289 295.9016  321.1 -4.021622      6.504579 0.96 
1 1 1 -27 3  23 o 192.5390 3.030606 239.1122  97.6  26.66548       6.061211 0.97 
1 1 1 -27 3  24 o 181.0249 3.025154 225.6764  183.2 -3.136108      6.050308 0.97 
1 1 1 -27 3  25 o 74.90825 5.620521 136.3447  53.6  17.22713       11.24104 0.89 
1 1 1 -27 3  26 o 74.72717 5.915329 120.1607  353.9 -5.049744      11.83066 0.89 
1 1 1 -27 3  27 o 78.14581 5.230040 214.0030  17.4  -8.688797      10.46008 0.95 
1 1 1 -27 3  28 o 104.6128 4.392064 158.3398  31.9  1.244057       8.784128 0.96 
1 1 1 -27 3  29 o 99.34753 4.815037 147.9078  57.1  8.160706       9.630075 0.95 
1 1 1 -27 3  30 o 88.70781 7.212817 113.7508  37.6  48.71233       14.42563 0.91 
1 1 1 -27 3  31 o 194.6653 3.838435 232.3349  163.5 32.98517       7.676869 0.98 
1 1 1 -27 3  32 o 117.4260 5.006776 193.2481  69.3  -10.06219      10.01355 0.97 
1 1 1 -27 3  33 f 176.8747 4.211442 249.1765  358.4 1.799957       8.422884 0.00 
1 1 1 -27 3  34 o 233.2539 6.554599 299.2245  7.4   1.004944       13.10920 0.99 
1 1 1 -27 3  35 o 94.06503 6.002864 145.9780  58.6  17.21436       12.00573 0.97 
1 1 1 -27 3  36 o 35.23679 9.344550 46.40117  218.8 15.47576       18.68910 0.73 
1 1 1 -27 5  1  f 804.5290 5.827843 1158.145  29.0  5.220459       11.65569 0.00 
1 1 1 -27 5  2  o 252.2382 2.755029 474.1467  196.4 -9.446655      5.510057 0.95 
1 1 1 -27 5  3  o 256.7759 3.023656 378.3402  262.6 -3.200760      6.047313 0.93 
1 1 1 -27 5  4  o 515.8918 4.416252 928.1157  39.8  28.75793       8.832504 0.99 
1 1 1 -27 5  5  o 306.3752 3.187521 526.3694  111.7 59.37903       6.375041 0.96 
1 1 1 -27 5  6  o 392.4247 3.749153 399.7789  169.4 2.191345       7.498306 0.96 
1 1 1 -27 5  7  o 182.6240 2.764054 55.26239  172.9 -16.99751      5.528109 0.52 
1 1 1 -27 5  8  o 416.7023 4.019295 573.1628  328.0 -33.54727      8.038590 0.97 
1 1 1 -27 5  9  o 227.4353 4.299384 456.0390  113.0 17.56027       8.598767 0.94 
1 1 1 -27 5  10 o 271.9276 3.432376 502.1984  235.7 -0.1094971     6.864752 0.94 
1 1 1 -27 5  11 o 171.4866 3.190774 361.8596  239.8 -0.8298492     6.381548 0.87 
1 1 1 -27 5  12 o 179.9726 4.793839 214.7878  321.3 ?              ?        0.79 
1 1 1 -27 5  13 o 534.3599 5.980899 641.7227  164.5 2.955566       11.96180 0.98 
1 1 1 -27 5  14 o 313.5040 3.650528 390.3582  30.4  -32.25323      7.301055 0.95 
1 1 1 -27 5  15 o 251.5978 3.341738 367.4049  275.1 -19.08456      6.683477 0.95 
1 1 1 -27 5  16 o 255.1187 3.074661 458.0800  130.4 -13.53329      6.149323 0.97 
1 1 1 -27 5  17 o 260.8142 3.954108 435.8310  152.3 -6.463257      7.908216 0.97 
1 1 1 -27 5  18 o 170.9835 3.019732 235.1877  24.5  -11.91209      6.039463 0.94 
1 1 1 -27 5  19 o 199.3112 3.046460 378.3832  88.2  -23.07120      6.092921 0.98 
1 1 1 -27 5  20 o 90.36533 6.521354 141.9471  145.9 -45.75971      13.04271 0.86 
1 1 1 -27 5  21 o 151.9449 3.540924 144.3168  290.3 -20.83484      7.081847 0.93 
1 1 1 -27 5  22 o 120.2897 3.626976 65.52010  16.4  15.04252       7.253953 0.80 
1 1 1 -27 5  23 o 115.8523 3.641585 203.4794  125.4 -12.08744      7.283171 0.95 
1 1 1 -27 5  24 o 217.0662 3.135758 347.4850  103.9 -21.77290      6.271517 0.99 
1 1 1 -27 5  25 o 145.1587 3.632355 141.6490  317.0 18.29124       7.264710 0.96 
1 1 1 -27 5  26 o 111.1591 4.115077 195.6214  175.3 -25.81905      8.230155 0.96 
1 1 1 -27 5  27 o 103.5889 4.528404 114.2346  199.9 22.89481       9.056808 0.95 
1 1 1 -27 5  28 o 108.9272 4.821895 136.7782  235.6 -19.39111      9.643790 0.95 
1 1 1 -27 5  29 o 114.6060 4.782799 178.3129  152.8 -9.666031      9.565598 0.96 
1 1 1 -27 5  30 o 121.4464 4.820472 209.8028  139.7 -33.36892      9.640944 0.97 
1 1 1 -27 5  31 o 60.62600 8.628316 45.21692  216.1 23.88496       17.25663 0.73 
1 1 1 -27 5  32 o 79.17432 7.513538 121.5953  122.5 9.084953       15.02708 0.95 
1 1 1 -27 5  33 o 106.3370 5.075910 168.2765  149.8 -13.88279      10.15182 0.98 
1 1 1 -27 5  34 o 43.84615 9.431497 68.25643  235.3 -24.66956      18.86299 0.85 
1 1 1 -27 5  35 o 66.42062 9.381673 102.3199  95.2  -3.198318      18.76335 0.94 
1 1 1 -27 5  36 o 51.91187 10.63215 66.98797  92.8  ?              ?        0.89 
1 1 1 -27 7  1  o 354.1224 3.660502 496.8607  70.4  -40.10318      7.321003 0.97 
1 1 1 -27 7  2  o 292.5083 3.183999 486.4304  198.3 19.71347       6.367997 0.96 
1 1 1 -27 7  3  o 275.0414 2.838711 486.4459  238.1 -45.36032      5.677421 0.96 
1 1 1 -27 7  4  o 113.2435 2.910532 134.4896  171.4 3.390274       5.821064 0.47 
1 1 1 -27 7  5  o 180.6224 4.146024 234.3291  131.6 -33.05312      8.292048 0.86 
1 1 1 -27 7  6  f 385.2981 3.800268 647.4673  285.4 -5.849060      7.600536 0.00 
1 1 1 -27 7  7  o 121.4428 3.627290 193.0968  266.5 18.03611       7.254580 0.73 
1 1 1 -27 7  8  o 120.5637 3.048919 153.4413  174.4 14.07731       6.097838 0.71 
1 1 1 -27 7  9  o 160.8948 2.900835 228.6924  278.3 30.64575       5.801670 0.85 
1 1 1 -27 7  10 o 88.48476 3.558198 111.2968  63.7  5.025963       7.116397 0.44 
1 1 1 -27 7  11 f 189.1938 3.740811 147.1805  272.5 17.99559       7.481622 0.00 
1 1 1 -27 7  12 o 297.7121 3.799013 621.0648  218.7 40.30630       7.598025 0.98 
1 1 1 -27 7  13 o 272.6991 3.369260 378.5068  78.1  -4.095367      6.738521 0.97 
1 1 1 -27 7  14 o 209.1373 3.305491 272.4582  74.9  -24.14304      6.610983 0.96 
1 1 1 -27 7  15 o 42.49014 7.893801 102.6348  61.8  -5.226734      15.78760 0.42 
1 1 1 -27 7  16 o 47.96046 7.731750 177.7956  107.3 10.62315       15.46350 0.79 
1 1 1 -27 7  17 o 63.13747 5.535484 196.4183  76.9  -0.6221771     11.07097 0.87 
1 1 1 -27 7  18 o 200.2296 3.273939 351.5683  143.8 -21.81052      6.547879 0.98 
1 1 1 -27 7  19 o 197.1534 2.926283 324.8113  139.1 3.275650       5.852567 0.98 
1 1 1 -27 7  20 o 289.1866 3.352292 454.8091  196.2 11.56967       6.704585 0.99 
1 1 1 -27 7  21 o 62.31247 7.519026 78.76815  335.4 -2.256634      15.03805 0.74 
1 1 1 -27 7  22 o 245.7774 3.534710 482.5755  327.5 -8.007706      7.069420 0.99 
1 1 1 -27 7  23 o 98.35744 4.696664 150.7408  61.7  9.827637       9.393329 0.94 
1 1 1 -27 7  24 o 151.3342 5.392177 246.1362  106.7 4.525208       10.78435 0.98 
1 1 1 -27 7  25 o 156.9158 3.986149 262.2013  85.0  10.99063       7.972299 0.99 
1 1 1 -27 7  26 o 49.34718 9.323313 145.2059  254.4 -7.003410      18.64663 0.89 
1 1 1 -27 7  27 o 44.72594 8.545768 12.15837  202.1 45.24706       17.09154 0.16 
1 1 1 -27 7  28 o 127.8053 5.179433 133.5718  110.5 27.11182       10.35887 0.96 
1 1 1 -27 7  29 o 90.77855 6.043541 137.5276  43.8  7.105118       12.08708 0.95 
1 1 1 -27 7  30 o 97.21061 9.184723 160.7782  234.7 -28.71880      18.36945 0.97 
1 1 1 -27 7  31 o 62.97940 9.338770 82.15828  240.6 1.242359       18.67754 0.91 
1 1 1 -27 7  32 o 78.88641 7.545049 116.4067  135.0 41.48150       15.09010 0.96 
1 1 1 -27 7  33 o 31.71017 10.90708 48.02385  259.2 -10.99692      21.81417 0.67 
1 1 1 -27 7  34 o 72.50815 12.94197 158.8403  339.1 ?              ?        0.96 
1 1 1 -27 9  1  o 240.0342 3.853704 362.0751  165.0 ?              ?        0.98 
1 1 1 -27 9  2  o 154.2591 2.823058 125.9781  167.0 -22.45277      5.646115 0.91 
1 1 1 -27 9  3  o 249.5473 4.160466 427.9309  175.0 30.27031       8.320932 0.98 
1 1 1 -27 9  4  o 123.0983 3.147642 214.6185  314.3 12.63456       6.295283 0.93 
1 1 1 -27 9  5  o 181.7237 4.108283 389.2048  340.7 24.01894       8.216566 0.97 
1 1 1 -27 9  6  o 169.5905 2.967305 344.1385  28.7  4.642609       5.934610 0.97 
1 1 1 -27 9  7  o 57.71006 7.348003 100.0076  80.3  41.31477       14.69601 0.61 
1 1 1 -27 9  8  o 107.5645 3.523640 240.1206  197.8 -31.92528      7.047280 0.94 
1 1 1 -27 9  9  o 249.3973 3.069777 452.7112  98.4  4.037521       6.139553 0.99 
1 1 1 -27 9  10 o 205.2739 3.266326 367.9896  29.4  -1.626709      6.532652 0.98 
1 1 1 -27 9  11 f 357.9495 3.624388 447.5408  305.0 -37.03693      7.248775 0.00 
1 1 1 -27 9  12 o 293.3011 3.423677 465.0303  296.5 -1.831451      6.847354 0.99 
1 1 1 -27 9  13 f 139.3159 3.466171 307.9659  57.4  -0.8535156     6.932342 0.00 
1 1 1 -27 9  14 o 130.6165 3.451519 189.7638  167.4 -1.596603      6.903039 0.94 
1 1 1 -27 9  15 o 340.2210 3.567344 549.8516  215.2 -46.75958      7.134689 0.99 
1 1 1 -27 9  16 o 237.6771 3.306547 475.7968  162.8 -22.87090      6.613094 0.99 
1 1 1 -27 9  17 o 136.2159 3.524747 252.4155  138.7 15.36560       7.049494 0.97 
1 1 1 -27 9  18 o 112.7640 4.771890 163.7304  230.1 -43.79941      9.543779 0.95 
1 1 1 -27 9  19 o 112.7912 3.909921 209.1749  161.5 10.29868       7.819841 0.96 
1 1 1 -27 9  20 o 157.3006 3.729439 287.0259  173.0 -15.95950      7.458878 0.98 
1 1 1 -27 9  21 o 31.78519 9.176947 53.79765  327.3 5.842812       18.35389 0.50 
1 1 1 -27 9  22 o 160.1429 4.053276 309.1901  5.3   -4.092804      8.106551 0.99 
1 1 1 -27 9  23 o 253.2859 3.807328 414.5067  16.1  -19.74350      7.614657 0.99 
1 1 1 -27 9  24 o 64.24639 9.163208 103.1900  40.3  -7.157055      18.32642 0.87 
1 1 1 -27 9  25 o 33.99687 9.893929 13.28489  214.2 21.07281       19.78786 0.14 
1 1 1 -27 9  26 o 132.4208 5.254002 197.7270  242.9 -12.71538      10.50800 0.97 
1 1 1 -27 9  27 o 60.83824 10.06405 78.13087  284.4 -36.89247      20.12810 0.86 
1 1 1 -27 9  28 o 67.57834 12.23752 109.2576  155.9 -19.36299      24.47503 0.92 
1 1 1 -27 9  29 o 84.23854 8.051340 168.5960  102.8 3.997673       16.10268 0.97 
1 1 1 -27 9  30 f 74.37996 10.56224 84.88428  323.8 -19.94617      21.12448 0.00 
1 1 1 -27 9  31 o 87.82545 8.556576 129.1514  262.8 29.12945       17.11315 0.97 
1 1 1 -27 9  32 o 34.60232 15.64761 16.60132  68.3  ?              ?        0.29 
1 1 1 -27 11 1  o 318.8896 3.562033 500.7593  38.0  -21.99731      7.124066 0.99 
1 1 1 -27 11 2  o 239.5638 3.107113 386.7945  353.5 -26.65300      6.214226 0.99 
1 1 1 -27 11 3  o 242.4298 3.226337 490.6831  228.5 0.9700470      6.452674 0.99 
1 1 1 -27 11 4  o 124.9802 4.182200 236.7377  211.5 10.80379       8.364401 0.96 
1 1 1 -27 11 5  f 171.9209 3.343367 247.6886  4.5   -6.894821      6.686734 0.00 
1 1 1 -27 11 6  o 85.65611 4.910050 162.4249  251.2 22.92487       9.820100 0.92 
1 1 1 -27 11 7  o 152.5529 3.474940 225.0138  243.8 13.07776       6.949880 0.97 
1 1 1 -27 11 8  o 37.53924 9.791218 36.73804  318.5 -4.448994      19.58244 0.32 
1 1 1 -27 11 9  f 131.0380 4.415235 222.8404  138.5 -10.59467      8.830469 0.00 
1 1 1 -27 11 10 o 86.36433 5.478169 209.9910  221.6 38.97503       10.95634 0.95 
1 1 1 -27 11 11 o 109.8520 5.559042 134.4208  345.9 -16.18855      11.11808 0.94 
1 1 1 -27 11 12 o 104.6746 5.703014 143.0634  254.1 2.137939       11.40603 0.94 
1 1 1 -27 11 13 o 155.0540 4.841538 213.1546  276.2 -0.6124573     9.683076 0.97 
1 1 1 -27 11 14 o 43.18177 8.546614 110.9104  88.5  -5.715195      17.09323 0.80 
1 1 1 -27 11 15 o 82.18886 4.992107 163.8490  197.3 15.24100       9.984215 0.94 
1 1 1 -27 11 16 o 101.7226 4.769612 142.2696  232.0 3.525635       9.539224 0.95 
1 1 1 -27 11 17 o 62.71103 7.723441 141.4386  121.2 -49.64490      15.44688 0.93 
1 1 1 -27 11 18 o 160.4621 3.587615 241.4660  69.0  -19.97273      7.175230 0.99 
1 1 1 -27 11 19 o 182.6343 3.735234 296.0429  255.5 1.767456       7.470469 0.99 
1 1 1 -27 11 20 o 89.92856 5.984753 161.9057  249.5 -15.33609      11.96951 0.95 
1 1 1 -27 11 21 o 42.93303 8.401791 143.9092  31.6  -20.46227      16.80358 0.87 
1 1 1 -27 11 22 o 53.42612 9.068677 120.1066  54.3  -16.05873      18.13735 0.88 
1 1 1 -27 11 23 o 49.91302 10.14247 98.56520  257.8 -10.42742      20.28494 0.86 
1 1 1 -27 11 24 o 134.9634 5.314475 246.9197  309.1 -3.169815      10.62895 0.99 
1 1 1 -27 11 25 o 58.43072 10.36455 149.2005  291.2 -1.650009      20.72910 0.94 
1 1 1 -27 11 26 o 62.08357 10.89158 77.85176  243.3 10.87656       21.78316 0.91 
1 1 1 -27 11 27 o 39.55032 12.21885 81.95850  330.5 12.43357       24.43771 0.85 
1 1 1 -27 11 28 o 47.47230 12.24596 77.67679  216.8 10.43803       24.49193 0.87 
1 1 1 -27 11 29 o 72.16774 14.91995 162.6380  159.8 19.27164       29.83990 0.96 
1 1 1 -27 11 30 x ?        ?        52.06977  313.8 ?              ?        0.00 
1 1 1 -27 13 1  o 36.80776 8.876217 72.17426  16.5  1.481663       17.75243 0.73 
1 1 1 -27 13 2  o 30.69302 8.799234 43.13878  324.7 -6.376030      17.59847 0.49 
1 1 1 -27 13 3  o 71.03090 6.475065 131.6489  301.1 -1.061684      12.95013 0.94 
1 1 1 -27 13 4  o 206.8644 3.463798 280.5912  38.9  41.47488       6.927595 0.99 
1 1 1 -27 13 5  o 87.31784 5.851057 153.1976  64.8  21.02296       11.70211 0.96 
1 1 1 -27 13 6  f 78.61159 8.692287 97.90427  23.3  3.214859       17.38457 0.00 
1 1 1 -27 13 7  o 234.6916 3.825626 424.5347  357.1 18.06339       7.651252 0.99 
1 1 1 -27 13 8  o 121.6997 4.545343 210.0009  283.7 -0.5878220     9.090687 0.98 
1 1 1 -27 13 9  o 114.9456 7.239540 179.5958  212.4 -41.46812      14.47908 0.97 
1 1 1 -27 13 10 o 121.0839 5.657236 213.0753  316.3 -7.442856      11.31447 0.98 
1 1 1 -27 13 11 o 120.5641 6.672772 235.5955  274.1 -16.56421      13.34554 0.98 
1 1 1 -27 13 12 o 174.5893 6.041203 276.8781  54.8  -29.14993      12.08241 0.99 
1 1 1 -27 13 13 o 108.1167 7.528638 184.6572  22.9  -13.64336      15.05728 0.96 
1 1 1 -27 13 14 o 106.6561 8.045990 195.8404  322.3 0.5706711      16.09198 0.96 
1 1 1 -27 13 15 o 82.20703 9.532324 184.2013  255.4 -45.68753      19.06465 0.95 
1 1 1 -27 13 16 o 85.91430 8.805728 153.7482  162.7 -9.814911      17.61146 0.95 
1 1 1 -27 13 17 o 225.0394 5.566808 331.4164  69.2  -19.62534      11.13362 0.99 
1 1 1 -27 13 18 o 97.67384 10.57881 191.8538  93.4  -7.977470      21.15761 0.97 
1 1 1 -27 13 19 o 105.5373 9.868395 220.8285  230.7 3.731567       19.73679 0.98 
1 1 1 -27 13 20 o 33.57996 11.11778 36.10140  233.0 23.71555       22.23556 0.53 
1 1 1 -27 13 21 o 138.2631 8.508457 229.8183  5.9   -25.89615      17.01691 0.99 
1 1 1 -27 13 22 o 112.3014 9.297482 192.1387  291.3 8.163681       18.59496 0.98 
1 1 1 -27 13 23 o 29.06451 9.063999 37.88424  62.9  14.01897       18.12800 0.60 
1 1 1 -27 13 24 o 64.84605 9.979522 160.0967  109.5 25.08250       19.95904 0.96 
1 1 1 -27 13 25 o 58.22854 10.50724 68.26231  203.4 -3.271301      21.01448 0.90 
1 1 1 -27 13 26 f 30.23232 10.35455 17.89799  165.1 ?              ?        0.00 
1 1 1 -27 15 1  o 103.4594 5.874050 176.2870  210.8 7.030830       11.74810 0.98 
1 1 1 -27 15 2  o 159.6125 4.660912 312.4551  153.9 9.905899       9.321824 0.99 
1 1 1 -27 15 3  o 102.6690 5.763851 223.5675  212.2 6.469597       11.52770 0.98 
1 1 1 -27 15 4  o 72.93672 8.307325 99.98251  329.9 -5.994286      16.61465 0.93 
1 1 1 -27 15 5  o 54.43736 10.20817 90.73019  121.5 7.645699       20.41635 0.89 
1 1 1 -27 15 6  o 135.2358 4.768785 298.4269  130.1 27.60126       9.537570 0.99 
1 1 1 -27 15 7  o 39.70872 10.91523 108.4200  114.1 2.606091       21.83046 0.87 
1 1 1 -27 15 8  o 91.13927 7.425465 139.2500  69.2  -7.182198      14.85093 0.96 
1 1 1 -27 15 9  o 68.62569 10.60960 137.5670  81.2  -27.09169      21.21921 0.95 
1 1 1 -27 15 10 o 84.83522 10.81456 115.8082  28.8  -3.688911      21.62911 0.95 
1 1 1 -27 15 11 f 93.81609 11.09674 206.5288  186.2 -31.22196      22.19347 0.00 
1 1 1 -27 15 12 o 81.99263 11.44835 185.1942  180.1 -32.42500      22.89670 0.97 
1 1 1 -27 15 13 o 59.29224 12.68420 111.0415  359.7 5.240646       25.36840 0.93 
1 1 1 -27 15 14 o 73.96513 12.80885 146.7136  5.4   -25.87355      25.61770 0.96 
1 1 1 -27 15 15 o 106.9215 10.76317 229.3090  59.7  -2.347755      21.52634 0.98 
1 1 1 -27 15 16 o 37.50697 11.64417 67.78468  4.1   10.31010       23.28835 0.82 
1 1 1 -27 15 17 o 112.5180 10.40972 203.5527  317.1 1.737076       20.81943 0.98 
1 1 1 -27 15 18 o 52.20570 10.00737 113.5596  57.4  -23.84936      20.01473 0.94 
1 1 1 -27 15 19 o 38.47003 11.47038 35.62216  50.5  12.99542       22.94076 0.67 
1 1 1 -27 15 20 o 38.31733 11.75965 47.05114  325.2 ?              ?        0.76 
1 1 1 -27 15 21 o 41.84743 12.95025 108.5864  73.3  ?              ?        0.91 
1 1 1 -27 17 1  o 36.00688 10.89072 52.87253  204.4 ?              ?        0.79 
1 1 1 -27 17 2  o 35.16599 10.76466 36.48364  10.2  ?              ?        0.68 
1 1 1 -27 17 3  o 45.03522 11.60249 73.50899  325.2 ?              ?        0.88 
1 1 1 -27 17 4  o 70.14613 9.967501 133.0374  247.3 ?              ?        0.96 
1 1 1 -27 17 5  o 110.7636 6.757832 227.3386  231.5 ?              ?        0.99 
1 1 1 -27 17 6  o 32.83516 10.44406 73.55257  157.3 ?              ?        0.85 
1 1 1 -27 17 7  o 52.03265 9.577556 94.00485  12.3  ?              ?        0.93 
1 1 1 -27 17 8  o 38.56087 10.99925 24.13783  47.2  ?              ?        0.56 
1 1 1 -27 17 9  f 38.04033 12.37574 85.91884  201.6 ?              ?        0.00 
1 1 1 -27 17 10 o 56.58636 13.17911 122.4846  153.3 ?              ?        0.94 
1 1 1 -27 17 11 o 77.47073 13.18614 169.8918  174.5 ?              ?        0.97 
1 1 1 -26 0  1  o 786.0160 8.557050 1029.920  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  2  o 787.2910 10.62400 1217.571  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  3  o 86.07973 5.628924 59.67670  0.0   -0.000000      0.000000 0.32 
1 1 1 -26 0  4  o 73.81113 6.732925 73.24858  180.0 -0.000000      0.000000 0.07 
1 1 1 -26 0  5  o 196.7919 5.069533 54.98646  0.0   -0.000000      0.000000 0.95 
1 1 1 -26 0  6  o 45.16571 9.910447 86.23314  180.0 -0.000000      0.000000 0.00 
1 1 1 -26 0  7  o 105.2732 5.352166 74.86176  180.0 -0.000000      0.000000 0.55 
1 1 1 -26 0  8  o 119.2535 4.488907 505.0089  0.0   -0.000000      0.000000 0.63 
1 1 1 -26 0  9  o 340.3862 5.909453 229.1342  0.0   -0.000000      0.000000 0.99 
1 1 1 -26 0  10 o 330.1801 5.930660 576.3073  0.0   -0.000000      0.000000 1.00 
1 1 1 -26 0  11 f 558.4523 7.855457 1152.031  180.0 -0.000000      0.000000 0.00 
1 1 1 -26 0  12 o 612.5844 8.381277 686.3947  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  13 o 242.3204 4.518251 361.9186  0.0   -0.000000      0.000000 0.99 
1 1 1 -26 0  14 o 339.6684 5.554675 646.8764  0.0   -0.000000      0.000000 1.00 
1 1 1 -26 0  15 o 241.7650 4.565540 413.9489  0.0   -0.000000      0.000000 1.00 
1 1 1 -26 0  16 o 140.0234 3.945223 269.5617  180.0 -0.000000      0.000000 0.83 
1 1 1 -26 0  17 o 76.12565 4.950075 235.2540  360.0 -0.000000      0.000000 0.61 
1 1 1 -26 0  18 o 87.74318 4.897711 186.7131  180.0 -0.000000      0.000000 0.66 
1 1 1 -26 0  19 o 235.2609 4.426878 347.1753  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  20 o 85.85629 4.480472 98.52164  360.0 -0.000000      0.000000 0.54 
1 1 1 -26 0  21 o 117.2059 4.875022 53.38897  180.0 -0.000000      0.000000 0.55 
1 1 1 -26 0  22 o 18.80772 11.86600 200.9500  360.0 -0.000000      0.000000 0.49 
1 1 1 -26 0  23 o 191.2849 4.282622 221.3177  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  24 o 201.2837 4.157674 361.2886  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  25 o 160.2273 4.225367 168.4787  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  26 o 124.6004 4.654086 275.6496  0.0   -0.000000      0.000000 1.00 
1 1 1 -26 0  27 o 98.97285 6.252186 75.18355  0.0   -0.000000      0.000000 0.96 
1 1 1 -26 0  28 o 92.34598 7.014966 116.8973  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  29 o 199.2688 5.230314 254.7811  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  30 o 174.6578 6.949663 166.6154  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  31 o 112.8005 6.591526 172.4379  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  32 o 22.83316 14.50877 77.95654  0.0   -0.000000      0.000000 0.52 
1 1 1 -26 0  33 o 39.96480 17.56873 37.17723  360.0 -0.000000      0.000000 0.52 
1 1 1 -26 0  34 o 77.94176 8.990855 130.9791  180.0 -0.000000      0.000000 1.00 
1 1 1 -26 0  35 o 59.81294 16.52799 48.95898  180.0 -0.000000      0.000000 0.92 
1 1 1 -26 0  36 o 37.92062 19.06122 3.481785  0.0   -0.000000      0.000000 0.07 
1 1 1 -26 0  37 o 15.59459 11.11385 6.541293  0.0   ?              ?        0.08 
1 1 1 -26 2  1  o 365.6472 4.220914 533.3407  140.5 -26.12939      8.441829 0.95 
1 1 1 -26 2  2  o 575.7277 5.296976 590.8875  355.1 98.54315       10.59395 0.98 
1 1 1 -26 2  3  o 170.7450 2.826906 397.9134  29.3  69.09535       5.653813 0.76 
1 1 1 -26 2  4  o 474.9765 5.011670 885.5800  180.5 52.01538       10.02334 0.98 
1 1 1 -26 2  5  o 515.2628 5.236689 552.0331  355.4 61.76416       10.47338 0.98 
1 1 1 -26 2  6  o 491.1265 5.126133 760.5679  319.3 32.12833       10.25227 0.98 
1 1 1 -26 2  7  o 413.2325 4.430900 537.6169  177.3 5.433319       8.861799 0.96 
1 1 1 -26 2  8  o 625.0108 6.217831 964.8836  215.4 -31.25024      12.43566 0.99 
1 1 1 -26 2  9  o 296.9462 4.665329 539.1036  297.1 -6.051208      9.330658 0.96 
1 1 1 -26 2  10 o 167.8078 3.198742 216.3483  101.7 -77.30133      6.397484 0.62 
1 1 1 -26 2  11 o 561.9065 5.489928 895.6771  354.2 -8.341980      10.97986 0.99 
1 1 1 -26 2  12 o 462.5810 4.670101 772.4740  253.3 -24.26291      9.340201 0.98 
1 1 1 -26 2  13 o 414.8765 4.213918 410.3434  187.8 12.58472       8.427836 0.96 
1 1 1 -26 2  14 o 504.5907 4.880918 516.5214  192.1 1.499542       9.761836 0.97 
1 1 1 -26 2  15 o 791.1479 7.047822 941.1036  183.2 0.8441162      14.09564 0.99 
1 1 1 -26 2  16 o 453.0064 5.141530 734.3721  214.9 33.74799       10.28306 0.98 
1 1 1 -26 2  17 o 542.7158 5.138715 785.3299  308.6 -27.37500      10.27743 0.99 
1 1 1 -26 2  18 o 387.5952 3.835525 620.7991  16.9  29.42722       7.671049 0.98 
1 1 1 -26 2  19 o 427.0898 4.193954 683.9175  114.5 -62.95605      8.387909 0.99 
1 1 1 -26 2  20 o 122.3893 3.394241 193.6080  9.9   -27.44946      6.788483 0.83 
1 1 1 -26 2  21 o 275.8329 3.288630 371.1057  58.9  -50.08743      6.577260 0.98 
1 1 1 -26 2  22 o 293.4689 3.418398 336.6494  291.1 -10.64948      6.836795 0.98 
1 1 1 -26 2  23 o 56.33170 6.189324 188.0522  102.6 -13.71851      12.37865 0.82 
1 1 1 -26 2  24 o 75.64482 4.699878 100.6618  64.1  -0.3755569     9.399756 0.77 
1 1 1 -26 2  25 o 108.6454 4.264354 141.7930  189.5 36.05106       8.528708 0.92 
1 1 1 -26 2  26 f 84.53099 4.869895 104.2128  245.5 -8.957222      9.739791 0.00 
1 1 1 -26 2  27 o 151.3061 3.366241 259.2309  108.0 -13.52159      6.732482 0.98 
1 1 1 -26 2  28 o 67.97542 6.397563 126.9048  40.2  -8.820137      12.79513 0.91 
1 1 1 -26 2  29 o 234.0528 3.647700 297.7628  124.9 19.84386       7.295400 0.99 
1 1 1 -26 2  30 o 42.59986 8.847508 82.32659  97.0  10.02651       17.69502 0.71 
1 1 1 -26 2  31 o 170.8295 4.017430 209.5280  107.4 -1.327393      8.034861 0.98 
1 1 1 -26 2  32 o 42.33681 10.32065 32.08461  4.5   12.88438       20.64130 0.42 
1 1 1 -26 2  33 o 156.8920 4.339014 246.9920  2.3   -12.07529      8.678028 0.99 
1 1 1 -26 2  34 o 118.2793 5.599267 180.2853  341.5 13.45338       11.19853 0.98 
1 1 1 -26 2  35 o 81.04801 7.763289 106.1197  217.0 5.097687       15.52658 0.95 
1 1 1 -26 2  36 o 105.8584 6.258493 166.5491  228.4 -15.57072      12.51699 0.98 
1 1 1 -26 2  37 o 45.39080 11.17087 12.99663  319.6 ?              ?        0.37 
1 1 1 -26 4  1  o 186.1278 3.007240 547.7845  104.9 7.621033       6.014480 0.91 
1 1 1 -26 4  2  o 706.1623 5.302317 1202.076  238.1 -32.89807      10.60463 0.99 
1 1 1 -26 4  3  o 396.3922 3.867725 559.3370  296.9 46.32050       7.735450 0.97 
1 1 1 -26 4  4  f 911.6010 8.305255 1136.332  288.3 40.18060       16.61051 0.00 
1 1 1 -26 4  5  o 250.7962 3.269398 168.1471  305.8 -22.78850      6.538796 0.88 
1 1 1 -26 4  6  o 803.2722 6.383947 1234.843  103.5 19.06140       12.76789 0.99 
1 1 1 -26 4  7  o 403.5532 4.256605 682.7484  159.4 -17.52176      8.513209 0.98 
1 1 1 -26 4  8  o 341.3400 3.901400 743.6401  246.4 -63.74936      7.802801 0.96 
1 1 1 -26 4  9  o 430.5132 4.324806 646.2693  20.3  -21.90979      8.649612 0.97 
1 1 1 -26 4  10 o 57.98652 5.971069 68.71461  262.4 -39.51423      11.94214 0.06 
1 1 1 -26 4  11 o 354.8190 3.924596 425.2950  99.2  7.513275       7.849192 0.95 
1 1 1 -26 4  12 o 456.0756 4.601045 651.1567  354.3 79.81976       9.202090 0.98 
1 1 1 -26 4  13 o 380.8528 4.022270 503.1431  20.3  -13.84555      8.044540 0.96 
1 1 1 -26 4  14 o 53.22277 5.700549 75.70506  346.6 14.82546       11.40110 0.17 
1 1 1 -26 4  15 o 329.7802 3.599599 332.2674  271.5 -40.32724      7.199199 0.95 
1 1 1 -26 4  16 o 444.5476 5.146608 779.3362  4.4   37.92215       10.29322 0.98 
1 1 1 -26 4  17 o 96.03955 3.264978 149.7738  59.7  -0.4029465     6.529957 0.62 
1 1 1 -26 4  18 o 190.8162 3.219267 239.8701  298.8 34.29947       6.438534 0.92 
1 1 1 -26 4  19 o 132.1435 3.796288 260.6850  316.1 17.77864       7.592576 0.92 
1 1 1 -26 4  20 o 267.9263 3.249039 523.0300  235.9 -5.300751      6.498078 0.99 
1 1 1 -26 4  21 o 215.6415 3.020405 239.4783  325.4 5.645706       6.040810 0.97 
1 1 1 -26 4  22 o 69.95531 5.105226 206.8006  358.1 28.75744       10.21045 0.88 
1 1 1 -26 4  23 o 196.8348 3.201995 281.4601  207.0 -18.33759      6.403990 0.97 
1 1 1 -26 4  24 f 109.4404 3.637413 132.5385  314.4 25.95830       7.274826 0.00 
1 1 1 -26 4  25 o 41.42747 8.400638 27.50116  321.7 -15.95515      16.80128 0.27 
1 1 1 -26 4  26 o 226.9335 3.424083 354.8058  142.5 -1.878433      6.848166 0.99 
1 1 1 -26 4  27 o 268.3722 3.588257 400.1213  94.8  0.1141968      7.176515 0.99 
1 1 1 -26 4  28 o 174.4138 3.882569 285.7422  321.7 12.43190       7.765138 0.99 
1 1 1 -26 4  29 o 157.5537 3.752797 209.8986  276.0 0.8573608      7.505595 0.98 
1 1 1 -26 4  30 o 84.50217 6.141513 117.5147  121.5 27.41811       12.28303 0.91 
1 1 1 -26 4  31 o 37.72308 10.40298 51.65635  139.9 -10.74975      20.80596 0.54 
1 1 1 -26 4  32 o 77.08855 6.697848 117.0063  110.2 -1.979706      13.39570 0.94 
1 1 1 -26 4  33 o 77.69883 6.683341 122.6395  114.6 -0.7957764     13.36668 0.95 
1 1 1 -26 4  34 o 72.30287 9.249341 62.21293  24.3  19.71734       18.49868 0.90 
1 1 1 -26 4  35 o 79.33911 7.972937 95.31324  94.2  14.59899       15.94587 0.95 
1 1 1 -26 4  36 o 37.37980 10.55271 29.22305  56.4  ?              ?        0.59 
1 1 1 -26 6  1  o 70.92133 3.431503 92.79311  1.9   -32.22174      6.863005 0.30 
1 1 1 -26 6  2  o 402.0604 3.468473 444.1144  51.1  41.33743       6.936945 0.97 
1 1 1 -26 6  3  o 814.7308 7.466534 1053.200  261.0 -40.54865      14.93307 0.99 
1 1 1 -26 6  4  o 400.6891 3.391828 497.0056  208.2 -77.91431      6.783655 0.97 
1 1 1 -26 6  5  o 339.7196 3.462494 555.2666  135.5 62.04279       6.924988 0.96 
1 1 1 -26 6  6  o 327.4294 3.271130 503.5097  250.5 -25.01660      6.542260 0.97 
1 1 1 -26 6  7  o 202.9687 2.591368 359.0214  343.7 -5.525330      5.182736 0.91 
1 1 1 -26 6  8  o 415.9229 4.812908 621.3934  357.7 -42.71509      9.625816 0.98 
1 1 1 -26 6  9  o 426.6016 3.891800 488.7440  311.1 -49.39124      7.783601 0.97 
1 1 1 -26 6  10 f 564.6671 6.142715 1070.234  233.5 4.893127       12.28543 0.00 
1 1 1 -26 6  11 o 545.6573 5.099803 816.8318  159.2 16.33502       10.19961 0.99 
1 1 1 -26 6  12 o 98.46054 4.127696 219.5573  156.6 30.87863       8.255392 0.68 
1 1 1 -26 6  13 o 368.5251 4.085368 449.9229  299.7 -44.41382      8.170735 0.97 
1 1 1 -26 6  14 o 407.4708 5.183152 669.3130  256.0 -0.4864502     10.36630 0.98 
1 1 1 -26 6  15 o 154.3727 3.206561 185.0870  294.0 -16.37708      6.413123 0.85 
1 1 1 -26 6  16 o 349.6438 3.630157 569.3397  148.4 10.23328       7.260315 0.99 
1 1 1 -26 6  17 o 140.3950 3.489362 256.3551  118.8 -3.107239      6.978724 0.93 
1 1 1 -26 6  18 o 63.32618 5.068770 165.1855  226.1 23.88237       10.13754 0.80 
1 1 1 -26 6  19 o 45.65437 7.375608 50.74852  138.9 6.899364       14.75122 0.33 
1 1 1 -26 6  20 o 36.14663 8.809137 147.7263  345.2 8.416307       17.61827 0.68 
1 1 1 -26 6  21 o 131.5276 3.550431 124.7226  341.9 -4.725784      7.100863 0.91 
1 1 1 -26 6  22 o 38.74040 8.921206 9.465554  357.0 2.468063       17.84241 0.09 
1 1 1 -26 6  23 o 50.95967 9.171034 117.7841  195.0 0.6043167      18.34207 0.81 
1 1 1 -26 6  24 o 153.2031 3.392099 195.2071  274.5 15.46919       6.784199 0.97 
1 1 1 -26 6  25 f 168.9881 3.714404 314.7092  300.6 -19.93005      7.428807 0.00 
1 1 1 -26 6  26 o 70.12677 6.399980 148.6661  147.6 -2.224113      12.79996 0.94 
1 1 1 -26 6  27 o 58.64543 7.932663 133.0637  182.6 21.38441       15.86533 0.91 
1 1 1 -26 6  28 o 120.0635 4.866397 138.0708  127.7 21.07797       9.732795 0.95 
1 1 1 -26 6  29 o 166.2951 4.475264 241.5081  165.1 1.620911       8.950528 0.98 
1 1 1 -26 6  30 o 102.2309 5.448619 182.3955  199.5 -22.27287      10.89724 0.97 
1 1 1 -26 6  31 o 79.68867 11.43615 120.3545  13.8  -34.54664      22.87229 0.94 
1 1 1 -26 6  32 o 38.67423 10.24771 59.44217  163.6 5.615784       20.49542 0.77 
1 1 1 -26 6  33 f 141.0239 4.922465 195.6277  161.6 -2.382767      9.844930 0.00 
1 1 1 -26 6  34 f 52.18578 10.96326 74.07229  195.4 -6.243824      21.92653 0.00 
1 1 1 -26 6  35 o 37.14996 10.79575 62.15435  237.7 ?              ?        0.82 
1 1 1 -26 8  1  o 172.2897 3.216547 247.6101  207.5 -12.86411      6.433095 0.91 
1 1 1 -26 8  2  o 104.4733 3.358477 205.5839  265.3 16.16886       6.716955 0.81 
1 1 1 -26 8  3  o 249.9734 3.142187 234.9080  228.1 -12.45525      6.284374 0.93 
1 1 1 -26 8  4  o 133.6547 3.926321 357.7004  276.5 ?              ?        0.92 
1 1 1 -26 8  5  o 48.54823 5.922823 108.3593  94.4  -42.84631      11.84565 0.36 
1 1 1 -26 8  6  o 318.8789 3.490514 499.1941  177.2 -1.003326      6.981028 0.98 
1 1 1 -26 8  7  o 117.6939 2.975290 145.2200  190.7 -2.054871      5.950579 0.80 
1 1 1 -26 8  8  o 129.4349 3.867642 117.4783  12.7  -27.23944      7.735285 0.66 
1 1 1 -26 8  9  o 241.8718 3.030428 368.7692  108.2 -11.61336      6.060856 0.97 
1 1 1 -26 8  10 o 258.9717 3.116493 384.4014  261.7 -0.2920227     6.232987 0.97 
1 1 1 -26 8  11 o 321.8686 3.369379 475.8875  246.6 29.99210       6.738758 0.98 
1 1 1 -26 8  12 o 120.5924 3.418221 191.2166  351.2 -36.74840      6.836442 0.90 
1 1 1 -26 8  13 o 205.0156 3.027056 455.6149  66.9  -14.84821      6.054112 0.98 
1 1 1 -26 8  14 o 123.5063 3.390124 196.7253  308.0 -12.93071      6.780247 0.94 
1 1 1 -26 8  15 o 170.5866 3.234445 372.8988  164.7 -24.27367      6.468890 0.98 
1 1 1 -26 8  16 o 144.7147 3.478487 270.3150  156.1 -11.29283      6.956973 0.96 
1 1 1 -26 8  17 f 98.20919 3.910671 167.4246  18.1  10.72961       7.821342 0.00 
1 1 1 -26 8  18 o 255.3671 3.187004 469.1410  220.7 -26.02483      6.374008 0.99 
1 1 1 -26 8  19 o 110.0384 4.319197 181.2744  226.6 -36.47381      8.638393 0.94 
1 1 1 -26 8  20 o 102.0218 4.438210 163.0982  313.1 0.6689453      8.876420 0.94 
1 1 1 -26 8  21 o 79.45692 5.504418 158.8186  332.1 26.52473       11.00884 0.93 
1 1 1 -26 8  22 o 143.0580 4.071132 270.1575  255.6 -16.53435      8.142264 0.98 
1 1 1 -26 8  23 o 110.0572 4.903408 206.2562  14.8  15.60857       9.806816 0.97 
1 1 1 -26 8  24 o 59.50569 9.189745 146.1936  54.4  -1.633385      18.37949 0.93 
1 1 1 -26 8  25 o 33.47231 9.763994 93.63737  289.8 11.39106       19.52799 0.72 
1 1 1 -26 8  26 o 141.8585 4.455688 266.9175  322.3 -9.653091      8.911375 0.98 
1 1 1 -26 8  27 o 144.5066 4.947982 194.9242  262.9 6.721802       9.895964 0.97 
1 1 1 -26 8  28 o 44.91839 10.07990 75.15589  182.1 -17.05673      20.15980 0.77 
1 1 1 -26 8  29 o 172.0656 4.636576 220.4171  78.2  1.938126       9.273151 0.99 
1 1 1 -26 8  30 o 37.37144 16.00327 60.61204  273.3 ?              ?        0.70 
1 1 1 -26 8  31 o 44.17357 10.98431 49.88078  347.7 28.48207       21.96861 0.78 
1 1 1 -26 8  32 f 68.19241 9.565000 118.4524  355.6 -13.20343      19.13000 0.00 
1 1 1 -26 8  33 o 92.30385 13.65786 185.2445  322.8 ?              ?        0.97 
1 1 1 -26 10 1  o 139.5482 3.080292 245.5004  193.9 2.277985       6.160584 0.95 
1 1 1 -26 10 2  o 143.3959 3.514606 319.0864  149.2 -5.616989      7.029212 0.97 
1 1 1 -26 10 3  f 86.14136 3.923769 194.9276  353.9 -12.78532      7.847538 0.00 
1 1 1 -26 10 4  o 150.6459 2.970447 318.2121  36.7  -8.570114      5.940894 0.97 
1 1 1 -26 10 5  o 124.8735 3.094537 234.4185  302.9 18.75603       6.189074 0.95 
1 1 1 -26 10 6  o 131.1719 4.050407 306.7426  320.5 29.15149       8.100814 0.96 
1 1 1 -26 10 7  o 261.7188 3.868733 387.1341  71.5  -12.39561      7.737466 0.99 
1 1 1 -26 10 8  o 139.3412 3.498874 164.3969  61.5  1.762497       6.997748 0.93 
1 1 1 -26 10 9  o 23.52055 7.729993 91.93573  175.6 9.611246       15.45999 0.33 
1 1 1 -26 10 10 o 64.12830 7.558028 165.6538  164.0 39.33922       15.11606 0.85 
1 1 1 -26 10 11 o 80.14342 4.605937 166.8258  158.5 -10.42365      9.211875 0.89 
1 1 1 -26 10 12 o 73.20502 5.489881 78.98880  168.2 -23.20876      10.97976 0.72 
1 1 1 -26 10 13 o 219.0154 3.178642 431.3919  191.5 12.49872       6.357285 0.99 
1 1 1 -26 10 14 o 35.48074 8.604760 41.86555  186.6 0.4605942      17.20952 0.33 
1 1 1 -26 10 15 o 82.25703 4.891219 206.4896  313.9 -17.60400      9.782438 0.94 
1 1 1 -26 10 16 o 125.4838 3.799569 235.3515  192.9 -13.87902      7.599138 0.97 
1 1 1 -26 10 17 f 116.8991 3.990081 109.5354  207.5 3.556847       7.980161 0.00 
1 1 1 -26 10 18 o 146.7808 3.538319 279.5348  9.9   1.980057       7.076638 0.98 
1 1 1 -26 10 19 f 57.61221 8.353059 60.40638  55.3  -18.22306      16.70612 0.00 
1 1 1 -26 10 20 o 78.32074 5.875004 140.3594  26.6  6.778664       11.75001 0.95 
1 1 1 -26 10 21 o 131.8258 4.300367 274.8698  357.4 -4.727768      8.600734 0.98 
1 1 1 -26 10 22 o 58.08359 8.505658 117.8284  313.1 -41.06684      17.01132 0.88 
1 1 1 -26 10 23 o 34.10976 9.276807 63.70372  348.2 -8.045156      18.55361 0.56 
1 1 1 -26 10 24 o 68.91898 9.121441 146.9080  299.4 -33.97486      18.24288 0.93 
1 1 1 -26 10 25 o 78.62141 8.589990 186.1835  342.9 -9.316833      17.17998 0.96 
1 1 1 -26 10 26 o 61.81054 10.70589 173.9839  341.2 -9.461784      21.41178 0.95 
1 1 1 -26 10 27 o 76.46696 12.00386 125.7461  325.7 -6.408791      24.00771 0.95 
1 1 1 -26 10 28 o 90.44255 8.578656 115.3638  161.8 8.275719       17.15731 0.96 
1 1 1 -26 10 29 o 56.51006 12.43590 108.5973  117.0 9.433300       24.87180 0.92 
1 1 1 -26 10 30 o 44.06917 13.38337 65.66525  305.0 8.739937       26.76675 0.83 
1 1 1 -26 10 31 o 37.91516 11.88490 60.80416  2.3   ?              ?        0.81 
1 1 1 -26 12 1  o 200.0341 3.349270 269.7161  335.9 -15.73953      6.698540 0.99 
1 1 1 -26 12 2  o 290.9953 3.527413 416.3778  350.2 -8.713745      7.054827 0.99 
1 1 1 -26 12 3  o 112.5776 4.333577 144.3721  270.2 -48.58092      8.667154 0.95 
1 1 1 -26 12 4  o 173.5043 3.277600 342.1635  43.1  14.90378       6.555200 0.99 
1 1 1 -26 12 5  o 224.7153 3.101855 357.5152  356.2 26.17860       6.203711 0.99 
1 1 1 -26 12 6  o 22.11124 7.312036 91.00528  312.6 9.292902       14.62407 0.51 
1 1 1 -26 12 7  o 109.6755 4.087102 136.7605  305.4 1.177612       8.174204 0.95 
1 1 1 -26 12 8  o 146.9647 5.478072 317.9168  136.2 -16.00188      10.95614 0.98 
1 1 1 -26 12 9  o 82.02139 6.704382 119.6778  37.8  16.57441       13.40876 0.91 
1 1 1 -26 12 10 o 188.5304 4.102876 342.7084  307.4 37.95013       8.205752 0.99 
1 1 1 -26 12 11 o 68.79428 7.715628 137.1316  271.7 7.142677       15.43126 0.92 
1 1 1 -26 12 12 o 32.90950 8.880758 71.63208  322.0 -6.500330      17.76152 0.64 
1 1 1 -26 12 13 o 64.01646 8.058505 78.75498  34.6  ?              ?        0.87 
1 1 1 -26 12 14 o 150.3279 5.685728 277.0765  93.6  -42.75891      11.37146 0.99 
1 1 1 -26 12 15 o 103.9545 6.568466 109.1690  106.5 -20.01840      13.13693 0.95 
1 1 1 -26 12 16 o 50.14938 9.317809 35.72539  83.9  -23.90562      18.63562 0.56 
1 1 1 -26 12 17 o 110.9440 6.764410 140.2487  102.8 -2.924301      13.52882 0.95 
1 1 1 -26 12 18 o 126.5840 6.697695 166.8349  149.8 -13.97131      13.39539 0.96 
1 1 1 -26 12 19 o 101.1777 5.051540 234.0913  194.6 -8.567650      10.10308 0.97 
1 1 1 -26 12 20 o 108.4447 4.691959 186.7317  135.4 5.852303       9.383919 0.97 
1 1 1 -26 12 21 o 93.88876 6.262424 170.2877  113.7 -19.62706      12.52485 0.96 
1 1 1 -26 12 22 f 113.4128 5.643884 235.9762  170.4 -24.38210      11.28777 0.00 
1 1 1 -26 12 23 o 34.40422 9.655870 27.90733  119.5 -3.078487      19.31174 0.47 
1 1 1 -26 12 24 o 40.75727 8.636344 87.64727  81.7  -21.96607      17.27269 0.89 
1 1 1 -26 12 25 f 34.08592 10.27560 81.51695  241.2 19.56596       20.55121 0.00 
1 1 1 -26 12 26 o 72.61780 9.616448 127.1778  225.2 11.94321       19.23290 0.96 
1 1 1 -26 12 27 f 39.56409 11.41022 47.04608  181.9 16.68990       22.82044 0.00 
1 1 1 -26 12 28 o 56.54299 14.10962 67.97224  155.7 ?              ?        0.88 
1 1 1 -26 14 1  o 95.79614 5.350429 195.0580  69.4  -9.219025      10.70086 0.96 
1 1 1 -26 14 2  o 107.5499 4.960255 156.2849  275.0 14.27723       9.920510 0.96 
1 1 1 -26 14 3  o 91.37617 6.598841 142.9948  254.2 -18.24314      13.19768 0.94 
1 1 1 -26 14 4  o 67.41657 7.454883 153.2218  28.7  17.72713       14.90977 0.93 
1 1 1 -26 14 5  o 143.0863 4.082421 209.8494  319.5 7.430939       8.164842 0.98 
1 1 1 -26 14 6  o 29.41479 9.286482 81.69362  339.9 -4.263628      18.57296 0.63 
1 1 1 -26 14 7  f 127.0570 4.668802 287.4480  44.3  1.452103       9.337605 0.00 
1 1 1 -26 14 8  o 164.8254 3.882147 257.3245  13.0  10.97539       7.764293 0.98 
1 1 1 -26 14 9  o 39.15826 10.12844 39.71178  174.9 -9.685345      20.25687 0.47 
1 1 1 -26 14 10 o 81.56593 10.89677 174.5891  270.1 -33.71098      21.79354 0.95 
1 1 1 -26 14 11 o 124.5080 7.062962 277.6726  198.3 -38.66328      14.12592 0.98 
1 1 1 -26 14 12 o 82.79678 10.60008 160.4062  145.0 -19.45519      21.20016 0.95 
1 1 1 -26 14 13 o 29.03995 9.805966 20.74519  299.9 13.26925       19.61193 0.24 
1 1 1 -26 14 14 o 96.98720 9.953629 236.5397  323.1 -15.92661      19.90726 0.97 
1 1 1 -26 14 15 o 73.37377 11.15209 169.8534  2.1   -10.24710      22.30419 0.95 
1 1 1 -26 14 16 o 68.00769 11.70229 102.8355  35.9  12.84764       23.40458 0.92 
1 1 1 -26 14 17 o 50.26620 11.25887 68.93111  78.0  -2.917709      22.51774 0.85 
1 1 1 -26 14 18 o 67.55038 10.79789 165.7536  106.3 -32.52317      21.59578 0.96 
1 1 1 -26 14 19 o 51.53713 11.49887 138.0131  23.2  1.383366       22.99774 0.94 
1 1 1 -26 14 20 o 54.66853 7.158689 99.88930  317.4 ?              ?        0.94 
1 1 1 -26 14 21 o 75.44823 12.93913 127.8997  358.0 -21.77540      25.87827 0.95 
1 1 1 -26 14 22 o 61.41536 11.90561 116.1054  329.4 -21.48554      23.81122 0.94 
1 1 1 -26 14 23 o 55.85867 24.12535 34.38721  293.9 ?              ?        0.49 
1 1 1 -26 14 24 o 56.65260 15.34292 29.73231  197.2 ?              ?        0.67 
1 1 1 -26 16 1  o 38.77344 10.32825 93.91634  258.8 -5.415665      20.65650 0.89 
1 1 1 -26 16 2  o 60.27327 10.08919 164.3831  239.0 -7.906624      20.17839 0.96 
1 1 1 -26 16 3  o 37.05295 10.33963 52.51805  189.6 18.18326       20.67927 0.78 
1 1 1 -26 16 4  o 63.04546 10.14264 77.41566  139.6 4.062840       20.28527 0.92 
1 1 1 -26 16 5  o 146.7938 5.141321 273.6942  247.1 -8.087585      10.28264 0.99 
1 1 1 -26 16 6  o 36.15063 9.548245 86.45615  199.5 -13.95009      19.09649 0.88 
1 1 1 -26 16 7  o 75.20280 8.532701 131.1776  58.0  -0.4183197E-01 17.06540 0.97 
1 1 1 -26 16 8  o 61.29194 11.59858 134.1909  30.7  -22.17841      23.19716 0.95 
1 1 1 -26 16 9  o 63.71872 12.36083 90.17622  338.3 -7.990803      24.72165 0.92 
1 1 1 -26 16 10 o 120.3526 8.756426 219.6915  78.6  -12.34079      17.51285 0.99 
1 1 1 -26 16 11 o 45.39833 12.77007 107.5581  189.0 20.89108       25.54014 0.91 
1 1 1 -26 16 12 o 51.63073 13.19562 54.22173  126.1 20.79915       26.39124 0.82 
1 1 1 -26 16 13 o 66.77502 11.68535 171.7897  104.2 -32.88026      23.37070 0.96 
1 1 1 -26 16 14 f 37.52877 10.77650 46.64362  93.6  -6.315994      21.55299 0.00 
1 1 1 -26 16 15 o 68.46861 13.02874 121.2811  54.9  -17.66364      26.05747 0.95 
1 1 1 -26 16 16 o 52.50493 12.05525 97.21763  27.5  ?              ?        0.92 
1 1 1 -26 16 17 o 65.33881 12.62597 135.4919  273.2 ?              ?        0.96 
1 1 1 -25 1  1  o 233.7760 3.149515 609.2498  359.8 25.19048       6.299029 0.94 
1 1 1 -25 1  2  o 233.9978 3.104695 370.3374  196.5 -10.50206      6.209389 0.93 
1 1 1 -25 1  3  o 51.42545 6.155176 358.6780  109.4 -37.98499      12.31035 0.09 
1 1 1 -25 1  4  o 224.3681 3.406687 515.9114  104.3 9.907196       6.813375 0.89 
1 1 1 -25 1  5  f 571.7190 5.708046 952.5824  11.9  21.66510       11.41609 0.00 
1 1 1 -25 1  6  o 446.7009 4.815094 741.2080  0.2   71.33990       9.630189 0.97 
1 1 1 -25 1  7  o 128.1017 3.131447 441.9763  279.9 -51.70154      6.262894 0.85 
1 1 1 -25 1  8  o 575.0148 5.618975 675.4675  305.8 44.26050       11.23795 0.98 
1 1 1 -25 1  9  o 436.8488 4.794575 648.9872  296.1 40.78888       9.589150 0.97 
1 1 1 -25 1  10 o 160.9293 3.060430 391.7226  338.4 -58.22325      6.120860 0.83 
1 1 1 -25 1  11 o 156.8041 3.169461 334.8979  196.1 -5.439758      6.338922 0.84 
1 1 1 -25 1  12 o 685.4901 7.627910 953.4836  146.4 -63.21881      15.25582 0.99 
1 1 1 -25 1  13 o 134.7183 2.595019 189.6888  233.1 -10.29887      5.190037 0.78 
1 1 1 -25 1  14 o 325.7074 3.625419 345.8549  70.7  33.99283       7.250837 0.95 
1 1 1 -25 1  15 o 80.61078 3.744195 75.96275  233.7 5.948586       7.488391 0.27 
1 1 1 -25 1  16 o 75.59084 3.785189 256.2845  116.2 -2.467812      7.570378 0.62 
1 1 1 -25 1  17 o 302.2760 3.443435 628.7580  332.2 4.115906       6.886869 0.96 
1 1 1 -25 1  18 o 197.4773 2.762620 366.3113  325.8 30.54977       5.525240 0.92 
1 1 1 -25 1  19 f 255.8441 3.238984 481.3830  175.7 -28.14766      6.477968 0.00 
1 1 1 -25 1  20 o 262.9156 3.013727 479.6156  255.3 8.841644       6.027454 0.97 
1 1 1 -25 1  21 o 218.5214 2.987116 298.2578  22.4  -17.38318      5.974232 0.96 
1 1 1 -25 1  22 o 79.22358 3.955568 88.88907  313.4 -26.32947      7.911137 0.64 
1 1 1 -25 1  23 o 164.7947 3.104429 217.8813  145.0 30.68704       6.208857 0.95 
1 1 1 -25 1  24 o 228.6929 4.264494 363.3340  116.1 1.736938       8.528989 0.98 
1 1 1 -25 1  25 o 155.1143 2.986429 75.76448  315.6 -22.44104      5.972859 0.88 
1 1 1 -25 1  26 o 98.98895 4.432882 162.2893  143.9 18.94009       8.865765 0.93 
1 1 1 -25 1  27 o 305.7931 3.777290 424.4830  121.1 14.61328       7.554580 0.99 
1 1 1 -25 1  28 o 233.7298 3.363549 342.5442  186.3 45.70770       6.727098 0.99 
1 1 1 -25 1  29 o 63.17196 10.88436 82.84067  78.5  19.66151       21.76871 0.86 
1 1 1 -25 1  30 o 197.9196 3.701834 310.2130  6.2   11.11064       7.403668 0.99 
1 1 1 -25 1  31 o 79.47243 6.241668 71.70346  154.2 27.08687       12.48334 0.84 
1 1 1 -25 1  32 o 60.33827 7.810482 72.77704  170.1 20.94838       15.62096 0.81 
1 1 1 -25 1  33 f 99.27779 6.068774 132.0135  301.9 -24.45008      12.13755 0.00 
1 1 1 -25 1  34 o 43.52837 9.618265 53.61238  278.2 -17.27845      19.23653 0.76 
1 1 1 -25 1  35 o 120.6302 6.281217 153.1692  189.4 38.03558       12.56243 0.98 
1 1 1 -25 1  36 o 83.09272 7.643312 123.3884  131.4 3.194855       15.28662 0.96 
1 1 1 -25 1  37 o 39.22699 10.35858 17.68914  107.5 ?              ?        0.43 
1 1 1 -25 3  1  f 618.4352 4.854497 563.8011  244.2 31.65106       9.708995 0.00 
1 1 1 -25 3  2  o 265.1470 3.217016 103.1035  169.3 18.15283       6.434033 0.55 
1 1 1 -25 3  3  o 612.5670 5.414473 795.8001  203.0 27.41205       10.82895 0.98 
1 1 1 -25 3  4  f 807.1723 6.745932 1247.604  203.5 39.87439       13.49186 0.00 
1 1 1 -25 3  5  o 412.1759 4.405943 338.0253  139.0 0.7753296      8.811886 0.95 
1 1 1 -25 3  6  o 685.4794 6.372722 948.7587  47.2  -6.068848      12.74544 0.99 
1 1 1 -25 3  7  o 486.0256 4.878636 893.8475  242.0 31.82016       9.757272 0.98 
1 1 1 -25 3  8  o 604.3953 7.051601 866.6868  178.7 -71.61407      14.10320 0.99 
1 1 1 -25 3  9  o 222.3859 3.253939 351.5786  51.6  -0.7151642     6.507879 0.92 
1 1 1 -25 3  10 f 200.6808 2.907060 287.7596  214.7 53.30592       5.814120 0.00 
1 1 1 -25 3  11 o 374.4244 4.060023 745.6517  302.9 23.25125       8.120046 0.97 
1 1 1 -25 3  12 o 471.2025 4.484511 754.0034  244.8 -13.35077      8.969022 0.98 
1 1 1 -25 3  13 o 449.7764 4.535811 487.0414  256.7 24.93320       9.071623 0.97 
1 1 1 -25 3  14 o 355.0290 3.862240 630.9202  48.2  11.80069       7.724480 0.97 
1 1 1 -25 3  15 o 393.6262 4.046958 814.5743  200.5 -42.43704      8.093917 0.98 
1 1 1 -25 3  16 o 332.2219 3.556651 661.2072  225.2 33.10721       7.113303 0.97 
1 1 1 -25 3  17 o 40.60541 5.976473 162.1324  21.8  -26.74680      11.95295 0.26 
1 1 1 -25 3  18 o 233.8840 3.054352 348.9668  251.7 -46.58981      6.108705 0.94 
1 1 1 -25 3  19 o 26.41080 7.012847 41.58242  38.2  -2.584019      14.02569 0.07 
1 1 1 -25 3  20 o 160.6329 2.928528 192.0563  113.5 -48.14709      5.857056 0.90 
1 1 1 -25 3  21 f 262.8319 3.215099 352.5616  359.0 27.56119       6.430197 0.00 
1 1 1 -25 3  22 o 215.6949 3.351967 338.9554  316.7 -42.80080      6.703934 0.98 
1 1 1 -25 3  23 o 304.1267 3.524858 408.5111  259.2 15.96375       7.049715 0.99 
1 1 1 -25 3  24 o 183.0082 4.519917 229.6409  350.2 ?              ?        0.97 
1 1 1 -25 3  25 o 119.0834 3.526432 193.6225  166.4 -13.58648      7.052863 0.95 
1 1 1 -25 3  26 o 181.1643 3.176457 256.6272  184.7 2.483261       6.352914 0.98 
1 1 1 -25 3  27 o 41.85192 8.135420 69.69832  31.5  15.42603       16.27084 0.62 
1 1 1 -25 3  28 o 93.32912 5.017086 145.2415  288.3 11.55493       10.03417 0.95 
1 1 1 -25 3  29 o 91.90675 5.651506 110.7282  115.9 -0.3109207     11.30301 0.93 
1 1 1 -25 3  30 o 74.80263 7.533278 85.55322  42.2  58.99524       15.06656 0.85 
1 1 1 -25 3  31 o 86.23856 5.429677 111.2087  45.2  15.85454       10.85935 0.92 
1 1 1 -25 3  32 o 144.1195 4.087643 190.6263  196.4 -17.87936      8.175285 0.98 
1 1 1 -25 3  33 o 62.18102 8.967093 67.88396  120.5 14.07178       17.93419 0.87 
1 1 1 -25 3  34 o 80.42538 14.29913 119.7068  298.9 -0.3695526     28.59826 0.95 
1 1 1 -25 3  35 o 80.86128 7.655544 79.87393  245.4 25.33515       15.31109 0.94 
1 1 1 -25 3  36 o 50.23014 11.63228 64.83517  159.4 8.542370       23.26456 0.86 
1 1 1 -25 3  37 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -25 5  1  o 287.7561 3.517104 526.3759  225.7 19.54974       7.034208 0.95 
1 1 1 -25 5  2  o 444.5722 3.790488 645.6537  276.7 -21.56818      7.580976 0.97 
1 1 1 -25 5  3  o 290.0633 2.835012 361.5250  278.0 40.21097       5.670023 0.93 
1 1 1 -25 5  4  o 96.38335 3.592522 239.6391  220.6 -0.8341217     7.185043 0.52 
1 1 1 -25 5  5  o 357.1670 3.501022 660.0490  96.2  22.66678       7.002044 0.97 
1 1 1 -25 5  6  o 598.5983 5.212901 814.1592  179.0 73.98724       10.42580 0.99 
1 1 1 -25 5  7  o 469.0380 4.111123 833.9205  327.0 -36.85468      8.222245 0.98 
1 1 1 -25 5  8  o 401.8656 3.775283 687.5643  309.7 -16.46289      7.550567 0.98 
1 1 1 -25 5  9  o 263.5502 3.105975 432.1077  282.9 4.967407       6.211949 0.93 
1 1 1 -25 5  10 f 332.7455 3.734453 383.3420  190.7 -7.651337      7.468906 0.00 
1 1 1 -25 5  11 o 167.4832 3.174746 229.9530  333.4 -39.07021      6.349492 0.86 
1 1 1 -25 5  12 o 704.1329 6.312939 907.2773  314.0 -38.22144      12.62588 0.99 
1 1 1 -25 5  13 o 210.4591 3.690720 281.8134  233.9 -9.324234      7.381440 0.90 
1 1 1 -25 5  14 o 192.8421 3.010306 221.0597  111.4 28.29414       6.020613 0.84 
1 1 1 -25 5  15 o 455.4688 4.600264 659.4180  343.2 6.517731       9.200527 0.98 
1 1 1 -25 5  16 o 384.4988 3.891942 643.2874  296.0 25.16907       7.783885 0.98 
1 1 1 -25 5  17 o 212.1898 2.884073 475.4254  279.8 -1.496231      5.768146 0.96 
1 1 1 -25 5  18 o 197.7659 2.983731 241.3159  205.5 7.418045       5.967461 0.94 
1 1 1 -25 5  19 o 99.38051 4.332641 148.9016  282.9 -24.88291      8.665282 0.83 
1 1 1 -25 5  20 o 231.5848 3.198820 341.4552  276.2 -3.196136      6.397639 0.98 
1 1 1 -25 5  21 o 112.3397 3.753555 214.7746  142.9 29.85294       7.507111 0.94 
1 1 1 -25 5  22 o 141.4751 3.325493 201.6227  326.2 -3.804031      6.650985 0.94 
1 1 1 -25 5  23 o 92.36033 4.334214 116.6791  334.2 -18.11101      8.668427 0.88 
1 1 1 -25 5  24 o 69.13097 7.402683 21.69831  165.5 -15.71305      14.80537 0.34 
1 1 1 -25 5  25 o 79.67595 5.819608 152.0679  139.2 37.77406       11.63922 0.92 
1 1 1 -25 5  26 o 180.5404 3.355810 238.0453  12.8  -5.897217      6.711620 0.98 
1 1 1 -25 5  27 o 83.12251 5.476717 110.2072  274.0 -8.379616      10.95343 0.93 
1 1 1 -25 5  28 o 43.06216 9.180703 83.30089  342.6 4.586678       18.36141 0.76 
1 1 1 -25 5  29 o 99.11675 5.555413 116.2162  55.1  4.783325       11.11083 0.92 
1 1 1 -25 5  30 o 76.33000 6.385962 81.58977  45.8  15.29571       12.77192 0.87 
1 1 1 -25 5  31 o 144.1948 4.428380 208.1895  338.8 -6.058685      8.856761 0.98 
1 1 1 -25 5  32 o 69.52487 8.266138 119.1683  237.0 29.95660       16.53228 0.94 
1 1 1 -25 5  33 o 66.88403 12.99580 57.10167  165.9 8.848633       25.99161 0.87 
1 1 1 -25 5  34 o 51.62708 9.744204 42.35254  49.8  32.94626       19.48841 0.78 
1 1 1 -25 5  35 f 29.93252 9.502902 34.39450  254.6 -0.3737030     19.00580 0.00 
1 1 1 -25 5  36 o 65.00760 9.144319 105.8170  324.8 ?              ?        0.95 
1 1 1 -25 7  1  o 307.3423 3.415452 410.7566  160.8 -5.867889      6.830903 0.95 
1 1 1 -25 7  2  o 35.67426 7.144402 119.3644  242.8 9.559856       14.28880 0.17 
1 1 1 -25 7  3  o 497.7454 4.349318 802.0372  283.1 -16.93222      8.698635 0.98 
1 1 1 -25 7  4  o 172.5125 2.483921 383.1820  254.9 -46.48187      4.967843 0.91 
1 1 1 -25 7  5  o 677.7227 5.016113 930.3741  137.0 -5.189697      10.03223 0.99 
1 1 1 -25 7  6  o 455.3502 4.139455 835.9365  136.1 -34.84302      8.278910 0.98 
1 1 1 -25 7  7  o 293.4549 5.122281 421.1986  22.9  ?              ?        0.95 
1 1 1 -25 7  8  o 87.07130 4.073879 91.72573  319.1 -41.66819      8.147758 0.43 
1 1 1 -25 7  9  o 208.2074 2.902478 271.8301  73.6  44.66228       5.804955 0.90 
1 1 1 -25 7  10 o 127.5089 2.781288 365.4782  253.2 -42.19429      5.562576 0.88 
1 1 1 -25 7  11 o 184.0988 3.728185 336.2553  244.3 19.96252       7.456371 0.91 
1 1 1 -25 7  12 o 373.1327 3.631861 479.8508  349.7 -14.52365      7.263722 0.98 
1 1 1 -25 7  13 o 193.4143 3.296681 277.0926  67.2  18.67123       6.593361 0.93 
1 1 1 -25 7  14 o 386.1343 3.965418 629.6963  271.8 -36.74310      7.930837 0.99 
1 1 1 -25 7  15 o 115.0547 3.284522 242.1414  30.0  -17.95570      6.569044 0.91 
1 1 1 -25 7  16 o 187.4935 2.825773 310.9832  177.8 -22.56870      5.651546 0.97 
1 1 1 -25 7  17 o 328.8922 3.543669 623.9005  238.5 -6.978455      7.087339 0.99 
1 1 1 -25 7  18 f 138.0834 3.028649 176.9525  220.4 11.47423       6.057298 0.00 
1 1 1 -25 7  19 o 104.2166 3.787485 127.6864  65.9  6.542183       7.574970 0.89 
1 1 1 -25 7  20 o 120.6543 3.479192 230.4336  33.5  15.36984       6.958385 0.95 
1 1 1 -25 7  21 o 77.62150 6.887497 194.8712  107.1 -34.73770      13.77499 0.92 
1 1 1 -25 7  22 o 162.0163 3.454531 288.0465  189.9 -2.312225      6.909063 0.98 
1 1 1 -25 7  23 o 124.1528 4.342646 240.9102  294.3 -15.42371      8.685291 0.97 
1 1 1 -25 7  24 o 61.57582 7.649715 71.57175  207.4 48.32898       15.29943 0.79 
1 1 1 -25 7  25 o 189.3916 4.916905 278.1431  159.3 11.86520       9.833810 0.99 
1 1 1 -25 7  26 o 35.77290 9.536305 92.93677  318.0 10.65982       19.07261 0.76 
1 1 1 -25 7  27 o 57.27815 9.009076 138.9720  189.1 3.972134       18.01815 0.89 
1 1 1 -25 7  28 o 51.77101 9.873491 141.8428  115.0 -15.75432      19.74698 0.88 
1 1 1 -25 7  29 o 91.90328 6.078625 124.2306  69.1  -9.220108      12.15725 0.94 
1 1 1 -25 7  30 o 34.75768 9.549753 37.31556  332.8 -6.198212      19.09951 0.50 
1 1 1 -25 7  31 o 45.35357 11.10192 86.09810  104.6 -1.750290      22.20383 0.87 
1 1 1 -25 7  32 o 97.65047 5.875643 176.2316  316.2 17.13126       11.75129 0.98 
1 1 1 -25 7  33 o 58.41200 9.934250 51.29449  43.4  -8.570881      19.86850 0.85 
1 1 1 -25 7  34 o 56.12596 13.72650 139.3212  100.2 ?              ?        0.94 
1 1 1 -25 9  1  o 260.3223 4.299907 352.5085  14.1  17.82532       8.599813 0.98 
1 1 1 -25 9  2  o 90.34966 3.668655 152.7565  154.3 17.98746       7.337310 0.82 
1 1 1 -25 9  3  o 319.9012 4.612141 582.2686  240.5 14.86401       9.224281 0.99 
1 1 1 -25 9  4  o 212.1617 2.964885 374.6988  91.9  -12.98253      5.929769 0.97 
1 1 1 -25 9  5  o 241.3013 3.171337 479.4958  198.4 9.137100       6.342673 0.98 
1 1 1 -25 9  6  o 320.3499 3.320607 500.9304  205.4 48.80118       6.641214 0.98 
1 1 1 -25 9  7  o 67.68838 5.306263 81.17412  325.2 -15.33507      10.61253 0.46 
1 1 1 -25 9  8  o 132.4633 3.037394 239.3756  192.6 8.561508       6.074788 0.93 
1 1 1 -25 9  9  o 268.5759 3.352400 542.8776  160.5 13.78842       6.704800 0.99 
1 1 1 -25 9  10 o 183.7955 2.990126 327.2519  30.2  -34.49490      5.980253 0.97 
1 1 1 -25 9  11 o 182.1568 2.888779 237.8477  183.8 0.4534149      5.777558 0.97 
1 1 1 -25 9  12 o 43.76429 6.525533 102.3595  178.3 -36.46780      13.05107 0.57 
1 1 1 -25 9  13 o 139.3713 3.021400 218.4846  144.6 9.272247       6.042801 0.95 
1 1 1 -25 9  14 o 174.4602 3.045046 322.0605  345.7 -34.75531      6.090092 0.97 
1 1 1 -25 9  15 o 113.7978 3.455889 250.4667  311.7 17.26939       6.911779 0.95 
1 1 1 -25 9  16 o 94.17519 4.241340 96.71272  351.7 17.40244       8.482680 0.84 
1 1 1 -25 9  17 o 186.0408 3.157912 325.3837  51.7  -26.49300      6.315825 0.98 
1 1 1 -25 9  18 o 145.1702 3.429059 268.0891  34.6  -2.510284      6.858119 0.98 
1 1 1 -25 9  19 o 86.85158 5.517534 141.4514  4.8   -11.52178      11.03507 0.92 
1 1 1 -25 9  20 o 28.74400 8.477435 91.28822  53.5  7.003500       16.95487 0.59 
1 1 1 -25 9  21 o 130.5717 4.344679 181.4005  318.2 -4.929733      8.689358 0.97 
1 1 1 -25 9  22 o 143.6165 4.190400 212.6041  247.8 -10.09286      8.380799 0.98 
1 1 1 -25 9  23 o 36.66308 10.15165 53.11025  183.4 4.458168       20.30330 0.60 
1 1 1 -25 9  24 o 60.10853 9.600380 63.81701  266.2 -18.84009      19.20076 0.76 
1 1 1 -25 9  25 o 58.93886 11.74675 66.96624  272.1 21.27946       23.49349 0.75 
1 1 1 -25 9  26 o 55.43921 10.19452 85.18870  67.7  23.90164       20.38903 0.82 
1 1 1 -25 9  27 o 100.5114 6.792453 150.1068  261.3 -20.03688      13.58491 0.96 
1 1 1 -25 9  28 o 103.5866 7.204459 121.9631  229.9 0.2696228      14.40892 0.96 
1 1 1 -25 9  29 o 81.23949 12.16191 125.5037  127.0 -45.52612      24.32382 0.95 
1 1 1 -25 9  30 o 99.08510 12.33408 162.0596  93.9  -1.357536      24.66817 0.97 
1 1 1 -25 9  31 o 47.84342 10.78338 125.9851  92.6  34.04085       21.56676 0.93 
1 1 1 -25 9  32 o 51.31553 11.36822 95.02034  133.1 ?              ?        0.92 
1 1 1 -25 11 1  o 187.2292 2.804238 326.3475  286.3 -27.96349      5.608476 0.98 
1 1 1 -25 11 2  o 234.6982 3.044002 379.4796  348.6 5.604248       6.088003 0.99 
1 1 1 -25 11 3  o 56.82708 7.629831 138.7529  43.2  -8.597496      15.25966 0.82 
1 1 1 -25 11 4  o 90.00790 4.134583 176.4328  27.2  22.14716       8.269166 0.92 
1 1 1 -25 11 5  f 157.5880 3.590434 356.9643  116.9 14.38576       7.180867 0.00 
1 1 1 -25 11 6  o 117.0286 3.728994 223.3693  126.8 2.422180       7.457988 0.95 
1 1 1 -25 11 7  o 90.00993 4.644907 231.1146  300.7 7.387146       9.289813 0.94 
1 1 1 -25 11 8  o 322.1656 4.138938 583.7964  6.7   -9.489044      8.277876 0.99 
1 1 1 -25 11 9  o 132.6588 4.550223 213.0802  306.1 -9.490074      9.100446 0.96 
1 1 1 -25 11 10 o 98.02251 5.696781 193.2906  221.2 -3.007538      11.39356 0.95 
1 1 1 -25 11 11 o 123.5855 5.048004 182.0603  79.9  6.895317       10.09601 0.96 
1 1 1 -25 11 12 o 192.6693 4.194355 416.8025  26.1  32.88123       8.388711 0.99 
1 1 1 -25 11 13 o 35.87263 9.035320 60.38494  342.9 -6.997066      18.07064 0.51 
1 1 1 -25 11 14 o 145.0331 5.334882 282.6132  82.0  -27.07249      10.66976 0.98 
1 1 1 -25 11 15 o 169.8528 3.258770 343.3247  48.5  12.68877       6.517540 0.99 
1 1 1 -25 11 16 o 75.13966 5.788146 106.5089  295.7 -5.466629      11.57629 0.91 
1 1 1 -25 11 17 o 49.23308 7.658817 82.46993  150.0 28.74018       15.31763 0.82 
1 1 1 -25 11 18 o 43.29512 8.176949 50.68754  121.0 -9.372993      16.35390 0.70 
1 1 1 -25 11 19 o 77.90545 5.569988 150.1823  119.1 7.921234       11.13998 0.95 
1 1 1 -25 11 20 o 76.38973 5.925353 125.4276  98.0  11.18478       11.85071 0.92 
1 1 1 -25 11 21 o 58.69726 8.271679 117.9680  166.5 -1.568279      16.54336 0.88 
1 1 1 -25 11 22 f 114.3177 4.949199 187.3378  197.9 3.367599       9.898398 0.00 
1 1 1 -25 11 23 o 30.29050 9.557913 61.77125  233.5 15.57208       19.11583 0.58 
1 1 1 -25 11 24 o 86.47281 7.466723 155.0381  126.1 4.047508       14.93345 0.96 
1 1 1 -25 11 25 o 50.67110 12.81101 45.50767  148.3 -10.01743      25.62202 0.72 
1 1 1 -25 11 26 f 91.59045 7.867377 64.96143  75.5  -8.007492      15.73475 0.00 
1 1 1 -25 11 27 o 44.36478 11.93074 12.47303  159.4 1.775280       23.86148 0.31 
1 1 1 -25 11 28 o 44.61696 11.97537 30.33883  7.2   15.26463       23.95073 0.62 
1 1 1 -25 11 29 o 36.81991 11.63880 22.01268  359.4 1.692444       23.27761 0.46 
1 1 1 -25 11 30 f 37.51287 18.22430 100.2294  138.1 ?              ?        0.00 
1 1 1 -25 13 1  o 94.84011 5.042037 129.3603  1.1   28.91144       10.08407 0.96 
1 1 1 -25 13 2  o 223.8752 3.445808 294.1509  266.0 -5.055832      6.891616 0.99 
1 1 1 -25 13 3  o 234.6433 3.461596 359.3821  280.8 11.17252       6.923192 0.99 
1 1 1 -25 13 4  f 37.60362 8.791090 89.07258  132.6 26.11373       17.58218 0.00 
1 1 1 -25 13 5  o 180.5564 4.146532 213.2548  343.8 0.4156494      8.293064 0.99 
1 1 1 -25 13 6  o 113.7184 4.216317 109.9443  83.9  10.59002       8.432633 0.96 
1 1 1 -25 13 7  o 112.1379 4.682603 180.7119  101.7 -3.773811      9.365207 0.97 
1 1 1 -25 13 8  o 64.06236 8.321231 128.8868  130.3 -5.340416      16.64246 0.93 
1 1 1 -25 13 9  o 248.3347 4.842961 434.2019  81.3  -34.93327      9.685923 1.00 
1 1 1 -25 13 10 o 156.6764 5.725739 304.9916  182.9 -35.30093      11.45148 0.99 
1 1 1 -25 13 11 o 236.2815 4.449009 420.7207  204.7 -26.79395      8.898018 0.99 
1 1 1 -25 13 12 o 74.58115 10.27689 199.6833  185.5 -9.178291      20.55379 0.95 
1 1 1 -25 13 13 o 148.6962 5.936495 268.3676  155.1 -2.266541      11.87299 0.98 
1 1 1 -25 13 14 o 136.1623 6.973314 206.1623  127.6 -35.83133      13.94663 0.97 
1 1 1 -25 13 15 o 44.56119 11.46595 56.15051  98.9  28.28773       22.93190 0.62 
1 1 1 -25 13 16 o 107.2406 4.727524 166.8794  78.7  ?              ?        0.96 
1 1 1 -25 13 17 o 27.91752 9.767500 112.4089  99.5  18.92354       19.53500 0.74 
1 1 1 -25 13 18 o 105.7450 9.467232 192.2524  139.1 -13.11120      18.93446 0.97 
1 1 1 -25 13 19 o 87.81081 11.54725 153.0237  173.8 -6.479179      23.09451 0.96 
1 1 1 -25 13 20 o 45.36784 11.46142 26.33936  223.1 28.31920       22.92284 0.50 
1 1 1 -25 13 21 o 45.60816 9.691032 96.00628  30.5  -14.67445      19.38206 0.90 
1 1 1 -25 13 22 o 57.34595 12.75411 108.4667  32.3  10.45976       25.50823 0.93 
1 1 1 -25 13 23 o 27.12226 9.730680 41.28501  359.8 15.95465       19.46136 0.60 
1 1 1 -25 13 24 o 36.26965 12.29445 74.90979  276.6 6.280342       24.58891 0.82 
1 1 1 -25 13 25 o 48.15992 12.29165 63.34212  29.0  -9.867226      24.58329 0.85 
1 1 1 -25 13 26 o 35.74058 11.31489 38.49739  311.0 ?              ?        0.69 
1 1 1 -25 15 1  o 84.70250 6.710547 127.5736  45.8  10.19774       13.42109 0.95 
1 1 1 -25 15 2  o 123.3215 4.717035 231.4281  226.5 7.795792       9.434070 0.98 
1 1 1 -25 15 3  o 46.48122 9.109134 63.78540  166.1 37.31028       18.21827 0.78 
1 1 1 -25 15 4  f 59.77364 9.517941 137.6036  340.9 7.749119       19.03588 0.00 
1 1 1 -25 15 5  o 191.7268 4.477832 329.6537  260.8 10.70737       8.955665 0.99 
1 1 1 -25 15 6  o 164.5159 4.482281 308.4769  230.7 -2.666397      8.964561 0.99 
1 1 1 -25 15 7  o 108.6050 5.871205 170.1095  269.1 24.16051       11.74241 0.97 
1 1 1 -25 15 8  o 64.24469 9.117403 74.02700  276.7 -20.90166      18.23481 0.88 
1 1 1 -25 15 9  o 39.91702 11.66178 65.09907  270.0 10.56622       23.32357 0.75 
1 1 1 -25 15 10 o 75.14668 11.15625 119.4805  18.2  7.499512       22.31249 0.94 
1 1 1 -25 15 11 o 90.94534 10.53786 104.0639  190.7 -14.54694      21.07571 0.95 
1 1 1 -25 15 12 o 109.6159 9.643843 199.8977  186.4 -31.06940      19.28769 0.98 
1 1 1 -25 15 13 o 77.72144 11.75825 188.7396  183.4 -48.59506      23.51650 0.97 
1 1 1 -25 15 14 o 39.76267 12.53663 57.93405  8.7   28.72606       25.07327 0.77 
1 1 1 -25 15 15 o 38.36819 12.09290 60.12107  144.4 24.63322       24.18579 0.80 
1 1 1 -25 15 16 o 131.8880 8.773382 225.9205  186.5 -26.45686      17.54676 0.99 
1 1 1 -25 15 17 o 106.9868 8.824167 208.5779  198.2 20.20073       17.64833 0.98 
1 1 1 -25 15 18 o 53.36623 12.72258 118.2452  247.1 -13.97412      25.44517 0.93 
1 1 1 -25 15 19 f 45.54905 9.742353 76.92669  342.9 -16.17709      19.48471 0.00 
1 1 1 -25 15 20 o 44.84486 16.06045 108.1174  276.8 ?              ?        0.89 
1 1 1 -25 15 21 o 71.49547 14.23496 113.0022  329.5 ?              ?        0.95 
1 1 1 -25 17 1  o 38.00232 9.859981 19.28665  355.6 -20.04613      19.71996 0.48 
1 1 1 -25 17 2  o 26.90260 9.178512 27.07003  285.3 9.260551       18.35702 0.49 
1 1 1 -25 17 3  o 53.69893 10.98341 137.6637  19.9  -7.624111      21.96683 0.95 
1 1 1 -25 17 4  o 61.78775 10.59988 147.4417  14.0  -16.99292      21.19975 0.96 
1 1 1 -25 17 5  o 34.25122 10.55242 22.48357  259.0 5.100338       21.10483 0.48 
1 1 1 -25 17 6  f 62.34128 10.92440 148.8167  156.3 -4.745110      21.84881 0.00 
1 1 1 -25 17 7  o 37.92501 10.91510 62.54000  77.9  10.10033       21.83019 0.83 
1 1 1 -25 17 8  o 51.00395 10.40203 102.7019  318.1 -26.30775      20.80407 0.93 
1 1 1 -25 17 9  o 70.76555 10.64973 166.8367  311.5 -29.54682      21.29946 0.97 
1 1 1 -25 17 10 o 47.81917 13.24274 56.36737  57.1  ?              ?        0.83 
1 1 1 -25 17 11 o 31.64333 10.78713 29.47412  30.3  ?              ?        0.57 
1 1 1 -25 17 12 o 67.08610 11.88310 91.32503  293.1 ?              ?        0.94 
1 1 1 -25 17 13 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -24 0  1  o 323.5161 5.419523 539.9955  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  2  o 129.8677 3.980560 90.06503  180.0 -0.000000      0.000000 0.83 
1 1 1 -24 0  3  o 270.5157 5.166291 182.1268  0.0   -0.000000      0.000000 0.89 
1 1 1 -24 0  4  o 744.4448 9.860760 1102.814  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  5  o 279.5986 5.157369 178.8624  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  6  o 360.1517 6.351375 390.7299  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  7  o 69.22324 5.729539 14.98441  180.0 -0.000000      0.000000 0.09 
1 1 1 -24 0  8  o 52.84975 7.173112 70.09700  0.0   -0.000000      0.000000 0.08 
1 1 1 -24 0  9  o 113.4430 4.484262 399.9814  0.0   -0.000000      0.000000 0.85 
1 1 1 -24 0  10 o 386.4900 5.963635 516.3346  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  11 o 340.4088 5.594916 974.4675  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  12 o 142.6661 3.996973 459.8787  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  13 o 669.5592 8.757520 768.6160  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  14 o 526.8304 9.410487 489.8876  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  15 o 95.15701 4.792854 120.9586  180.0 -0.000000      0.000000 0.12 
1 1 1 -24 0  16 o 191.3903 3.860739 260.5490  0.0   -0.000000      0.000000 0.96 
1 1 1 -24 0  17 o 264.5726 4.305668 341.4847  180.0 -0.000000      0.000000 0.99 
1 1 1 -24 0  18 o 417.8794 5.727990 361.7388  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  19 o 204.8698 4.084634 431.1850  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  20 o 49.58007 7.814435 6.994698  180.0 -0.000000      0.000000 0.09 
1 1 1 -24 0  21 o 296.5432 4.922000 628.5280  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  22 o 186.4136 4.682467 206.3642  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  23 o 120.6022 4.586953 172.8067  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  24 o 267.0846 4.298438 311.9514  0.0   -0.000000      0.000000 1.00 
1 1 1 -24 0  25 o 19.18239 12.37724 91.94751  180.0 -0.000000      0.000000 0.31 
1 1 1 -24 0  26 o 315.2799 5.448401 333.1793  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  27 o 180.7715 4.631786 328.9035  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  28 o 251.8983 4.593659 449.8533  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  29 o 56.09263 13.34776 51.80751  180.0 -0.000000      0.000000 0.79 
1 1 1 -24 0  30 f 131.3608 6.465801 203.2344  0.0   -0.000000      0.000000 0.00 
1 1 1 -24 0  31 o 28.36993 17.10215 11.00345  0.0   -0.000000      0.000000 0.08 
1 1 1 -24 0  32 o 35.07434 16.73531 6.361832  180.0 -0.000000      0.000000 0.07 
1 1 1 -24 0  33 o 83.99625 9.417088 63.09987  0.0   -0.000000      0.000000 0.98 
1 1 1 -24 0  34 o 33.68626 18.14450 32.43556  180.0 -0.000000      0.000000 0.47 
1 1 1 -24 0  35 o 115.1316 8.195210 158.2542  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  36 o 109.3043 8.145973 168.9113  180.0 -0.000000      0.000000 1.00 
1 1 1 -24 0  37 o 63.80422 15.45360 82.22460  180.0 ?              ?        1.00 
1 1 1 -24 2  1  f 248.0364 3.537255 462.1730  156.4 23.22380       7.074510 0.00 
1 1 1 -24 2  2  o 254.3753 3.324843 195.0179  139.9 46.88412       6.649686 0.93 
1 1 1 -24 2  3  o 285.6396 3.290435 362.6456  297.3 -23.67706      6.580869 0.95 
1 1 1 -24 2  4  o 101.5026 3.894539 297.1926  350.2 -79.09952      7.789078 0.22 
1 1 1 -24 2  5  o 228.3888 3.343473 488.5469  200.2 30.43346       6.686946 0.91 
1 1 1 -24 2  6  o 429.8352 4.740151 1114.146  141.8 13.56512       9.480302 0.98 
1 1 1 -24 2  7  o 180.2387 3.059691 474.0759  212.9 -33.18777      6.119383 0.84 
1 1 1 -24 2  8  o 273.4879 3.405367 567.8425  107.5 -85.04575      6.810733 0.91 
1 1 1 -24 2  9  o 307.3766 3.795782 380.4067  79.9  -14.44437      7.591564 0.94 
1 1 1 -24 2  10 o 684.0205 6.273106 958.5715  148.5 -36.48962      12.54621 0.99 
1 1 1 -24 2  11 o 112.7595 3.456277 257.6142  202.4 0.1669846      6.912554 0.79 
1 1 1 -24 2  12 o 35.27777 6.098382 70.87485  136.2 -19.86241      12.19676 0.18 
1 1 1 -24 2  13 o 377.6531 3.961815 553.8688  333.6 29.90955       7.923629 0.97 
1 1 1 -24 2  14 o 508.8307 4.655623 566.8397  61.5  22.63492       9.311247 0.98 
1 1 1 -24 2  15 o 252.7429 3.148879 354.0795  266.0 -14.81158      6.297758 0.92 
1 1 1 -24 2  16 o 90.14444 4.130544 226.8252  164.0 -12.92091      8.261088 0.60 
1 1 1 -24 2  17 o 64.07009 4.533511 133.8111  248.5 -8.337376      9.067022 0.30 
1 1 1 -24 2  18 o 337.7840 3.613221 483.1659  267.3 -22.73511      7.226443 0.97 
1 1 1 -24 2  19 o 196.7923 2.759275 293.2281  10.3  32.64859       5.518549 0.92 
1 1 1 -24 2  20 o 69.40995 4.598322 22.50797  264.2 41.32273       9.196644 0.18 
1 1 1 -24 2  21 o 180.6052 3.522528 309.6924  307.3 -10.80234      7.045056 0.95 
1 1 1 -24 2  22 o 99.96568 3.266224 214.2346  13.3  18.44128       6.532448 0.91 
1 1 1 -24 2  23 o 286.2111 3.375322 510.8060  277.3 -21.53439      6.750644 0.99 
1 1 1 -24 2  24 o 138.0701 3.260715 178.4023  76.3  -11.77310      6.521431 0.93 
1 1 1 -24 2  25 o 147.9255 3.648701 251.5134  39.0  22.23152       7.297402 0.96 
1 1 1 -24 2  26 o 364.6846 4.052485 562.7064  231.0 -11.70660      8.104970 1.00 
1 1 1 -24 2  27 o 191.4981 3.282394 302.7671  203.0 13.61949       6.564788 0.98 
1 1 1 -24 2  28 o 39.43728 9.332088 44.61076  170.8 21.58196       18.66418 0.47 
1 1 1 -24 2  29 o 159.0378 4.162325 211.2569  347.5 8.120880       8.324650 0.98 
1 1 1 -24 2  30 o 109.9905 4.490656 123.5407  327.5 30.97134       8.981312 0.94 
1 1 1 -24 2  31 o 51.99464 9.882483 26.50251  329.1 15.05352       19.76497 0.37 
1 1 1 -24 2  32 o 90.33687 6.039887 114.1775  213.4 28.08581       12.07977 0.93 
1 1 1 -24 2  33 o 73.36833 7.800303 123.8385  248.6 13.68945       15.60061 0.94 
1 1 1 -24 2  34 o 82.10776 7.298245 125.5404  324.6 -9.655220      14.59649 0.96 
1 1 1 -24 2  35 o 54.41998 10.99850 75.02766  341.4 -4.086742      21.99701 0.88 
1 1 1 -24 2  36 o 78.59679 8.728422 130.0136  115.8 0.9095764E-01  17.45684 0.96 
1 1 1 -24 2  37 o 36.70830 11.08948 41.14687  237.5 ?              ?        0.70 
1 1 1 -24 4  1  o 355.6959 3.322300 619.4845  248.5 -29.69330      6.644600 0.97 
1 1 1 -24 4  2  o 465.3931 4.105394 729.2464  188.2 93.86426       8.210789 0.97 
1 1 1 -24 4  3  o 156.6200 2.481345 366.6647  74.2  27.08069       4.962690 0.85 
1 1 1 -24 4  4  o 601.3947 5.202596 868.7972  169.3 -44.80676      10.40519 0.98 
1 1 1 -24 4  5  o 540.0157 4.540990 687.4775  105.8 -76.63412      9.081981 0.98 
1 1 1 -24 4  6  o 592.6001 5.273116 837.0215  241.3 78.82214       10.54623 0.99 
1 1 1 -24 4  7  o 459.4405 4.580056 681.1215  243.6 -6.716248      9.160112 0.98 
1 1 1 -24 4  8  o 586.1179 5.450904 1011.999  81.5  -21.46124      10.90181 0.99 
1 1 1 -24 4  9  f 208.0700 2.964258 515.4372  236.5 6.156921       5.928515 0.00 
1 1 1 -24 4  10 o 404.6447 4.101158 562.0110  252.8 12.08038       8.202315 0.97 
1 1 1 -24 4  11 o 140.0747 2.922398 144.6754  183.4 -3.114319      5.844796 0.63 
1 1 1 -24 4  12 o 193.5670 2.917953 382.5704  22.0  -91.22414      5.835905 0.90 
1 1 1 -24 4  13 f 483.8448 4.712664 1083.804  322.7 -3.666718      9.425327 0.00 
1 1 1 -24 4  14 o 155.4239 2.792316 111.6182  303.9 2.117386       5.584632 0.21 
1 1 1 -24 4  15 o 426.7506 4.181796 651.0665  179.9 10.69894       8.363592 0.98 
1 1 1 -24 4  16 o 148.8306 2.733260 292.8905  199.5 30.02907       5.466520 0.86 
1 1 1 -24 4  17 o 92.10899 3.538533 125.4109  291.4 29.87704       7.077066 0.40 
1 1 1 -24 4  18 o 322.3992 3.446749 558.7239  150.3 80.43149       6.893497 0.98 
1 1 1 -24 4  19 o 102.9299 3.326657 104.4485  79.4  26.65757       6.653315 0.65 
1 1 1 -24 4  20 o 195.9800 3.018221 266.0127  329.9 16.66095       6.036441 0.95 
1 1 1 -24 4  21 o 246.7197 3.267365 412.3501  255.5 7.781418       6.534731 0.98 
1 1 1 -24 4  22 o 99.07198 4.510422 166.3645  353.5 -79.28506      9.020844 0.90 
1 1 1 -24 4  23 o 204.8586 2.935066 394.4117  34.9  -6.874008      5.870133 0.98 
1 1 1 -24 4  24 o 144.6218 3.960092 226.0713  35.9  12.43109       7.920184 0.96 
1 1 1 -24 4  25 o 30.86438 7.956546 94.48085  317.4 10.81593       15.91309 0.57 
1 1 1 -24 4  26 o 171.0178 3.474565 266.2317  297.2 7.386414       6.949131 0.98 
1 1 1 -24 4  27 o 54.59002 7.922938 52.05136  327.7 -4.554470      15.84588 0.65 
1 1 1 -24 4  28 o 107.5824 4.385065 153.2166  80.2  -21.57059      8.770130 0.96 
1 1 1 -24 4  29 o 147.3527 3.971544 176.0183  40.5  -1.472122      7.943087 0.97 
1 1 1 -24 4  30 o 118.0936 4.951644 193.6891  228.6 -5.354324      9.903289 0.96 
1 1 1 -24 4  31 o 40.04965 9.141637 49.83468  248.7 -12.07361      18.28327 0.55 
1 1 1 -24 4  32 o 106.2068 5.311269 181.2735  228.3 12.16346       10.62254 0.97 
1 1 1 -24 4  33 o 38.61664 10.39517 51.90645  320.0 5.078377       20.79034 0.70 
1 1 1 -24 4  34 o 57.00191 8.855978 96.57934  201.5 -29.90373      17.71196 0.92 
1 1 1 -24 4  35 o 63.96415 10.76149 68.49387  217.3 -0.7805862     21.52299 0.90 
1 1 1 -24 4  36 o 84.47663 8.948543 126.2683  315.0 ?              ?        0.97 
1 1 1 -24 6  1  o 611.4312 5.774734 739.7639  173.8 41.12268       11.54947 0.99 
1 1 1 -24 6  2  o 616.0258 4.728534 718.1093  259.2 49.44415       9.457068 0.98 
1 1 1 -24 6  3  o 140.5494 2.463153 275.6959  345.5 -4.171616      4.926306 0.69 
1 1 1 -24 6  4  o 430.8480 3.940347 701.8372  48.1  3.684875       7.880693 0.98 
1 1 1 -24 6  5  o 246.8322 2.907648 318.7930  307.3 7.769943       5.815296 0.92 
1 1 1 -24 6  6  o 378.8466 3.774307 570.7335  188.3 55.52582       7.548614 0.97 
1 1 1 -24 6  7  o 245.0222 3.100368 430.8628  60.7  -21.93192      6.200737 0.93 
1 1 1 -24 6  8  o 229.4202 2.657209 415.9611  78.2  53.20392       5.314419 0.94 
1 1 1 -24 6  9  o 527.0042 4.466684 831.5955  259.9 0.1091309      8.933368 0.99 
1 1 1 -24 6  10 o 283.2814 3.712035 344.0763  271.5 -35.66238      7.424070 0.93 
1 1 1 -24 6  11 o 153.0879 2.818777 306.4367  93.2  -5.870987      5.637553 0.85 
1 1 1 -24 6  12 o 263.9183 3.302927 547.3987  20.9  12.90640       6.605855 0.96 
1 1 1 -24 6  13 o 378.1640 3.758635 527.8969  100.4 -1.925415      7.517270 0.97 
1 1 1 -24 6  14 o 100.9132 4.632728 36.34984  155.2 8.762352       9.265455 0.34 
1 1 1 -24 6  15 o 289.2233 3.246630 314.8992  323.4 30.14200       6.493260 0.96 
1 1 1 -24 6  16 o 73.87290 4.603131 81.44334  52.5  -10.16948      9.206263 0.43 
1 1 1 -24 6  17 o 182.2815 3.103180 346.6669  120.1 -7.446213      6.206360 0.95 
1 1 1 -24 6  18 o 99.07029 3.994070 235.6868  29.4  -25.22856      7.988139 0.91 
1 1 1 -24 6  19 o 207.2061 3.012012 357.0113  135.2 0.4245453      6.024024 0.98 
1 1 1 -24 6  20 o 69.97516 5.395898 127.6880  148.1 30.67498       10.79180 0.79 
1 1 1 -24 6  21 o 87.68217 4.805943 112.7793  54.1  22.49773       9.611886 0.82 
1 1 1 -24 6  22 o 226.1094 3.156407 305.7710  146.2 -16.07884      6.312813 0.98 
1 1 1 -24 6  23 o 62.72234 5.714087 135.1715  127.9 12.89813       11.42817 0.87 
1 1 1 -24 6  24 o 159.8197 4.989761 186.7186  38.8  8.084732       9.979522 0.97 
1 1 1 -24 6  25 o 150.4038 3.966032 237.3941  177.7 -30.50798      7.932063 0.98 
1 1 1 -24 6  26 o 92.58199 4.721063 166.1156  298.2 -6.166222      9.442126 0.96 
1 1 1 -24 6  27 o 49.68710 9.023787 62.53476  295.1 7.814510       18.04757 0.75 
1 1 1 -24 6  28 o 66.93295 7.714559 83.16051  358.7 14.55360       15.42912 0.83 
1 1 1 -24 6  29 o 47.91409 9.557799 92.70920  328.3 -17.87627      19.11560 0.79 
1 1 1 -24 6  30 o 41.01578 9.401237 69.89951  305.9 16.45749       18.80247 0.71 
1 1 1 -24 6  31 o 38.48528 11.73424 63.13612  17.8  -12.98094      23.46849 0.71 
1 1 1 -24 6  32 o 141.4628 4.656511 219.9411  312.4 -5.128647      9.313022 0.99 
1 1 1 -24 6  33 o 98.87754 5.802447 164.8060  321.9 5.593109       11.60489 0.98 
1 1 1 -24 6  34 o 66.49403 9.023399 79.72671  54.2  -21.95263      18.04680 0.92 
1 1 1 -24 6  35 o 31.75071 9.714731 25.67135  324.4 ?              ?        0.50 
1 1 1 -24 8  1  o 140.0080 2.946414 201.7116  50.3  -48.66404      5.892828 0.85 
1 1 1 -24 8  2  o 29.93907 7.311043 71.32458  82.3  8.222462       14.62209 0.13 
1 1 1 -24 8  3  o 638.1187 5.725091 875.8249  280.9 26.98712       11.45018 0.99 
1 1 1 -24 8  4  o 169.1537 3.539066 290.4910  280.2 -13.16603      7.078132 0.91 
1 1 1 -24 8  5  o 232.3099 2.864278 440.8976  229.2 -21.79704      5.728556 0.95 
1 1 1 -24 8  6  o 343.9141 4.568950 520.5696  126.5 -57.70621      9.137900 0.98 
1 1 1 -24 8  7  o 86.63498 3.761909 183.9149  76.6  -43.52251      7.523818 0.61 
1 1 1 -24 8  8  o 174.2932 3.253539 320.8268  293.6 2.855820       6.507077 0.93 
1 1 1 -24 8  9  o 144.9083 2.892590 325.8250  82.6  37.27415       5.785179 0.92 
1 1 1 -24 8  10 o 130.8328 3.231866 204.7348  300.3 -16.05561      6.463732 0.86 
1 1 1 -24 8  11 o 286.9041 3.156394 412.6745  264.4 17.84949       6.312788 0.97 
1 1 1 -24 8  12 o 161.7159 2.764313 263.5350  137.5 -20.93491      5.528625 0.94 
1 1 1 -24 8  13 o 295.1608 3.462386 530.1157  177.9 -33.84381      6.924773 0.99 
1 1 1 -24 8  14 o 92.90575 4.461555 191.6663  285.1 -37.20512      8.923110 0.88 
1 1 1 -24 8  15 o 142.3186 3.266006 233.7311  323.6 -16.48265      6.532013 0.96 
1 1 1 -24 8  16 o 257.5310 3.427991 365.0001  40.7  -24.54852      6.855981 0.98 
1 1 1 -24 8  17 o 199.8581 3.046955 270.8483  18.6  3.198746       6.093909 0.97 
1 1 1 -24 8  18 o 162.9080 3.253702 241.5004  99.8  -30.77513      6.507404 0.96 
1 1 1 -24 8  19 o 284.8453 3.347744 418.9822  175.8 6.045441       6.695489 0.99 
1 1 1 -24 8  20 o 178.2189 3.185708 264.2617  155.3 42.26508       6.371416 0.98 
1 1 1 -24 8  21 o 80.05866 5.413438 159.2905  251.4 7.922974       10.82688 0.92 
1 1 1 -24 8  22 o 98.67181 5.460040 228.1916  194.6 -11.93752      10.92008 0.96 
1 1 1 -24 8  23 o 56.98455 9.118922 131.8474  192.5 22.33224       18.23784 0.89 
1 1 1 -24 8  24 o 119.8642 4.770989 169.0468  260.9 13.73403       9.541978 0.97 
1 1 1 -24 8  25 f 178.6150 4.135912 314.2244  162.6 -0.7032166     8.271825 0.00 
1 1 1 -24 8  26 o 157.6317 4.329850 253.1513  69.8  -2.002045      8.659700 0.98 
1 1 1 -24 8  27 o 91.31938 6.584805 101.0259  13.5  13.15531       13.16961 0.92 
1 1 1 -24 8  28 f 34.09999 10.07126 100.9278  44.3  -4.897827      20.14252 0.00 
1 1 1 -24 8  29 o 101.7603 6.300390 171.9176  51.3  2.941414       12.60078 0.97 
1 1 1 -24 8  30 o 58.62601 13.76426 91.41815  3.2   -4.787445      27.52852 0.90 
1 1 1 -24 8  31 o 85.59383 7.591323 134.2378  197.8 -7.546242      15.18265 0.97 
1 1 1 -24 8  32 o 38.52957 8.881780 46.43609  39.3  -29.24687      17.76356 0.74 
1 1 1 -24 8  33 o 74.96197 8.854568 138.6883  112.9 -26.08702      17.70914 0.97 
1 1 1 -24 10 1  o 219.1389 2.811976 410.8075  335.3 14.50079       5.623952 0.98 
1 1 1 -24 10 2  o 197.2269 3.293599 324.1641  257.7 19.22348       6.587199 0.98 
1 1 1 -24 10 3  o 169.8244 2.792779 284.8500  247.4 17.44888       5.585558 0.97 
1 1 1 -24 10 4  o 222.2018 3.056724 362.5161  84.7  22.17871       6.113448 0.98 
1 1 1 -24 10 5  f 191.9091 3.177254 382.7675  81.2  -28.20631      6.354507 0.00 
1 1 1 -24 10 6  o 166.6514 3.744243 313.6312  218.3 22.54742       7.488486 0.97 
1 1 1 -24 10 7  o 273.3459 4.230083 426.1390  257.9 ?              ?        0.99 
1 1 1 -24 10 8  o 231.8939 3.538648 494.4832  18.8  -4.537888      7.077295 0.99 
1 1 1 -24 10 9  o 263.2468 3.817067 512.5535  55.9  -25.13405      7.634135 0.99 
1 1 1 -24 10 10 o 95.63498 5.474969 168.4506  66.1  -51.04720      10.94994 0.90 
1 1 1 -24 10 11 o 170.4881 3.777750 310.7419  18.1  -28.62787      7.555500 0.97 
1 1 1 -24 10 12 o 238.0468 3.153492 437.6498  1.6   19.14885       6.306985 0.99 
1 1 1 -24 10 13 o 180.7747 2.998390 306.3380  187.7 -14.46243      5.996781 0.98 
1 1 1 -24 10 14 o 116.0757 3.790185 324.4945  98.1  0.8370895      7.580369 0.97 
1 1 1 -24 10 15 o 59.85024 6.819953 152.1429  118.1 -16.91684      13.63991 0.88 
1 1 1 -24 10 16 o 185.9339 3.020651 351.6324  287.8 -9.495407      6.041301 0.99 
1 1 1 -24 10 17 o 23.97115 7.378221 60.68663  109.9 5.502396       14.75644 0.38 
1 1 1 -24 10 18 o 169.3372 3.162380 296.5798  196.4 0.9872437E-02  6.324761 0.98 
1 1 1 -24 10 19 f 132.9248 3.773445 229.0292  222.9 5.082062       7.546890 0.00 
1 1 1 -24 10 20 o 78.12480 5.880807 132.1785  167.8 13.73914       11.76161 0.94 
1 1 1 -24 10 21 o 51.12902 9.329083 63.79821  50.2  7.651917       18.65817 0.79 
1 1 1 -24 10 22 o 61.85347 8.229131 152.9265  51.2  -49.77495      16.45826 0.92 
1 1 1 -24 10 23 f 82.90206 6.873665 82.52449  246.1 8.151901       13.74733 0.00 
1 1 1 -24 10 24 f 106.7238 5.414724 135.4614  180.7 -7.677414      10.82945 0.00 
1 1 1 -24 10 25 o 135.5005 5.339252 242.0195  161.2 -6.802475      10.67850 0.98 
1 1 1 -24 10 26 o 74.96662 9.969192 175.5152  99.8  -50.12935      19.93838 0.96 
1 1 1 -24 10 27 f 38.28323 11.95660 25.81871  350.0 -17.21415      23.91321 0.00 
1 1 1 -24 10 28 o 63.13548 9.629309 103.9282  306.2 -47.22832      19.25862 0.94 
1 1 1 -24 10 29 o 60.49725 12.06767 50.81982  241.9 2.539089       24.13535 0.84 
1 1 1 -24 10 30 o 38.21286 12.40708 28.80802  99.5  1.200699       24.81417 0.54 
1 1 1 -24 10 31 o 46.78212 14.31872 12.70248  319.9 ?              ?        0.32 
1 1 1 -24 12 1  o 113.1558 3.693621 208.2029  124.4 -16.70335      7.387242 0.96 
1 1 1 -24 12 2  o 107.2205 3.641891 238.6607  248.5 4.301804       7.283782 0.97 
1 1 1 -24 12 3  o 130.8105 3.998039 225.4356  306.7 23.10945       7.996078 0.97 
1 1 1 -24 12 4  f 46.03531 8.568823 88.78944  3.2   -1.754227      17.13765 0.00 
1 1 1 -24 12 5  o 164.7607 3.532209 289.1213  120.4 -6.096298      7.064418 0.98 
1 1 1 -24 12 6  o 140.9882 3.504227 239.7507  28.0  15.12503       7.008455 0.98 
1 1 1 -24 12 7  o 24.97053 7.924982 35.52586  80.7  15.06026       15.84996 0.25 
1 1 1 -24 12 8  o 105.4851 3.955736 169.1005  136.4 18.79321       7.911473 0.95 
1 1 1 -24 12 9  o 127.5752 5.193857 180.8780  189.6 17.34159       10.38771 0.96 
1 1 1 -24 12 10 o 277.5138 4.581481 497.3249  175.0 -46.87198      9.162963 0.99 
1 1 1 -24 12 11 o 62.07854 9.377079 120.6698  273.6 -20.53161      18.75416 0.88 
1 1 1 -24 12 12 o 164.6031 4.935109 294.7263  20.2  -0.1129150E-02 9.870217 0.99 
1 1 1 -24 12 13 o 64.81448 9.194536 77.85183  222.2 -43.15270      18.38907 0.85 
1 1 1 -24 12 14 o 98.29568 5.786912 249.1663  249.8 10.41664       11.57382 0.98 
1 1 1 -24 12 15 f 152.0781 6.135273 178.5068  0.9   -41.03734      12.27055 0.00 
1 1 1 -24 12 16 o 100.1197 8.412797 158.4880  314.1 -31.12598      16.82559 0.96 
1 1 1 -24 12 17 o 192.0285 4.954086 384.4656  297.2 -4.541489      9.908172 0.99 
1 1 1 -24 12 18 o 153.6382 5.862262 308.9669  333.3 -14.64348      11.72452 0.98 
1 1 1 -24 12 19 o 27.10484 9.127575 36.32190  340.9 12.16476       18.25515 0.31 
1 1 1 -24 12 20 o 23.24207 7.492459 33.09916  15.0  0.2285995      14.98492 0.28 
1 1 1 -24 12 21 o 88.67529 5.725247 193.9585  87.6  -8.603027      11.45049 0.97 
1 1 1 -24 12 22 o 34.39281 9.682717 103.7160  11.4  3.592991       19.36543 0.83 
1 1 1 -24 12 23 o 48.05595 10.01060 45.65541  187.0 19.13972       20.02120 0.74 
1 1 1 -24 12 24 o 61.29001 9.021615 134.1818  171.6 34.54340       18.04323 0.95 
1 1 1 -24 12 25 o 99.76799 6.866536 152.6483  10.8  -7.238792      13.73307 0.98 
1 1 1 -24 12 26 o 51.21075 11.59278 81.04310  334.2 32.65354       23.18555 0.89 
1 1 1 -24 12 27 o 40.39736 10.44685 68.68918  127.1 33.51896       20.89370 0.85 
1 1 1 -24 12 28 o 52.64321 14.64125 88.76929  39.5  ?              ?        0.90 
1 1 1 -24 14 1  o 112.9334 4.248262 164.2796  102.4 28.13551       8.496524 0.96 
1 1 1 -24 14 2  o 126.7903 4.444963 113.9943  218.4 -9.945839      8.889925 0.95 
1 1 1 -24 14 3  o 98.82899 5.075966 176.3355  256.0 32.27134       10.15193 0.96 
1 1 1 -24 14 4  o 179.7917 3.519202 305.0459  166.4 -11.59525      7.038404 0.99 
1 1 1 -24 14 5  o 132.4687 5.777111 237.1034  149.5 -10.69860      11.55422 0.98 
1 1 1 -24 14 6  o 257.7376 3.593828 499.2640  199.4 -0.6098633     7.187655 0.99 
1 1 1 -24 14 7  o 184.9631 3.837295 357.5827  262.5 0.1445923      7.674590 0.99 
1 1 1 -24 14 8  o 144.6874 4.231137 260.4064  32.1  -5.028717      8.462275 0.98 
1 1 1 -24 14 9  o 163.4178 5.262774 283.6703  50.1  -42.49149      10.52555 0.99 
1 1 1 -24 14 10 o 42.40938 11.91237 61.82278  296.1 15.47011       23.82473 0.64 
1 1 1 -24 14 11 o 111.7919 8.175965 196.5709  90.9  8.064819       16.35193 0.97 
1 1 1 -24 14 12 o 163.3874 6.534945 308.8448  123.4 -39.07777      13.06989 0.99 
1 1 1 -24 14 13 o 116.5587 7.468397 220.9763  186.8 16.54198       14.93679 0.98 
1 1 1 -24 14 14 o 77.05810 11.71237 119.8318  266.7 -39.23831      23.42473 0.93 
1 1 1 -24 14 15 o 49.61513 10.77203 82.97279  196.7 57.05074       21.54405 0.84 
1 1 1 -24 14 16 o 58.13123 9.497725 117.3746  141.5 -37.07635      18.99545 0.92 
1 1 1 -24 14 17 o 71.47145 11.75428 129.8544  331.6 -1.597054      23.50857 0.94 
1 1 1 -24 14 18 o 88.91683 11.40034 164.4897  262.6 -5.050797      22.80069 0.97 
1 1 1 -24 14 19 o 42.88502 10.34567 58.80111  173.0 -4.410694      20.69133 0.83 
1 1 1 -24 14 20 o 43.63504 13.23641 83.71712  73.4  19.05598       26.47281 0.87 
1 1 1 -24 14 21 o 43.75547 13.43017 75.50387  17.0  9.122360       26.86035 0.85 
1 1 1 -24 14 22 o 49.58280 14.19491 82.06882  37.5  33.01982       28.38982 0.88 
1 1 1 -24 14 23 o 41.28984 19.46741 94.76820  224.2 ?              ?        0.82 
1 1 1 -24 14 24 o 44.61845 13.50681 65.06689  169.3 ?              ?        0.85 
1 1 1 -24 16 1  o 44.03358 10.58802 77.71515  87.2  -15.31363      21.17604 0.88 
1 1 1 -24 16 2  o 106.1885 6.042466 190.4587  287.4 18.77323       12.08493 0.98 
1 1 1 -24 16 3  o 41.28101 10.74229 124.3452  71.0  12.00600       21.48458 0.92 
1 1 1 -24 16 4  o 156.1415 4.886707 237.2127  70.9  -1.888657      9.773415 0.99 
1 1 1 -24 16 5  o 27.55478 9.078218 35.39390  345.3 2.238163       18.15644 0.55 
1 1 1 -24 16 6  o 135.3228 5.307942 210.5526  243.1 23.03278       10.61588 0.99 
1 1 1 -24 16 7  o 47.32874 11.95942 48.37040  263.7 -3.077248      23.91885 0.79 
1 1 1 -24 16 8  o 83.79092 8.670219 140.3933  211.0 -9.695618      17.34044 0.97 
1 1 1 -24 16 9  o 129.6350 5.935416 252.4337  223.2 11.95206       11.87083 0.99 
1 1 1 -24 16 10 o 72.78845 11.78476 159.4187  234.0 -7.200783      23.56953 0.97 
1 1 1 -24 16 11 f 42.40714 12.66269 52.01172  68.5  32.41647       25.32539 0.00 
1 1 1 -24 16 12 o 38.44635 12.24041 90.03143  26.3  23.01451       24.48081 0.87 
1 1 1 -24 16 13 o 53.39468 11.19518 91.01794  354.7 -20.28596      22.39037 0.92 
1 1 1 -24 16 14 o 36.31050 12.31897 54.51651  86.6  20.73031       24.63794 0.75 
1 1 1 -24 16 15 o 39.82203 11.65353 52.44987  186.0 -0.1856041     23.30706 0.79 
1 1 1 -24 16 16 o 48.58071 13.63174 109.2942  87.8  31.79350       27.26348 0.91 
1 1 1 -24 16 17 f 78.77356 12.74571 209.1642  93.6  ?              ?        0.00 
1 1 1 -24 16 18 o 43.68943 14.34417 2.780638  252.4 ?              ?        0.07 
1 1 1 -23 1  1  o 261.5078 3.205197 197.3300  250.5 -3.011200      6.410395 0.89 
1 1 1 -23 1  2  o 113.0519 2.994111 265.1861  153.4 -19.01905      5.988222 0.49 
1 1 1 -23 1  3  o 273.5186 3.724655 377.6400  101.3 7.950867       7.449311 0.91 
1 1 1 -23 1  4  o 133.8835 3.499034 341.3565  142.5 8.417267       6.998069 0.81 
1 1 1 -23 1  5  o 557.1642 5.575785 927.5672  222.6 -19.92847      11.15157 0.98 
1 1 1 -23 1  6  o 419.3600 4.641937 695.3080  143.5 -14.51077      9.283874 0.97 
1 1 1 -23 1  7  o 179.7356 3.046758 392.5822  357.8 32.00031       6.093516 0.91 
1 1 1 -23 1  8  o 299.5092 3.811762 429.7814  161.7 82.31400       7.623525 0.93 
1 1 1 -23 1  9  o 378.0969 4.239083 598.5162  102.1 -27.09305      8.478166 0.97 
1 1 1 -23 1  10 o 296.8510 3.569087 490.2474  70.5  14.87894       7.138174 0.80 
1 1 1 -23 1  11 f 216.4461 3.049654 555.5670  84.0  61.98306       6.099308 0.00 
1 1 1 -23 1  12 o 148.8844 2.803696 195.5206  256.4 32.25117       5.607391 0.19 
1 1 1 -23 1  13 o 465.7000 4.658057 434.1722  16.7  -28.48895      9.316114 0.98 
1 1 1 -23 1  14 o 464.1233 4.541780 845.6204  9.9   -0.6354370     9.083559 0.98 
1 1 1 -23 1  15 o 393.8282 3.921984 555.5165  245.6 -45.83795      7.843969 0.97 
1 1 1 -23 1  16 o 624.3342 5.665907 803.6125  311.3 18.14923       11.33181 0.99 
1 1 1 -23 1  17 o 552.8408 5.077765 804.3965  247.3 -32.67731      10.15553 0.99 
1 1 1 -23 1  18 o 230.1717 2.875981 278.6631  126.5 -27.70009      5.751963 0.90 
1 1 1 -23 1  19 o 434.5063 4.057088 601.0983  79.7  34.94980       8.114176 0.98 
1 1 1 -23 1  20 o 102.6937 4.040709 68.23193  234.9 -26.16377      8.081419 0.41 
1 1 1 -23 1  21 o 422.5749 4.346571 530.0958  327.5 21.69690       8.693143 0.99 
1 1 1 -23 1  22 o 203.2832 2.954078 382.0105  66.8  11.83487       5.908155 0.97 
1 1 1 -23 1  23 o 212.4953 3.003776 344.7490  248.4 -22.01939      6.007551 0.98 
1 1 1 -23 1  24 o 89.92928 6.045607 184.4753  337.9 0.9080505      12.09121 0.90 
1 1 1 -23 1  25 o 69.11478 6.040729 91.45840  300.5 -52.48402      12.08146 0.73 
1 1 1 -23 1  26 o 230.3984 3.344023 330.6681  244.7 11.79237       6.688046 0.99 
1 1 1 -23 1  27 o 77.22383 5.945053 112.7736  138.3 24.08940       11.89011 0.88 
1 1 1 -23 1  28 o 109.3141 4.978838 80.30537  161.0 -25.70692      9.957676 0.90 
1 1 1 -23 1  29 o 134.0460 6.165255 194.8628  273.8 17.68894       12.33051 0.98 
1 1 1 -23 1  30 o 173.3184 3.504711 228.0625  277.9 -8.723785      7.009422 0.98 
1 1 1 -23 1  31 o 203.7964 4.681029 247.5489  303.6 -30.58150      9.362059 0.98 
1 1 1 -23 1  32 o 50.76522 9.895158 40.40712  194.3 -18.69679      19.79032 0.54 
1 1 1 -23 1  33 o 37.70338 10.07231 104.9093  201.0 -9.674625      20.14461 0.82 
1 1 1 -23 1  34 o 97.52193 7.132126 130.4906  244.9 -9.365509      14.26425 0.96 
1 1 1 -23 1  35 o 36.70488 10.98793 5.844484  329.2 -6.203938      21.97586 0.12 
1 1 1 -23 1  36 o 64.10738 12.10343 85.23427  129.3 -21.27403      24.20687 0.91 
1 1 1 -23 1  37 o 29.48792 9.458534 51.96596  158.1 ?              ?        0.72 
1 1 1 -23 3  1  o 340.8340 3.182566 830.3406  133.6 12.95721       6.365131 0.97 
1 1 1 -23 3  2  o 490.0371 4.509495 747.5164  228.6 50.61575       9.018990 0.98 
1 1 1 -23 3  3  o 115.0278 2.711505 331.5313  72.5  -20.56823      5.423010 0.17 
1 1 1 -23 3  4  o 528.3707 4.704509 781.5130  357.4 32.96494       9.409018 0.98 
1 1 1 -23 3  5  o 445.9452 4.521741 522.3668  315.5 44.47955       9.043482 0.98 
1 1 1 -23 3  6  o 590.8498 5.586632 861.4474  187.2 -32.04688      11.17326 0.99 
1 1 1 -23 3  7  o 216.3272 3.072531 120.8897  311.0 21.91060       6.145061 0.50 
1 1 1 -23 3  8  o 292.6136 3.557768 336.4468  326.2 15.61792       7.115535 0.93 
1 1 1 -23 3  9  o 367.5623 3.870778 600.5645  224.1 8.550018       7.741556 0.97 
1 1 1 -23 3  10 o 314.8182 4.403668 567.2861  10.3  11.73819       8.807336 0.95 
1 1 1 -23 3  11 o 794.8906 6.877011 1195.597  13.7  -13.96521      13.75402 0.99 
1 1 1 -23 3  12 o 273.0718 3.337247 455.3855  327.8 -39.49098      6.674494 0.94 
1 1 1 -23 3  13 o 580.9236 5.375336 921.3705  220.9 -11.11896      10.75067 0.99 
1 1 1 -23 3  14 o 544.1002 5.006779 953.3176  121.9 15.35120       10.01356 0.99 
1 1 1 -23 3  15 o 760.3503 6.634828 1098.627  29.6  7.140442       13.26966 0.99 
1 1 1 -23 3  16 o 623.1469 5.543701 851.6074  112.6 -48.94482      11.08740 0.99 
1 1 1 -23 3  17 o 612.3959 5.535197 748.6320  137.2 -38.44012      11.07039 0.99 
1 1 1 -23 3  18 o 126.2841 2.966500 107.7235  86.2  54.26823       5.933000 0.45 
1 1 1 -23 3  19 o 97.82291 3.249000 168.4754  137.2 5.979103       6.497999 0.68 
1 1 1 -23 3  20 o 239.6661 3.019321 258.0604  276.9 43.59244       6.038643 0.95 
1 1 1 -23 3  21 o 74.85602 4.383388 152.5337  120.1 28.58879       8.766775 0.72 
1 1 1 -23 3  22 o 217.4492 3.568258 417.7583  64.6  17.05067       7.136516 0.98 
1 1 1 -23 3  23 o 101.7608 4.413163 139.9091  331.5 -1.974525      8.826326 0.88 
1 1 1 -23 3  24 o 111.5081 3.518869 132.5627  275.8 -21.98076      7.037738 0.88 
1 1 1 -23 3  25 o 182.6063 3.224056 367.9742  19.3  17.16345       6.448112 0.98 
1 1 1 -23 3  26 o 87.01241 4.485108 140.6832  255.6 0.7534866      8.970216 0.92 
1 1 1 -23 3  27 o 233.1315 3.411523 342.2889  238.8 19.93112       6.823047 0.99 
1 1 1 -23 3  28 o 32.85877 8.873391 38.03711  327.6 11.88836       17.74678 0.38 
1 1 1 -23 3  29 o 82.57993 6.246399 100.2958  295.3 -25.16968      12.49280 0.92 
1 1 1 -23 3  30 o 70.86462 6.806474 151.3942  249.5 -11.96319      13.61295 0.92 
1 1 1 -23 3  31 o 85.02892 6.527335 92.85446  16.3  16.00684       13.05467 0.89 
1 1 1 -23 3  32 o 99.34663 6.325602 116.9637  1.1   -13.25508      12.65120 0.94 
1 1 1 -23 3  33 o 46.37966 10.47578 60.80226  10.6  15.50724       20.95155 0.77 
1 1 1 -23 3  34 o 41.41356 12.42889 48.94379  16.0  -8.669147      24.85779 0.72 
1 1 1 -23 3  35 o 148.6478 5.439620 219.2486  350.7 -13.41862      10.87924 0.99 
1 1 1 -23 3  36 o 150.0566 5.491199 219.5250  300.7 -4.759262      10.98240 0.99 
1 1 1 -23 3  37 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -23 5  1  f 510.6534 4.143560 610.5676  188.1 20.75107       8.287121 0.00 
1 1 1 -23 5  2  o 270.0035 3.086097 248.4122  181.5 -33.70639      6.172193 0.83 
1 1 1 -23 5  3  o 719.8040 5.276541 893.7769  30.6  -30.21625      10.55308 0.99 
1 1 1 -23 5  4  o 321.3724 3.396821 680.9037  13.1  4.972504       6.793642 0.96 
1 1 1 -23 5  5  o 491.2848 4.305799 778.2928  228.4 -84.06711      8.611598 0.98 
1 1 1 -23 5  6  o 441.0052 4.006473 814.5536  107.9 36.42917       8.012945 0.98 
1 1 1 -23 5  7  o 567.7346 4.631183 993.7983  106.5 34.70099       9.262366 0.99 
1 1 1 -23 5  8  o 308.7049 3.405716 723.6246  19.2  -18.55206      6.811432 0.96 
1 1 1 -23 5  9  o 98.98279 3.436935 197.6639  314.5 15.72605       6.873869 0.67 
1 1 1 -23 5  10 o 188.2573 2.757451 296.2857  70.1  -2.458893      5.514903 0.88 
1 1 1 -23 5  11 o 515.0471 4.898998 627.7762  69.7  -0.7961426     9.797997 0.98 
1 1 1 -23 5  12 o 522.1165 5.011370 668.4462  152.0 -14.24799      10.02274 0.98 
1 1 1 -23 5  13 f 403.7112 4.763978 700.1785  18.5  -19.48190      9.527957 0.00 
1 1 1 -23 5  14 f 188.4073 2.700213 183.0848  221.6 49.29939       5.400426 0.00 
1 1 1 -23 5  15 o 480.6111 4.522868 628.2372  179.2 9.247528       9.045736 0.98 
1 1 1 -23 5  16 o 178.5650 4.732008 331.2201  345.4 ?              ?        0.91 
1 1 1 -23 5  17 o 116.2805 3.273694 151.1011  252.4 2.704094       6.547389 0.74 
1 1 1 -23 5  18 o 172.9126 2.917447 176.3382  241.7 73.49422       5.834893 0.89 
1 1 1 -23 5  19 o 316.4031 3.695796 594.4761  84.1  15.53430       7.391593 0.99 
1 1 1 -23 5  20 o 189.8611 3.030988 343.4945  120.8 14.36732       6.061975 0.97 
1 1 1 -23 5  21 o 326.4804 3.533655 441.4107  244.4 -19.04437      7.067310 0.99 
1 1 1 -23 5  22 o 279.4753 3.482544 442.5516  106.3 7.962494       6.965088 0.99 
1 1 1 -23 5  23 o 174.8237 3.179779 188.5345  85.1  1.426270       6.359559 0.96 
1 1 1 -23 5  24 o 43.38130 8.280838 19.90746  267.3 13.19476       16.56168 0.20 
1 1 1 -23 5  25 o 143.5906 3.547212 209.7355  150.2 -5.342819      7.094423 0.97 
1 1 1 -23 5  26 o 60.70381 8.309947 87.70970  85.6  18.96769       16.61989 0.81 
1 1 1 -23 5  27 o 75.81053 5.602198 161.5949  259.1 -0.5205307     11.20440 0.94 
1 1 1 -23 5  28 o 110.5334 4.438174 168.7674  270.3 11.55779       8.876348 0.96 
1 1 1 -23 5  29 o 114.9702 4.408113 190.0966  109.6 -2.531929      8.816226 0.96 
1 1 1 -23 5  30 o 131.2342 4.386823 162.8968  174.9 14.53927       8.773646 0.96 
1 1 1 -23 5  31 o 45.55513 10.23147 71.61039  28.7  15.12296       20.46294 0.75 
1 1 1 -23 5  32 o 70.07932 8.155195 41.56131  296.7 12.39725       16.31039 0.80 
1 1 1 -23 5  33 o 97.97867 13.13949 124.2528  222.9 23.86399       26.27899 0.96 
1 1 1 -23 5  34 o 79.63970 7.695238 116.0549  166.0 44.73930       15.39048 0.96 
1 1 1 -23 5  35 o 37.83844 11.02411 33.05585  313.7 5.830151       22.04821 0.61 
1 1 1 -23 5  36 o 41.30872 10.99423 29.88404  14.2  ?              ?        0.65 
1 1 1 -23 7  1  o 306.9961 3.233684 425.0754  32.5  -0.1017151     6.467367 0.95 
1 1 1 -23 7  2  o 263.3344 2.921906 498.6888  88.6  2.538422       5.843813 0.95 
1 1 1 -23 7  3  o 171.2350 4.155426 510.0389  209.4 ?              ?        0.93 
1 1 1 -23 7  4  o 454.3593 3.723949 619.1097  299.7 -1.729462      7.447899 0.98 
1 1 1 -23 7  5  o 589.8625 4.520932 780.2303  319.5 12.20496       9.041863 0.99 
1 1 1 -23 7  6  o 190.4979 2.683499 249.6431  171.3 -52.51579      5.366998 0.83 
1 1 1 -23 7  7  o 195.9246 3.565243 143.1467  283.3 29.88229       7.130486 0.71 
1 1 1 -23 7  8  o 471.4939 4.126142 669.4620  277.7 -1.685181      8.252283 0.98 
1 1 1 -23 7  9  o 75.00702 5.058555 218.0393  273.8 -55.16869      10.11711 0.52 
1 1 1 -23 7  10 o 490.6315 4.358597 532.9755  144.8 -15.36438      8.717194 0.98 
1 1 1 -23 7  11 o 348.0563 4.524831 650.3007  212.5 -35.95554      9.049662 0.98 
1 1 1 -23 7  12 o 225.2157 3.006065 260.4574  175.5 -12.12587      6.012131 0.91 
1 1 1 -23 7  13 o 219.1912 3.118707 365.8117  203.6 -19.18802      6.237414 0.95 
1 1 1 -23 7  14 o 97.53938 3.546229 212.9220  328.6 27.10273       7.092457 0.82 
1 1 1 -23 7  15 o 43.19143 6.732941 32.04025  21.5  -19.48606      13.46588 0.15 
1 1 1 -23 7  16 o 262.6740 3.051627 352.9231  96.4  20.56512       6.103253 0.97 
1 1 1 -23 7  17 f 128.4456 3.167086 272.6146  99.3  8.201340       6.334171 0.00 
1 1 1 -23 7  18 f 86.80787 4.338396 126.2284  21.0  9.348083       8.676792 0.00 
1 1 1 -23 7  19 o 38.29499 7.259494 60.73872  205.6 -20.30452      14.51899 0.35 
1 1 1 -23 7  20 o 171.2450 3.183673 279.7462  1.0   -4.099228      6.367346 0.97 
1 1 1 -23 7  21 o 222.2844 3.301380 393.4444  291.2 -15.92006      6.602759 0.99 
1 1 1 -23 7  22 o 56.78846 7.038516 150.9899  265.0 -51.29802      14.07703 0.87 
1 1 1 -23 7  23 o 148.4213 3.805451 242.9843  303.1 -1.676407      7.610901 0.97 
1 1 1 -23 7  24 o 159.4377 3.794242 232.1815  334.9 1.656372       7.588485 0.98 
1 1 1 -23 7  25 o 101.2993 4.862209 66.74828  300.9 17.80721       9.724419 0.90 
1 1 1 -23 7  26 o 69.18090 10.66657 94.81889  4.8   -1.625000      21.33313 0.89 
1 1 1 -23 7  27 o 56.73746 8.578813 126.5295  2.4   30.87069       17.15763 0.88 
1 1 1 -23 7  28 o 150.4433 4.312954 194.0583  329.0 -6.213516      8.625908 0.97 
1 1 1 -23 7  29 o 117.1055 5.228168 156.0811  300.6 5.464973       10.45634 0.96 
1 1 1 -23 7  30 o 60.37298 8.565786 95.58739  223.3 -22.60568      17.13157 0.90 
1 1 1 -23 7  31 o 60.41199 11.36780 107.5951  205.2 36.86316       22.73561 0.92 
1 1 1 -23 7  32 o 68.64651 9.306835 64.65755  298.3 -4.534988      18.61367 0.91 
1 1 1 -23 7  33 o 53.22840 8.861867 73.17591  213.5 -43.04614      17.72373 0.89 
1 1 1 -23 7  34 o 92.29524 6.905307 108.9786  215.2 ?              ?        0.97 
1 1 1 -23 9  1  o 88.39005 3.911488 123.1427  9.3   -21.25401      7.822977 0.67 
1 1 1 -23 9  2  o 179.2468 2.740024 317.3051  348.0 -10.00107      5.480048 0.95 
1 1 1 -23 9  3  o 456.9851 5.527894 674.8305  21.8  57.35852       11.05579 0.99 
1 1 1 -23 9  4  o 148.4849 2.893125 159.3027  290.6 -17.28114      5.786249 0.87 
1 1 1 -23 9  5  o 439.9169 5.506006 718.5814  354.9 -25.71701      11.01201 0.99 
1 1 1 -23 9  6  o 214.4019 2.920666 461.8587  106.8 40.50703       5.841331 0.97 
1 1 1 -23 9  7  o 160.9653 3.091065 248.4363  162.2 -36.77992      6.182131 0.93 
1 1 1 -23 9  8  o 183.6727 3.148943 317.4677  343.2 0.2195282      6.297885 0.95 
1 1 1 -23 9  9  o 185.7776 2.930013 294.3010  293.8 -8.463928      5.860025 0.96 
1 1 1 -23 9  10 o 303.2627 3.246295 527.5703  297.5 -51.35730      6.492589 0.99 
1 1 1 -23 9  11 o 294.5212 3.303088 454.7144  308.9 -15.53604      6.606176 0.99 
1 1 1 -23 9  12 o 68.30798 4.946604 160.7930  148.4 -12.43657      9.893209 0.83 
1 1 1 -23 9  13 o 148.5310 3.138376 265.8168  173.4 -52.47170      6.276752 0.96 
1 1 1 -23 9  14 o 38.52939 6.592454 53.55417  73.0  -25.61826      13.18491 0.30 
1 1 1 -23 9  15 o 110.0859 3.480287 109.4402  153.9 6.144295       6.960574 0.88 
1 1 1 -23 9  16 o 135.7537 3.238980 211.6174  343.0 -21.37148      6.477960 0.95 
1 1 1 -23 9  17 o 45.21914 7.365487 77.08302  241.4 6.838718       14.73097 0.58 
1 1 1 -23 9  18 o 134.8632 3.510634 252.1073  186.5 -5.825104      7.021268 0.97 
1 1 1 -23 9  19 o 142.4345 3.372079 276.5906  223.2 6.681702       6.744158 0.98 
1 1 1 -23 9  20 f 55.30643 7.932320 114.2237  217.5 9.236832       15.86464 0.00 
1 1 1 -23 9  21 o 64.44782 8.235147 121.4722  84.5  -4.819260      16.47029 0.89 
1 1 1 -23 9  22 o 98.05748 6.351024 203.3134  74.6  -30.45070      12.70205 0.97 
1 1 1 -23 9  23 o 95.67056 6.145015 185.4702  257.2 2.203583       12.29003 0.97 
1 1 1 -23 9  24 o 93.62761 6.348621 142.8533  309.6 10.83636       12.69724 0.95 
1 1 1 -23 9  25 o 138.9420 4.923554 246.6670  115.5 -18.07762      9.847109 0.98 
1 1 1 -23 9  26 o 167.0220 4.533943 273.6526  83.2  -12.44557      9.067886 0.98 
1 1 1 -23 9  27 o 107.5801 8.583817 173.0885  342.8 12.16914       17.16763 0.97 
1 1 1 -23 9  28 o 91.34903 7.721712 122.9845  324.5 -8.295784      15.44342 0.96 
1 1 1 -23 9  29 o 29.51389 9.550046 62.61809  13.9  0.4953270      19.10009 0.72 
1 1 1 -23 9  30 o 71.54588 17.34659 145.5580  331.8 18.91067       34.69318 0.94 
1 1 1 -23 9  31 o 58.13858 15.21683 89.30714  324.0 -19.52861      30.43366 0.90 
1 1 1 -23 9  32 o 47.12099 13.47943 71.99717  77.1  ?              ?        0.86 
1 1 1 -23 11 1  o 203.6109 2.979716 307.3869  134.3 11.64191       5.959432 0.98 
1 1 1 -23 11 2  f 228.1209 3.453468 402.9717  203.6 9.995605       6.906936 0.00 
1 1 1 -23 11 3  o 163.4920 3.164361 266.0173  280.4 0.9620819      6.328722 0.97 
1 1 1 -23 11 4  o 39.61676 6.853415 16.70853  194.2 -14.36926      13.70683 0.04 
1 1 1 -23 11 5  o 120.6473 4.333754 177.2047  22.5  -26.20222      8.667507 0.93 
1 1 1 -23 11 6  o 123.2507 3.687345 304.8221  340.3 -13.80105      7.374690 0.96 
1 1 1 -23 11 7  o 63.78674 5.734627 82.05043  192.8 30.13910       11.46925 0.69 
1 1 1 -23 11 8  o 159.5333 3.760863 259.2735  126.8 -4.377060      7.521726 0.97 
1 1 1 -23 11 9  o 190.9784 3.586119 393.3965  70.2  ?              ?        0.98 
1 1 1 -23 11 10 o 44.02509 8.285490 31.78264  294.6 -22.04912      16.57098 0.31 
1 1 1 -23 11 11 o 91.93685 5.254966 179.5260  294.9 -37.83383      10.50993 0.93 
1 1 1 -23 11 12 o 94.92746 6.385726 210.5096  19.2  -16.25364      12.77145 0.95 
1 1 1 -23 11 13 o 169.1487 4.580476 249.3686  242.2 -22.94485      9.160953 0.98 
1 1 1 -23 11 14 o 151.2806 4.078075 260.8822  231.4 -3.522018      8.156151 0.98 
1 1 1 -23 11 15 o 158.7086 4.996001 242.4830  311.0 -9.574890      9.992002 0.98 
1 1 1 -23 11 16 o 170.2171 3.035467 310.1031  23.8  -6.255280      6.070934 0.99 
1 1 1 -23 11 17 o 194.5927 3.047560 311.6325  21.8  -34.62497      6.095119 0.99 
1 1 1 -23 11 18 o 139.8018 3.293202 285.5001  294.4 0.3481293      6.586403 0.99 
1 1 1 -23 11 19 o 50.12150 7.977453 113.2441  189.2 -9.891361      15.95491 0.89 
1 1 1 -23 11 20 o 82.97096 5.124638 185.8372  102.6 5.313515       10.24928 0.96 
1 1 1 -23 11 21 o 140.1858 3.989174 235.1498  34.1  -33.32528      7.978349 0.98 
1 1 1 -23 11 22 o 64.47271 8.750959 104.6919  284.2 -30.54107      17.50192 0.88 
1 1 1 -23 11 23 o 48.38262 10.96225 62.78111  337.5 3.646122       21.92450 0.72 
1 1 1 -23 11 24 o 131.5904 5.258237 226.2287  34.6  16.62141       10.51647 0.98 
1 1 1 -23 11 25 o 91.80652 6.936856 201.6638  57.1  3.398453       13.87371 0.98 
1 1 1 -23 11 26 o 52.55590 11.98695 85.80401  89.4  20.03789       23.97390 0.89 
1 1 1 -23 11 27 o 40.94870 11.60821 46.02072  87.1  4.164116       23.21641 0.74 
1 1 1 -23 11 28 o 82.89082 14.53508 139.0695  347.2 -4.602737      29.07016 0.96 
1 1 1 -23 11 29 f 80.20280 10.26441 160.1782  295.8 12.79828       20.52881 0.00 
1 1 1 -23 11 30 o 37.19352 12.44890 37.56298  285.3 ?              ?        0.67 
1 1 1 -23 13 1  o 32.82534 8.215919 39.74843  33.0  -15.63058      16.43184 0.45 
1 1 1 -23 13 2  f 56.84224 8.365511 116.5415  238.2 -16.55752      16.73102 0.00 
1 1 1 -23 13 3  o 170.7891 3.249788 237.8760  139.4 -3.266708      6.499577 0.98 
1 1 1 -23 13 4  o 136.1617 3.687976 255.0824  109.4 1.853027       7.375952 0.98 
1 1 1 -23 13 5  f 38.24203 9.249882 109.5955  127.5 2.644253       18.49976 0.00 
1 1 1 -23 13 6  o 88.89817 5.477443 160.4968  249.8 -14.93384      10.95489 0.95 
1 1 1 -23 13 7  o 256.8918 3.750141 454.2459  252.3 -10.46889      7.500282 0.99 
1 1 1 -23 13 8  o 94.78275 5.817796 79.96540  281.9 -21.97371      11.63559 0.92 
1 1 1 -23 13 9  o 143.6399 4.945242 239.0489  0.3   -10.22075      9.890485 0.98 
1 1 1 -23 13 10 o 82.41127 7.602229 74.94178  8.7   15.68705       15.20446 0.91 
1 1 1 -23 13 11 o 200.3689 4.965355 322.6786  41.4  -11.29373      9.930710 0.99 
1 1 1 -23 13 12 o 38.15966 9.564556 129.0670  344.4 -11.92847      19.12911 0.87 
1 1 1 -23 13 13 o 99.95413 9.023956 192.7910  269.9 -26.64581      18.04791 0.97 
1 1 1 -23 13 14 o 164.4367 6.563359 322.8570  273.9 -17.80322      13.12672 0.99 
1 1 1 -23 13 15 o 57.89867 11.49414 91.32860  344.1 1.007298       22.98829 0.83 
1 1 1 -23 13 16 o 132.8933 3.814960 179.9833  15.5  ?              ?        0.97 
1 1 1 -23 13 17 o 208.4241 5.665386 377.9033  329.2 14.41251       11.33077 0.99 
1 1 1 -23 13 18 o 58.60104 10.92151 115.6460  336.5 -18.22755      21.84302 0.89 
1 1 1 -23 13 19 o 101.2144 8.545280 122.3622  253.2 9.552307       17.09056 0.95 
1 1 1 -23 13 20 o 41.17552 12.44029 49.79299  278.6 23.38070       24.88059 0.67 
1 1 1 -23 13 21 o 47.27826 12.62689 65.18572  201.9 17.82713       25.25378 0.81 
1 1 1 -23 13 22 o 40.63121 11.03611 82.55500  344.0 -17.35426      22.07222 0.87 
1 1 1 -23 13 23 o 65.38432 13.08790 116.3604  191.2 -23.71069      26.17580 0.94 
1 1 1 -23 13 24 o 69.17805 13.85810 82.78709  155.9 63.49799       27.71620 0.91 
1 1 1 -23 13 25 o 36.21874 11.85091 23.84257  40.2  3.650459       23.70182 0.47 
1 1 1 -23 13 26 o 42.40131 13.98346 39.16827  255.2 ?              ?        0.69 
1 1 1 -23 15 1  o 118.5580 5.230015 184.5687  55.7  -9.211708      10.46003 0.97 
1 1 1 -23 15 2  o 102.0785 5.702899 211.7454  238.9 -8.373116      11.40580 0.97 
1 1 1 -23 15 3  o 34.09801 9.771617 4.815810  28.0  11.05891       19.54323 0.07 
1 1 1 -23 15 4  o 132.2774 4.488099 245.4408  127.0 2.146927       8.976197 0.98 
1 1 1 -23 15 5  o 151.3984 4.406981 295.6574  123.3 5.407425       8.813961 0.99 
1 1 1 -23 15 6  o 173.9674 4.027438 347.1343  102.3 14.84392       8.054876 0.99 
1 1 1 -23 15 7  o 109.1251 5.455241 189.2362  32.3  -2.075455      10.91048 0.97 
1 1 1 -23 15 8  o 58.76536 9.230958 71.45266  257.3 -28.68092      18.46192 0.85 
1 1 1 -23 15 9  o 77.52995 8.006291 152.6431  132.3 14.67705       16.01258 0.95 
1 1 1 -23 15 10 o 53.61740 11.45185 77.89915  42.9  9.743721       22.90370 0.85 
1 1 1 -23 15 11 o 189.4884 5.361918 315.9462  9.9   -14.70741      10.72384 0.99 
1 1 1 -23 15 12 o 89.68433 12.00612 122.2264  345.8 -41.22499      24.01224 0.95 
1 1 1 -23 15 13 o 125.7432 8.294422 236.9006  277.0 -8.959366      16.58884 0.99 
1 1 1 -23 15 14 o 38.37483 11.35721 92.98933  72.3  3.299267       22.71443 0.86 
1 1 1 -23 15 15 o 86.98288 11.39609 186.2121  69.7  -5.920273      22.79218 0.97 
1 1 1 -23 15 16 o 49.24302 11.33407 137.2748  49.7  -2.223309      22.66813 0.94 
1 1 1 -23 15 17 o 45.51240 11.64021 40.94705  303.0 10.12433       23.28043 0.75 
1 1 1 -23 15 18 o 48.14220 12.47036 141.3835  254.3 -10.82593      24.94071 0.94 
1 1 1 -23 15 19 o 70.29432 30.54223 90.91705  116.0 ?              ?        0.77 
1 1 1 -23 15 20 o 120.8827 13.16036 244.5396  83.4  -45.69419      26.32072 0.99 
1 1 1 -23 15 21 o 46.01468 14.30738 100.4626  118.5 ?              ?        0.90 
1 1 1 -23 15 22 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -23 17 1  o 32.36292 10.22268 38.13151  213.4 4.815039       20.44536 0.65 
1 1 1 -23 17 2  o 47.91058 10.87931 73.85086  192.5 33.43465       21.75862 0.89 
1 1 1 -23 17 3  o 31.99442 10.16658 45.46703  172.5 13.30954       20.33317 0.71 
1 1 1 -23 17 4  o 51.77534 10.45141 120.0050  353.4 36.77119       20.90281 0.94 
1 1 1 -23 17 5  o 82.80693 9.329818 178.1506  36.2  -12.36761      18.65964 0.98 
1 1 1 -23 17 6  f 31.10899 9.941166 104.3811  71.4  8.580700       19.88233 0.00 
1 1 1 -23 17 7  o 51.31060 10.92359 99.45181  164.5 -22.27398      21.84717 0.92 
1 1 1 -23 17 8  o 46.72894 11.14993 78.55091  166.8 -2.099812      22.29985 0.89 
1 1 1 -23 17 9  o 38.83679 10.16339 50.36878  204.6 -12.91831      20.32679 0.80 
1 1 1 -23 17 10 o 48.34432 14.18270 102.3975  237.5 30.83897       28.36540 0.90 
1 1 1 -23 17 11 o 67.34658 11.49425 134.6557  98.1  ?              ?        0.96 
1 1 1 -23 17 12 o 47.73727 12.32380 125.4790  84.7  ?              ?        0.93 
1 1 1 -23 17 13 o 39.61621 11.87636 80.64156  308.1 ?              ?        0.88 
1 1 1 -23 17 14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -22 0  1  o 266.6441 5.074355 203.7435  180.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  2  o 126.8459 4.358710 133.8378  180.0 -0.000000      0.000000 0.43 
1 1 1 -22 0  3  o 287.2094 5.579019 328.3391  180.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  4  o 53.56635 6.290148 80.93876  180.0 -0.000000      0.000000 0.54 
1 1 1 -22 0  5  o 306.1412 5.291244 501.4555  180.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  6  o 70.15708 4.995288 63.87894  0.0   -0.000000      0.000000 0.02 
1 1 1 -22 0  7  o 292.6477 5.475010 335.5196  180.0 -0.000000      0.000000 0.53 
1 1 1 -22 0  8  o 163.4810 4.304722 58.29209  0.0   -0.000000      0.000000 0.86 
1 1 1 -22 0  9  o 46.54319 6.089644 200.6677  180.0 -0.000000      0.000000 0.27 
1 1 1 -22 0  10 f 343.9045 5.408376 264.4431  180.0 -0.000000      0.000000 0.00 
1 1 1 -22 0  11 o 191.4169 4.139808 414.0981  180.0 -0.000000      0.000000 0.62 
1 1 1 -22 0  12 o 914.5097 11.42220 1382.799  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  13 o 215.2387 5.006168 218.9153  360.0 -0.000000      0.000000 0.99 
1 1 1 -22 0  14 o 435.9253 5.980766 627.1632  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  15 o 179.9363 3.958744 98.92311  0.0   -0.000000      0.000000 0.73 
1 1 1 -22 0  16 o 669.8059 8.488412 745.5305  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  17 o 505.7132 6.826891 662.4517  180.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  18 o 147.7481 3.919101 319.4934  180.0 -0.000000      0.000000 0.97 
1 1 1 -22 0  19 o 342.3852 7.046648 387.9572  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  20 o 321.7951 5.088614 483.5511  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  21 o 432.9493 6.165945 517.3478  360.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  22 o 19.98619 11.76033 123.2248  0.0   -0.000000      0.000000 0.30 
1 1 1 -22 0  23 o 42.98518 11.74653 15.12837  0.0   -0.000000      0.000000 0.16 
1 1 1 -22 0  24 o 376.9063 5.737416 522.7016  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  25 o 286.2061 4.851130 457.9218  360.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  26 o 82.88492 5.853573 18.97688  0.0   -0.000000      0.000000 0.30 
1 1 1 -22 0  27 o 84.61833 6.487210 12.07503  180.0 -0.000000      0.000000 0.26 
1 1 1 -22 0  28 o 169.4213 5.102590 191.4617  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  29 o 50.36078 14.85094 5.199474  360.0 -0.000000      0.000000 0.09 
1 1 1 -22 0  30 o 37.41897 18.44504 5.164665  0.0   -0.000000      0.000000 0.06 
1 1 1 -22 0  31 o 32.59266 18.41034 126.5250  180.0 -0.000000      0.000000 0.79 
1 1 1 -22 0  32 o 75.61417 10.44436 78.87847  180.0 -0.000000      0.000000 0.96 
1 1 1 -22 0  33 o 35.25451 18.51780 35.14737  180.0 -0.000000      0.000000 0.42 
1 1 1 -22 0  34 o 32.38335 19.57984 63.50439  0.0   -0.000000      0.000000 0.72 
1 1 1 -22 0  35 o 90.22208 12.06965 68.10085  0.0   -0.000000      0.000000 1.00 
1 1 1 -22 0  36 o 76.18060 16.53038 80.30968  180.0 -0.000000      0.000000 1.00 
1 1 1 -22 0  37 f 22.03120 14.69488 23.83792  180.0 ?              ?        0.00 
1 1 1 -22 2  1  o 556.9819 5.087167 723.8983  171.3 -1.386353      10.17433 0.98 
1 1 1 -22 2  2  o 265.7523 3.148442 635.6624  289.8 -68.87611      6.296883 0.95 
1 1 1 -22 2  3  o 411.5495 4.246034 534.9171  54.2  4.474731       8.492068 0.97 
1 1 1 -22 2  4  o 469.0593 5.035115 482.1943  351.5 8.336792       10.07023 0.98 
1 1 1 -22 2  5  o 370.1776 4.213029 433.9030  292.3 -11.43549      8.426059 0.97 
1 1 1 -22 2  6  o 187.8935 2.939340 278.8463  99.0  -73.83084      5.878680 0.77 
1 1 1 -22 2  7  o 293.1791 3.680826 565.9407  2.1   11.70892       7.361653 0.95 
1 1 1 -22 2  8  o 146.7578 2.661554 221.1531  264.8 -58.27515      5.323108 0.83 
1 1 1 -22 2  9  o 529.6166 5.371558 910.8777  91.6  31.06464       10.74312 0.99 
1 1 1 -22 2  10 o 593.8897 5.507341 844.2905  7.5   12.61951       11.01468 0.99 
1 1 1 -22 2  11 o 556.1783 5.314544 981.6381  212.8 12.42371       10.62909 0.98 
1 1 1 -22 2  12 o 367.1424 3.734628 518.7827  148.7 35.78738       7.469255 0.96 
1 1 1 -22 2  13 o 1120.869 9.468730 1568.525  51.0  5.663940       18.93746 1.00 
1 1 1 -22 2  14 f 169.2985 3.058727 154.5068  5.1   -23.37593      6.117453 0.00 
1 1 1 -22 2  15 o 405.1439 3.927432 474.4360  282.3 -8.512024      7.854863 0.97 
1 1 1 -22 2  16 o 396.8253 3.828197 576.7838  121.7 -5.292725      7.656394 0.97 
1 1 1 -22 2  17 o 203.3338 2.770832 189.9166  115.5 -50.54858      5.541663 0.85 
1 1 1 -22 2  18 o 47.09262 5.190474 66.83304  4.0   -8.021191      10.38095 0.14 
1 1 1 -22 2  19 o 405.2631 3.858055 655.9122  99.1  -23.97128      7.716110 0.98 
1 1 1 -22 2  20 o 110.1549 3.134672 147.9541  229.1 34.46156       6.269344 0.71 
1 1 1 -22 2  21 o 280.3332 3.934447 526.4209  184.8 17.52661       7.868893 0.98 
1 1 1 -22 2  22 o 90.71465 4.226297 180.8483  151.8 -56.23585      8.452595 0.86 
1 1 1 -22 2  23 o 100.9277 3.890527 130.6044  201.2 13.74776       7.781054 0.87 
1 1 1 -22 2  24 o 141.8470 3.148200 271.6868  230.7 32.08488       6.296400 0.96 
1 1 1 -22 2  25 o 100.3614 4.011271 215.5518  316.7 35.67451       8.022542 0.93 
1 1 1 -22 2  26 o 156.1672 3.486902 255.3389  33.5  -4.572800      6.973805 0.97 
1 1 1 -22 2  27 o 180.0587 3.450073 279.6231  177.8 21.84677       6.900146 0.98 
1 1 1 -22 2  28 o 42.95517 8.718763 27.66591  233.4 14.23410       17.43753 0.33 
1 1 1 -22 2  29 o 193.7695 3.552186 299.9658  303.1 17.44429       7.104373 0.99 
1 1 1 -22 2  30 o 236.8922 3.742646 330.0899  284.0 -9.812744      7.485291 0.99 
1 1 1 -22 2  31 o 61.34349 9.729670 83.86555  0.4   -0.6831779     19.45934 0.81 
1 1 1 -22 2  32 o 58.23675 9.566673 68.60431  114.5 2.385185       19.13335 0.78 
1 1 1 -22 2  33 o 70.33875 8.446773 92.41701  223.6 5.521439       16.89355 0.91 
1 1 1 -22 2  34 o 101.2363 6.260337 183.6583  256.4 -18.63157      12.52067 0.98 
1 1 1 -22 2  35 o 53.27465 11.04959 76.14184  20.8  18.22493       22.09919 0.88 
1 1 1 -22 2  36 o 42.04659 12.10135 82.45935  337.4 4.149872       24.20270 0.86 
1 1 1 -22 2  37 o 31.30905 10.13751 55.64675  249.3 ?              ?        0.76 
1 1 1 -22 4  1  o 466.5336 3.916642 605.7174  327.7 12.40750       7.833283 0.98 
1 1 1 -22 4  2  o 994.8481 7.134422 1375.665  309.4 19.96838       14.26884 0.99 
1 1 1 -22 4  3  o 664.2612 5.529751 1083.108  301.8 -39.61267      11.05950 0.99 
1 1 1 -22 4  4  o 421.0812 3.775191 700.0782  72.1  -10.50818      7.550382 0.97 
1 1 1 -22 4  5  o 240.8656 2.813778 187.1902  274.9 45.08826       5.627555 0.89 
1 1 1 -22 4  6  o 616.4985 4.983922 980.6439  251.4 -19.28564      9.967843 0.99 
1 1 1 -22 4  7  o 461.5504 4.461604 871.7182  343.3 -56.93759      8.923208 0.98 
1 1 1 -22 4  8  o 407.0037 4.077092 701.6631  253.0 30.06747       8.154184 0.97 
1 1 1 -22 4  9  o 260.3612 4.056614 257.1280  166.1 24.69821       8.113228 0.88 
1 1 1 -22 4  10 o 267.5068 3.104899 541.4208  13.4  -1.855865      6.209798 0.95 
1 1 1 -22 4  11 o 191.0414 2.813987 420.9704  27.2  -11.07608      5.627975 0.90 
1 1 1 -22 4  12 o 148.5865 2.683164 254.0992  159.6 17.94669       5.366328 0.86 
1 1 1 -22 4  13 o 409.7859 4.006224 613.3250  283.4 5.778870       8.012448 0.97 
1 1 1 -22 4  14 o 224.9396 2.973702 327.7378  220.1 23.98218       5.947404 0.91 
1 1 1 -22 4  15 o 258.2984 3.087177 336.9196  118.3 -4.316223      6.174354 0.93 
1 1 1 -22 4  16 o 159.4016 2.578657 106.0481  94.5  -33.30435      5.157314 0.66 
1 1 1 -22 4  17 o 408.7621 3.878397 612.7244  125.6 -39.52505      7.756793 0.98 
1 1 1 -22 4  18 o 267.4726 3.176839 343.4168  303.7 -11.06659      6.353677 0.95 
1 1 1 -22 4  19 o 174.5667 3.100892 447.4083  98.1  35.12915       6.201784 0.95 
1 1 1 -22 4  20 o 534.1594 5.084472 786.7473  77.9  -22.65271      10.16894 0.99 
1 1 1 -22 4  21 o 63.57488 5.781416 71.66151  129.8 -35.80276      11.56283 0.56 
1 1 1 -22 4  22 o 147.4744 2.957446 159.3380  327.9 -9.070236      5.914893 0.93 
1 1 1 -22 4  23 o 137.0803 3.236762 150.2984  213.7 16.44394       6.473523 0.92 
1 1 1 -22 4  24 o 138.1640 3.366174 200.4030  93.6  -23.80053      6.732348 0.95 
1 1 1 -22 4  25 f 72.26088 5.402889 118.4598  197.3 12.17415       10.80578 0.00 
1 1 1 -22 4  26 o 58.98953 7.034943 73.13351  310.0 -22.89879      14.06989 0.73 
1 1 1 -22 4  27 f 104.1758 4.671709 151.6201  196.7 -1.751923      9.343418 0.00 
1 1 1 -22 4  28 o 31.61819 8.447165 111.8762  184.4 -21.60132      16.89433 0.79 
1 1 1 -22 4  29 o 79.94743 6.180816 93.31313  150.0 26.51566       12.36163 0.90 
1 1 1 -22 4  30 o 82.71140 7.128705 135.8551  41.0  -43.95707      14.25741 0.92 
1 1 1 -22 4  31 o 48.46045 9.224953 61.80116  277.3 5.799274       18.44991 0.69 
1 1 1 -22 4  32 o 54.65031 9.078748 104.8657  21.6  7.000584       18.15750 0.89 
1 1 1 -22 4  33 o 44.65720 9.045927 52.25172  80.0  28.89497       18.09185 0.76 
1 1 1 -22 4  34 o 72.75441 9.136339 74.33183  313.6 8.303062       18.27268 0.92 
1 1 1 -22 4  35 o 111.2096 6.319445 109.3147  313.9 -29.78492      12.63889 0.97 
1 1 1 -22 4  36 o 53.57560 12.84781 83.92091  219.7 ?              ?        0.90 
1 1 1 -22 6  1  o 382.9882 3.694085 346.8476  51.2  30.11618       7.388171 0.95 
1 1 1 -22 6  2  o 351.3939 3.306317 517.4717  169.6 -86.27164      6.612634 0.97 
1 1 1 -22 6  3  o 181.5541 2.332607 432.6597  127.2 -34.92026      4.665214 0.92 
1 1 1 -22 6  4  o 532.9703 4.195215 555.4904  13.4  5.958679       8.390430 0.98 
1 1 1 -22 6  5  o 703.3782 5.706977 1033.619  309.3 60.86444       11.41395 0.99 
1 1 1 -22 6  6  o 218.1321 2.989954 487.7010  253.1 29.51462       5.979908 0.93 
1 1 1 -22 6  7  o 456.4877 4.035872 686.3239  26.9  -40.66507      8.071744 0.98 
1 1 1 -22 6  8  o 726.0162 5.682934 969.6116  82.0  -33.98328      11.36587 0.99 
1 1 1 -22 6  9  o 154.2466 2.511584 307.4892  74.2  6.968872       5.023168 0.81 
1 1 1 -22 6  10 o 294.5997 3.800291 290.9981  269.5 45.44604       7.600581 0.91 
1 1 1 -22 6  11 o 176.7521 2.846066 238.9574  260.8 -10.71352      5.692132 0.85 
1 1 1 -22 6  12 o 305.8637 3.484558 471.1879  272.8 -17.95605      6.969116 0.96 
1 1 1 -22 6  13 o 117.0366 3.236157 236.7722  19.2  -39.59202      6.472314 0.73 
1 1 1 -22 6  14 o 174.6547 6.060169 150.3558  56.1  ?              ?        0.72 
1 1 1 -22 6  15 o 164.3168 3.008230 246.9967  181.0 11.98332       6.016460 0.87 
1 1 1 -22 6  16 o 267.8457 3.214002 402.6509  258.9 -58.88641      6.428004 0.97 
1 1 1 -22 6  17 o 182.9572 2.897936 360.6363  151.0 -8.722473      5.795872 0.95 
1 1 1 -22 6  18 o 36.08762 8.188116 116.2426  287.9 3.239357       16.37623 0.32 
1 1 1 -22 6  19 o 150.2348 3.589296 191.8756  334.0 -40.19769      7.178593 0.93 
1 1 1 -22 6  20 o 119.9509 3.287927 164.2104  337.2 -9.705292      6.575854 0.92 
1 1 1 -22 6  21 f 200.2030 3.069771 414.4915  335.2 16.23848       6.139542 0.00 
1 1 1 -22 6  22 f 70.31590 5.460754 90.20717  269.9 36.13723       10.92151 0.00 
1 1 1 -22 6  23 o 119.9130 3.888316 115.8124  232.8 -2.496880      7.776632 0.92 
1 1 1 -22 6  24 o 142.1439 3.721636 193.4529  23.8  4.204987       7.443273 0.97 
1 1 1 -22 6  25 o 137.5318 3.909436 210.9563  30.6  -4.288147      7.818872 0.97 
1 1 1 -22 6  26 f 80.78387 5.931170 199.9916  128.6 -19.66592      11.86234 0.00 
1 1 1 -22 6  27 o 92.12489 5.509098 147.2597  43.6  14.65615       11.01820 0.95 
1 1 1 -22 6  28 o 93.15248 5.035696 156.4177  2.8   7.780739       10.07139 0.94 
1 1 1 -22 6  29 o 68.82474 7.638387 130.8023  125.7 9.375259       15.27677 0.91 
1 1 1 -22 6  30 o 92.64430 5.600853 142.4771  197.3 25.46142       11.20171 0.95 
1 1 1 -22 6  31 o 41.47633 10.05773 46.21309  109.0 -12.11243      20.11546 0.64 
1 1 1 -22 6  32 o 55.29036 12.58843 75.78313  87.1  0.4059410      25.17686 0.87 
1 1 1 -22 6  33 o 54.64723 14.01673 78.08944  251.6 -13.09584      28.03346 0.88 
1 1 1 -22 6  34 o 100.8328 6.088925 155.5748  233.8 -2.583664      12.17785 0.98 
1 1 1 -22 6  35 f 86.83803 8.170914 79.13297  284.7 ?              ?        0.00 
1 1 1 -22 8  1  o 459.5416 4.061446 784.1701  75.8  42.25412       8.122892 0.99 
1 1 1 -22 8  2  o 234.8682 2.979929 383.8735  290.9 -30.49051      5.959858 0.94 
1 1 1 -22 8  3  o 319.0114 3.987016 328.7713  28.9  ?              ?        0.95 
1 1 1 -22 8  4  f 261.1191 3.417162 208.3481  39.4  -38.36032      6.834324 0.00 
1 1 1 -22 8  5  o 382.0323 3.741180 520.7349  28.7  23.91666       7.482360 0.97 
1 1 1 -22 8  6  o 353.5783 3.467925 536.9036  162.7 20.02133       6.935850 0.97 
1 1 1 -22 8  7  o 72.90591 5.456649 141.7975  189.0 -25.54042      10.91330 0.52 
1 1 1 -22 8  8  o 106.9336 3.589299 304.7237  342.7 -27.98266      7.178599 0.85 
1 1 1 -22 8  9  o 361.6569 3.429714 496.1573  223.7 10.02554       6.859428 0.97 
1 1 1 -22 8  10 o 78.76887 4.266080 183.6298  127.0 -24.86783      8.532160 0.66 
1 1 1 -22 8  11 o 167.8425 2.802434 142.5145  121.3 10.28963       5.604867 0.84 
1 1 1 -22 8  12 o 399.3308 3.923653 539.3562  246.0 2.133118       7.847306 0.99 
1 1 1 -22 8  13 o 162.1876 2.920266 432.3519  321.0 20.93504       5.840532 0.96 
1 1 1 -22 8  14 o 131.0714 3.532501 138.4777  108.4 -24.92712      7.065001 0.87 
1 1 1 -22 8  15 o 113.0405 3.106741 174.9989  353.1 -14.74901      6.213483 0.91 
1 1 1 -22 8  16 o 277.0765 3.270166 419.9436  301.2 10.51514       6.540332 0.99 
1 1 1 -22 8  17 o 309.3297 3.348819 503.0915  308.3 -2.355438      6.697638 0.99 
1 1 1 -22 8  18 o 129.2544 3.409979 112.1240  328.1 32.37950       6.819959 0.90 
1 1 1 -22 8  19 o 88.45923 4.504464 210.1298  349.2 35.04890       9.008927 0.93 
1 1 1 -22 8  20 o 53.57629 7.419128 112.2566  136.1 -39.98311      14.83826 0.79 
1 1 1 -22 8  21 o 93.49765 5.518581 130.9716  338.4 -3.751900      11.03716 0.92 
1 1 1 -22 8  22 o 111.6575 5.133356 125.2425  179.0 -38.24757      10.26671 0.94 
1 1 1 -22 8  23 o 55.94991 9.164524 141.0754  242.3 2.742531       18.32905 0.89 
1 1 1 -22 8  24 o 85.10154 6.246470 110.5165  35.2  -4.774353      12.49294 0.93 
1 1 1 -22 8  25 o 101.2898 5.378584 166.6546  25.9  21.58863       10.75717 0.96 
1 1 1 -22 8  26 o 129.1515 4.928329 173.2853  115.7 -39.98798      9.856657 0.96 
1 1 1 -22 8  27 o 82.98187 6.507318 112.2388  290.4 19.67169       13.01464 0.91 
1 1 1 -22 8  28 o 119.4375 8.576482 227.1487  343.0 -28.00137      17.15296 0.97 
1 1 1 -22 8  29 o 35.97118 10.38179 12.89828  213.6 2.026897       20.76358 0.20 
1 1 1 -22 8  30 o 67.35308 13.03181 116.6151  173.6 -33.97609      26.06362 0.93 
1 1 1 -22 8  31 o 88.76991 9.318270 146.6317  340.1 ?              ?        0.97 
1 1 1 -22 8  32 o 54.24057 12.51122 50.59590  94.1  19.55460       25.02245 0.81 
1 1 1 -22 8  33 o 29.06857 9.277833 37.71156  105.5 -1.397400      18.55567 0.61 
1 1 1 -22 10 1  o 156.7758 2.806899 279.7309  84.1  14.44272       5.613798 0.97 
1 1 1 -22 10 2  o 181.5604 2.942708 354.2430  81.8  -15.03224      5.885416 0.98 
1 1 1 -22 10 3  o 115.8940 2.939312 227.3241  149.4 -19.57337      5.878623 0.94 
1 1 1 -22 10 4  o 235.6423 3.984688 464.8540  236.1 3.250046       7.969376 0.99 
1 1 1 -22 10 5  o 284.0660 4.227003 372.4650  2.4   ?              ?        0.99 
1 1 1 -22 10 6  o 105.1664 5.283165 170.3398  177.9 10.67959       10.56633 0.91 
1 1 1 -22 10 7  o 376.8109 3.596663 640.7052  253.7 -31.50000      7.193325 0.99 
1 1 1 -22 10 8  o 191.3079 4.088571 394.5250  332.4 32.28552       8.177142 0.98 
1 1 1 -22 10 9  f 236.8733 3.735478 552.7481  66.1  -25.40289      7.470956 0.00 
1 1 1 -22 10 10 o 52.29932 8.497047 46.84150  221.1 -8.613075      16.99409 0.35 
1 1 1 -22 10 11 o 158.2507 3.936768 291.9718  308.6 -31.31664      7.873536 0.97 
1 1 1 -22 10 12 o 73.08520 7.315144 123.2266  208.4 -1.574844      14.63029 0.81 
1 1 1 -22 10 13 o 249.7246 3.113259 387.2786  333.7 -12.56877      6.226518 0.99 
1 1 1 -22 10 14 o 226.4058 3.279660 400.1221  22.7  -19.95039      6.559320 0.99 
1 1 1 -22 10 15 o 230.7055 3.027013 442.1833  4.4   -31.39534      6.054026 0.99 
1 1 1 -22 10 16 o 324.0746 3.407055 564.9225  23.0  -9.282623      6.814110 0.99 
1 1 1 -22 10 17 o 150.6100 3.135348 231.7323  92.9  17.66455       6.270696 0.97 
1 1 1 -22 10 18 o 122.0708 3.403910 154.4375  127.3 21.19106       6.807821 0.95 
1 1 1 -22 10 19 o 123.6779 3.919411 113.2797  120.0 0.7486877      7.838823 0.94 
1 1 1 -22 10 20 o 62.98038 7.898726 169.9292  336.4 -44.17615      15.79745 0.93 
1 1 1 -22 10 21 o 54.14060 9.132780 112.8618  73.4  -12.31397      18.26556 0.90 
1 1 1 -22 10 22 o 114.5940 5.027705 247.4617  84.5  -11.72572      10.05541 0.98 
1 1 1 -22 10 23 o 135.1747 4.765992 236.9022  1.2   -12.74541      9.531983 0.98 
1 1 1 -22 10 24 o 195.0369 4.414506 318.2575  342.6 -16.45876      8.829013 0.99 
1 1 1 -22 10 25 o 37.12326 10.34000 39.12576  348.3 -6.932713      20.68000 0.45 
1 1 1 -22 10 26 o 137.1736 5.585121 179.1334  183.0 9.480652       11.17024 0.98 
1 1 1 -22 10 27 o 46.02929 11.19796 42.73495  71.3  29.96171       22.39593 0.69 
1 1 1 -22 10 28 f 34.49179 10.28044 13.23775  6.1   -12.37415      20.56087 0.00 
1 1 1 -22 10 29 o 62.31949 11.59659 135.0479  184.1 5.322556       23.19318 0.95 
1 1 1 -22 10 30 o 35.06861 10.19072 45.54847  188.3 -12.30321      20.38144 0.71 
1 1 1 -22 10 31 o 38.90749 12.65681 92.41224  101.0 ?              ?        0.88 
1 1 1 -22 12 1  o 140.7218 4.210206 242.7021  198.1 23.33614       8.420411 0.97 
1 1 1 -22 12 2  o 287.5518 3.742076 417.9367  161.8 0.4833679      7.484153 0.99 
1 1 1 -22 12 3  o 119.1972 3.535685 148.1491  79.9  12.89317       7.071369 0.95 
1 1 1 -22 12 4  o 102.6152 4.190684 241.4373  219.2 -2.160919      8.381368 0.96 
1 1 1 -22 12 5  o 35.68408 8.650556 68.92426  76.6  11.12861       17.30111 0.55 
1 1 1 -22 12 6  o 111.4287 4.205832 152.3546  37.1  -20.29700      8.411664 0.95 
1 1 1 -22 12 7  o 169.7566 3.124322 273.1657  94.2  -4.785904      6.248643 0.98 
1 1 1 -22 12 8  o 214.0555 3.731128 314.7826  331.9 6.808609       7.462255 0.99 
1 1 1 -22 12 9  o 162.0605 4.193421 259.9448  0.3   2.099106       8.386843 0.98 
1 1 1 -22 12 10 o 114.5414 6.442375 165.8131  105.7 -38.16245      12.88475 0.96 
1 1 1 -22 12 11 o 207.4277 4.315555 389.8428  85.5  -45.04147      8.631109 0.99 
1 1 1 -22 12 12 o 143.6523 5.517725 264.9373  72.5  -27.66644      11.03545 0.98 
1 1 1 -22 12 13 o 80.34618 9.313740 134.9694  106.8 -17.72879      18.62748 0.93 
1 1 1 -22 12 14 o 132.4406 5.829348 186.8011  66.0  -29.65067      11.65870 0.97 
1 1 1 -22 12 15 o 42.38828 10.11651 99.65373  327.5 7.140751       20.23301 0.83 
1 1 1 -22 12 16 o 198.7084 4.594342 370.9695  140.9 -15.18810      9.188684 0.99 
1 1 1 -22 12 17 o 216.2821 4.758098 373.2375  113.8 -29.83774      9.516196 0.99 
1 1 1 -22 12 18 o 86.11757 10.36955 129.2691  92.9  -19.75134      20.73910 0.93 
1 1 1 -22 12 19 o 64.55494 11.56685 123.7244  263.3 -11.37868      23.13369 0.89 
1 1 1 -22 12 20 f 27.52284 9.537681 44.66725  328.4 17.14719       19.07536 0.00 
1 1 1 -22 12 21 o 78.92665 11.99506 142.7258  350.0 -17.88972      23.99011 0.93 
1 1 1 -22 12 22 o 86.58446 6.013478 222.4412  318.3 -11.62583      12.02696 0.97 
1 1 1 -22 12 23 o 54.66810 9.147627 50.57674  117.2 7.118320       18.29525 0.80 
1 1 1 -22 12 24 o 100.8247 5.711292 181.4738  72.9  -6.400902      11.42258 0.98 
1 1 1 -22 12 25 o 73.30906 8.779302 176.0576  163.9 -16.67230      17.55860 0.97 
1 1 1 -22 12 26 o 86.57962 11.44352 148.3248  227.8 -40.14275      22.88704 0.97 
1 1 1 -22 12 27 o 59.06722 10.48155 87.41302  260.0 36.17224       20.96311 0.92 
1 1 1 -22 12 28 o 29.13109 9.752155 22.41454  290.6 ?              ?        0.44 
1 1 1 -22 14 1  o 51.97446 8.351035 45.40107  102.3 -2.879658      16.70207 0.65 
1 1 1 -22 14 2  o 156.8532 3.758371 224.0462  109.3 17.15495       7.516742 0.98 
1 1 1 -22 14 3  o 109.0346 4.513587 199.4680  137.7 29.01960       9.027173 0.97 
1 1 1 -22 14 4  o 148.2302 5.491651 240.8939  79.1  -15.97672      10.98330 0.98 
1 1 1 -22 14 5  o 68.29411 7.194257 164.7428  77.8  -1.338852      14.38851 0.94 
1 1 1 -22 14 6  o 46.04144 9.572802 85.50294  134.6 -3.374958      19.14560 0.80 
1 1 1 -22 14 7  o 205.2290 3.953730 386.0179  216.1 -14.76651      7.907459 0.99 
1 1 1 -22 14 8  o 170.1194 3.771476 312.3212  191.0 6.382599       7.542951 0.99 
1 1 1 -22 14 9  o 41.13137 11.42300 96.85008  12.9  25.77220       22.84600 0.77 
1 1 1 -22 14 10 f 74.90944 10.30643 207.9248  280.4 -32.15743      20.61286 0.00 
1 1 1 -22 14 11 o 146.1087 5.574161 289.2764  305.7 5.342117       11.14832 0.98 
1 1 1 -22 14 12 o 27.49388 9.178821 63.29515  42.3  9.715399       18.35764 0.53 
1 1 1 -22 14 13 o 46.02951 11.86247 41.81597  258.1 10.00299       23.72494 0.55 
1 1 1 -22 14 14 o 61.30623 10.52179 166.1524  331.0 -31.00444      21.04358 0.93 
1 1 1 -22 14 15 o 52.45356 10.20191 80.49393  241.9 -25.79854      20.40382 0.84 
1 1 1 -22 14 16 o 118.4468 7.362984 165.9512  172.7 -7.507668      14.72597 0.97 
1 1 1 -22 14 17 o 36.11034 9.813689 68.57886  91.0  2.432842       19.62738 0.77 
1 1 1 -22 14 18 o 52.85567 13.75633 41.61501  339.9 13.75942       27.51266 0.71 
1 1 1 -22 14 19 o 50.22424 15.76642 27.63313  216.9 ?              ?        0.54 
1 1 1 -22 14 20 o 94.74976 11.99790 159.0959  71.5  16.17305       23.99580 0.97 
1 1 1 -22 14 21 o 30.99412 10.28812 42.68213  250.4 -1.724876      20.57625 0.65 
1 1 1 -22 14 22 o 59.64816 11.81668 175.9813  237.2 -32.31435      23.63337 0.96 
1 1 1 -22 14 23 o 48.03412 21.76966 50.08002  189.0 ?              ?        0.63 
1 1 1 -22 14 24 o 40.89530 12.70694 65.18159  37.3  ?              ?        0.84 
1 1 1 -22 16 1  o 86.15070 7.348902 200.4268  264.7 -7.639214      14.69780 0.98 
1 1 1 -22 16 2  o 112.0947 5.813956 156.1527  7.1   -3.785408      11.62791 0.98 
1 1 1 -22 16 3  f 60.38809 10.24325 115.1842  28.5  10.32325       20.48651 0.00 
1 1 1 -22 16 4  o 31.40911 9.911080 53.70419  176.7 8.953016       19.82216 0.70 
1 1 1 -22 16 5  o 118.2866 5.288841 213.2841  121.3 34.21550       10.57768 0.99 
1 1 1 -22 16 6  o 139.3037 6.367348 225.3857  102.0 15.20729       12.73470 0.99 
1 1 1 -22 16 7  o 81.83133 7.602099 166.8470  354.3 -1.490997      15.20420 0.97 
1 1 1 -22 16 8  o 92.85976 6.775652 161.9931  16.7  22.13821       13.55130 0.98 
1 1 1 -22 16 9  o 82.56314 7.917140 149.5408  98.5  0.8277893E-02  15.83428 0.97 
1 1 1 -22 16 10 o 38.17241 12.18182 91.94637  278.5 16.59991       24.36364 0.87 
1 1 1 -22 16 11 o 54.80630 12.59535 113.0654  314.3 7.720219       25.19070 0.93 
1 1 1 -22 16 12 o 69.52244 12.66643 110.6217  267.3 16.55250       25.33287 0.94 
1 1 1 -22 16 13 f 113.7407 11.66993 202.6281  246.3 -21.62240      23.33985 0.00 
1 1 1 -22 16 14 o 44.12656 13.67113 49.58367  120.6 28.52025       27.34226 0.75 
1 1 1 -22 16 15 o 38.30905 11.47782 46.60059  355.5 6.830959       22.95565 0.74 
1 1 1 -22 16 16 o 42.60046 10.85759 73.04074  336.2 1.298790       21.71519 0.87 
1 1 1 -22 16 17 o 41.12056 13.01412 30.05974  335.8 6.887386       26.02823 0.60 
1 1 1 -22 16 18 o 81.22353 13.61543 120.3626  158.1 ?              ?        0.96 
1 1 1 -21 1  1  o 206.9498 2.999694 363.8949  195.1 -70.23456      5.999389 0.89 
1 1 1 -21 1  2  o 163.7277 2.898496 364.2823  357.5 13.62320       5.796991 0.89 
1 1 1 -21 1  3  o 352.6379 4.322145 615.4598  163.4 27.37827       8.644291 0.97 
1 1 1 -21 1  4  o 362.1768 4.321234 769.6207  7.2   40.15628       8.642468 0.97 
1 1 1 -21 1  5  f 407.0244 4.620363 701.9431  142.5 20.64175       9.240726 0.00 
1 1 1 -21 1  6  o 146.7585 3.001463 290.2407  36.9  5.575745       6.002926 0.83 
1 1 1 -21 1  7  o 566.8567 5.601023 1114.153  323.3 79.37335       11.20205 0.99 
1 1 1 -21 1  8  o 225.1208 3.147892 246.7855  346.6 -2.349762      6.295783 0.86 
1 1 1 -21 1  9  o 418.5247 4.369770 746.7105  156.3 43.66406       8.739539 0.97 
1 1 1 -21 1  10 o 388.8732 4.107988 666.8848  230.5 -1.961304      8.215977 0.97 
1 1 1 -21 1  11 o 156.5493 2.633148 591.8557  266.7 81.03931       5.266295 0.85 
1 1 1 -21 1  12 o 137.6057 2.350932 343.8147  231.0 -17.57657      4.701864 0.81 
1 1 1 -21 1  13 o 567.0614 5.391819 1067.459  120.8 -18.95941      10.78364 0.99 
1 1 1 -21 1  14 o 302.8857 3.261503 424.0494  108.7 -18.84854      6.523005 0.92 
1 1 1 -21 1  15 o 333.2122 3.463244 315.9107  354.2 17.82144       6.926487 0.94 
1 1 1 -21 1  16 o 299.5979 3.312531 424.9562  91.9  80.60370       6.625061 0.95 
1 1 1 -21 1  17 f 62.47932 4.127065 141.0143  355.5 16.65030       8.254129 0.00 
1 1 1 -21 1  18 o 523.8753 6.173228 658.9166  268.1 59.68176       12.34646 0.98 
1 1 1 -21 1  19 o 485.2300 4.542519 676.3693  90.0  -14.52737      9.085037 0.98 
1 1 1 -21 1  20 o 204.6791 2.684253 236.8837  92.9  67.12349       5.368506 0.90 
1 1 1 -21 1  21 o 303.9322 3.363113 394.2021  194.7 -9.941528      6.726226 0.97 
1 1 1 -21 1  22 o 160.3972 2.843446 333.1833  282.3 3.804443       5.686892 0.95 
1 1 1 -21 1  23 o 94.81641 3.833797 113.5448  22.9  22.00629       7.667593 0.81 
1 1 1 -21 1  24 o 92.87817 4.596424 130.7052  42.3  -20.78808      9.192848 0.86 
1 1 1 -21 1  25 o 212.5865 3.182130 304.1565  274.3 2.244324       6.364260 0.98 
1 1 1 -21 1  26 o 101.9988 3.977028 203.2641  43.8  2.749306       7.954055 0.94 
1 1 1 -21 1  27 o 162.1099 4.096161 225.5766  298.3 -30.58842      8.192322 0.97 
1 1 1 -21 1  28 o 228.8445 3.408256 265.8451  319.5 -3.925522      6.816513 0.99 
1 1 1 -21 1  29 o 179.0321 4.819022 305.7179  159.3 ?              ?        0.99 
1 1 1 -21 1  30 o 96.69159 6.664386 104.2496  316.3 -14.49570      13.32877 0.92 
1 1 1 -21 1  31 o 88.98785 7.048469 62.16127  135.7 28.34096       14.09694 0.82 
1 1 1 -21 1  32 o 65.86558 9.271040 48.05179  234.1 -11.41462      18.54208 0.70 
1 1 1 -21 1  33 o 56.40860 10.19625 97.98721  204.3 20.11297       20.39250 0.88 
1 1 1 -21 1  34 o 48.31646 12.30001 66.23566  126.7 11.10994       24.60001 0.81 
1 1 1 -21 1  35 o 100.2251 7.974529 100.4856  17.2  0.3767929      15.94906 0.96 
1 1 1 -21 1  36 o 66.03828 12.13652 157.4711  294.9 -28.29412      24.27304 0.96 
1 1 1 -21 1  37 o 31.31808 10.18959 19.06664  259.8 ?              ?        0.38 
1 1 1 -21 3  1  o 111.0821 2.339067 454.9518  225.8 -31.70101      4.678134 0.75 
1 1 1 -21 3  2  o 208.9886 2.887155 132.9618  25.2  87.32707       5.774310 0.86 
1 1 1 -21 3  3  o 221.5529 2.697892 396.4678  73.2  -11.45375      5.395785 0.91 
1 1 1 -21 3  4  o 341.4363 3.438339 330.6257  72.4  50.07266       6.876677 0.95 
1 1 1 -21 3  5  o 288.7377 3.336959 871.6876  20.2  -46.85791      6.673919 0.96 
1 1 1 -21 3  6  o 37.74885 5.822233 75.69077  257.1 -20.96060      11.64447 0.14 
1 1 1 -21 3  7  o 431.8759 4.190307 557.9661  316.3 -12.11075      8.380614 0.98 
1 1 1 -21 3  8  o 289.0133 3.429946 434.4848  336.8 -61.72855      6.859892 0.94 
1 1 1 -21 3  9  o 573.8953 5.465491 917.7504  223.3 46.92090       10.93098 0.98 
1 1 1 -21 3  10 o 404.4991 3.949152 502.6265  257.3 -88.34082      7.898305 0.97 
1 1 1 -21 3  11 o 398.0150 4.053853 554.5399  312.1 -9.697845      8.107706 0.97 
1 1 1 -21 3  12 o 269.7291 3.145010 455.5887  63.7  24.48883       6.290019 0.93 
1 1 1 -21 3  13 f 220.8513 2.785934 398.5284  98.3  7.516037       5.571868 0.00 
1 1 1 -21 3  14 o 552.6694 4.942357 929.9335  287.5 -36.94318      9.884713 0.99 
1 1 1 -21 3  15 o 219.4139 3.599580 380.3391  92.8  9.260452       7.199160 0.91 
1 1 1 -21 3  16 o 125.1704 2.467382 216.6396  184.3 -14.64147      4.934765 0.72 
1 1 1 -21 3  17 o 262.6927 3.095863 494.8415  170.9 -20.95854      6.191727 0.95 
1 1 1 -21 3  18 o 154.0838 2.519242 319.0542  87.6  -4.452332      5.038484 0.86 
1 1 1 -21 3  19 o 71.32227 4.545721 99.10299  125.1 28.03968       9.091441 0.32 
1 1 1 -21 3  20 o 112.9296 4.085158 181.5932  310.3 13.43919       8.170316 0.82 
1 1 1 -21 3  21 o 110.1044 3.278450 213.2934  218.9 20.26221       6.556900 0.88 
1 1 1 -21 3  22 o 90.43633 4.365784 171.0480  307.3 -32.79211      8.731568 0.88 
1 1 1 -21 3  23 o 134.8086 3.102510 174.2076  267.7 19.13368       6.205020 0.93 
1 1 1 -21 3  24 o 159.8381 3.104831 284.3276  250.1 21.91069       6.209661 0.96 
1 1 1 -21 3  25 o 255.2861 3.390634 384.2020  185.2 13.93346       6.781268 0.99 
1 1 1 -21 3  26 o 178.6876 3.045707 326.6958  63.0  13.50737       6.091414 0.98 
1 1 1 -21 3  27 o 204.2062 3.414118 266.8154  119.9 -22.93788      6.828236 0.98 
1 1 1 -21 3  28 o 103.3972 4.827020 189.9466  150.9 -23.88223      9.654039 0.96 
1 1 1 -21 3  29 o 54.00537 8.321337 74.40987  323.8 45.79681       16.64267 0.82 
1 1 1 -21 3  30 o 51.97675 9.012209 61.85811  141.4 2.426983       18.02442 0.67 
1 1 1 -21 3  31 o 76.34259 8.547660 70.15376  276.6 -27.87963      17.09532 0.83 
1 1 1 -21 3  32 o 169.4474 5.167737 221.0201  336.8 17.69737       10.33547 0.98 
1 1 1 -21 3  33 o 39.73278 9.664546 85.99447  184.5 -22.85165      19.32909 0.82 
1 1 1 -21 3  34 o 54.03074 11.62381 69.50903  192.7 10.18130       23.24761 0.87 
1 1 1 -21 3  35 o 101.4866 6.776811 142.5538  178.6 -4.016441      13.55362 0.97 
1 1 1 -21 3  36 o 46.27296 10.41137 94.83427  192.2 -26.73096      20.82273 0.90 
1 1 1 -21 3  37 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -21 5  1  o 675.8080 5.043801 1048.302  2.2   14.55713       10.08760 0.99 
1 1 1 -21 5  2  o 538.0137 4.185280 688.1740  220.5 5.572754       8.370561 0.98 
1 1 1 -21 5  3  o 184.4146 2.324086 99.48549  258.1 17.69980       4.648172 0.82 
1 1 1 -21 5  4  o 300.3994 3.037074 558.8044  159.2 -4.778564      6.074148 0.95 
1 1 1 -21 5  5  o 404.7484 3.772295 716.8333  239.2 6.099854       7.544590 0.97 
1 1 1 -21 5  6  o 601.6440 4.970352 949.0568  230.7 -45.25153      9.940704 0.99 
1 1 1 -21 5  7  o 427.0485 3.691053 669.8940  24.6  -30.36951      7.382105 0.97 
1 1 1 -21 5  8  o 256.4546 3.838132 425.0094  85.6  1.709991       7.676263 0.94 
1 1 1 -21 5  9  o 281.8409 3.119806 415.1491  90.5  -29.80237      6.239611 0.94 
1 1 1 -21 5  10 o 379.2667 3.891869 611.6535  355.0 1.657990       7.783739 0.97 
1 1 1 -21 5  11 o 417.0713 4.018879 601.0718  220.1 -3.232361      8.037758 0.97 
1 1 1 -21 5  12 o 398.8843 3.893551 581.5944  277.6 18.19763       7.787103 0.97 
1 1 1 -21 5  13 o 214.7022 2.781847 207.7293  270.0 4.664322       5.563695 0.89 
1 1 1 -21 5  14 o 265.1223 3.001049 471.5182  314.7 5.460083       6.002099 0.94 
1 1 1 -21 5  15 o 185.7792 2.915653 158.0290  320.3 37.48997       5.831306 0.78 
1 1 1 -21 5  16 o 335.6650 3.587383 492.3887  226.5 -29.27713      7.174767 0.97 
1 1 1 -21 5  17 o 213.5073 2.849195 257.0311  7.4   16.97617       5.698390 0.90 
1 1 1 -21 5  18 o 143.5384 3.018091 146.6434  251.7 -2.088638      6.036181 0.81 
1 1 1 -21 5  19 o 125.8449 3.122777 232.0909  57.1  -9.794289      6.245553 0.90 
1 1 1 -21 5  20 o 368.5277 3.710521 563.0646  40.5  -0.8989563     7.421041 0.99 
1 1 1 -21 5  21 o 348.9696 3.873763 476.3625  11.3  -10.80157      7.747525 0.99 
1 1 1 -21 5  22 o 204.5354 3.015065 238.5280  290.2 3.472855       6.030130 0.97 
1 1 1 -21 5  23 o 198.2214 4.449756 311.1556  284.4 -17.46478      8.899511 0.98 
1 1 1 -21 5  24 o 117.4011 3.672072 104.0775  41.5  19.45558       7.344145 0.90 
1 1 1 -21 5  25 o 90.11360 4.949870 101.0223  15.6  -36.53912      9.899739 0.89 
1 1 1 -21 5  26 o 61.72621 7.272922 121.6187  121.3 24.47367       14.54584 0.87 
1 1 1 -21 5  27 o 170.4738 3.944031 242.3323  36.7  -6.411804      7.888062 0.98 
1 1 1 -21 5  28 o 147.9245 4.855896 196.5784  41.0  35.22632       9.711791 0.98 
1 1 1 -21 5  29 o 47.28925 8.004714 80.79768  205.1 30.74725       16.00943 0.73 
1 1 1 -21 5  30 o 35.72754 9.543889 95.53248  293.7 1.978020       19.08778 0.71 
1 1 1 -21 5  31 o 44.18141 10.00585 78.95068  259.5 0.1072159      20.01169 0.77 
1 1 1 -21 5  32 o 85.84787 6.519784 74.45427  15.0  3.438026       13.03957 0.92 
1 1 1 -21 5  33 o 79.71581 12.95873 108.8572  4.3   10.83655       25.91746 0.94 
1 1 1 -21 5  34 o 46.13302 9.842638 16.61500  287.4 -41.28468      19.68528 0.42 
1 1 1 -21 5  35 o 67.16913 11.56132 91.09253  233.9 -3.933167      23.12264 0.93 
1 1 1 -21 5  36 o 34.34423 10.29829 46.54690  330.8 ?              ?        0.74 
1 1 1 -21 7  1  o 353.6008 3.643530 582.9924  119.2 83.83334       7.287060 0.97 
1 1 1 -21 7  2  o 404.4327 3.851818 489.1943  30.2  17.51242       7.703637 0.97 
1 1 1 -21 7  3  o 400.0550 3.796973 455.0173  100.9 -32.94498      7.593947 0.96 
1 1 1 -21 7  4  o 674.9210 5.547739 992.2661  112.4 1.118835       11.09548 0.99 
1 1 1 -21 7  5  o 293.7533 3.132457 463.6454  38.8  24.10919       6.264913 0.95 
1 1 1 -21 7  6  o 298.4409 3.089362 548.6109  135.5 20.71375       6.178724 0.96 
1 1 1 -21 7  7  o 479.1832 4.148422 656.1511  126.2 26.81027       8.296844 0.98 
1 1 1 -21 7  8  o 136.8446 2.787524 202.4138  196.4 29.68001       5.575047 0.79 
1 1 1 -21 7  9  o 264.2117 2.906056 450.9367  327.8 -53.37692      5.812111 0.95 
1 1 1 -21 7  10 o 494.5957 4.386375 803.7368  10.0  17.78741       8.772750 0.98 
1 1 1 -21 7  11 o 309.9573 4.146780 514.9609  42.1  -12.59204      8.293559 0.96 
1 1 1 -21 7  12 o 95.60055 3.821186 260.6477  319.9 -47.15878      7.642373 0.76 
1 1 1 -21 7  13 o 310.5468 3.341320 540.2415  356.2 -26.23706      6.682641 0.97 
1 1 1 -21 7  14 o 67.33021 5.171196 82.15002  52.9  -15.91199      10.34239 0.25 
1 1 1 -21 7  15 o 240.8261 2.901414 328.4921  347.6 -19.22151      5.802828 0.96 
1 1 1 -21 7  16 o 236.7605 3.008181 194.5056  289.0 -17.33630      6.016361 0.94 
1 1 1 -21 7  17 f 67.78114 5.501431 120.8772  110.8 17.34026       11.00286 0.00 
1 1 1 -21 7  18 o 105.7864 4.158339 213.1068  247.1 -29.54922      8.316678 0.93 
1 1 1 -21 7  19 o 116.1320 3.788518 162.7873  359.3 7.135361       7.577036 0.92 
1 1 1 -21 7  20 f 93.37959 4.932483 153.8296  159.4 -27.76252      9.864965 0.00 
1 1 1 -21 7  21 o 138.5556 3.546719 276.5504  11.0  0.7080688      7.093437 0.97 
1 1 1 -21 7  22 o 59.99937 7.841285 128.4218  157.7 -27.81784      15.68257 0.85 
1 1 1 -21 7  23 o 70.63341 5.975741 213.3054  151.4 2.111061       11.95148 0.94 
1 1 1 -21 7  24 o 155.2434 3.998269 249.1705  50.7  -11.44246      7.996538 0.98 
1 1 1 -21 7  25 o 76.09306 6.461184 118.5399  6.1   -14.56192      12.92237 0.92 
1 1 1 -21 7  26 o 102.0650 5.220128 186.2309  147.4 -38.46117      10.44026 0.97 
1 1 1 -21 7  27 o 110.6031 5.463984 166.0152  198.8 8.777351       10.92797 0.96 
1 1 1 -21 7  28 o 204.7956 3.882718 345.6936  335.9 14.07327       7.765437 0.99 
1 1 1 -21 7  29 o 77.60281 6.823260 151.3823  294.5 1.602493       13.64652 0.94 
1 1 1 -21 7  30 o 134.7791 5.204290 212.8085  170.5 -23.61435      10.40858 0.98 
1 1 1 -21 7  31 o 53.90937 13.79280 117.6108  3.9   -23.45427      27.58561 0.91 
1 1 1 -21 7  32 o 69.80757 9.891243 94.24930  97.6  -5.177025      19.78249 0.94 
1 1 1 -21 7  33 o 42.63806 10.83506 60.12621  234.0 -3.859585      21.67012 0.81 
1 1 1 -21 7  34 o 59.33727 10.64926 90.08369  343.2 ?              ?        0.93 
1 1 1 -21 9  1  o 506.1238 5.070187 763.5208  170.2 17.46338       10.14037 0.99 
1 1 1 -21 9  2  o 119.3234 3.109293 301.7554  338.8 -4.240181      6.218585 0.89 
1 1 1 -21 9  3  o 365.7442 3.685301 514.2634  87.4  24.58786       7.370603 0.98 
1 1 1 -21 9  4  o 259.2606 2.950185 375.4772  251.0 62.93416       5.900370 0.96 
1 1 1 -21 9  5  o 190.5697 2.976288 369.3027  48.4  -63.65134      5.952575 0.95 
1 1 1 -21 9  6  o 222.6872 3.604887 262.9074  180.0 27.22719       7.209774 0.94 
1 1 1 -21 9  7  o 89.94949 3.953113 107.5899  326.9 -15.48028      7.906227 0.66 
1 1 1 -21 9  8  o 145.9510 3.396335 187.1184  240.2 64.76275       6.792671 0.88 
1 1 1 -21 9  9  o 39.20361 6.636237 99.47000  190.1 -29.74479      13.27247 0.31 
1 1 1 -21 9  10 o 315.1370 3.281056 533.6104  141.1 -12.91544      6.562111 0.99 
1 1 1 -21 9  11 o 137.0088 2.950447 157.2805  100.8 3.302307       5.900893 0.90 
1 1 1 -21 9  12 o 128.4521 3.365329 98.94414  134.0 -55.62503      6.730658 0.86 
1 1 1 -21 9  13 o 239.7108 2.930861 384.4876  29.9  -0.6351624     5.861721 0.98 
1 1 1 -21 9  14 o 142.2465 3.046510 230.5227  68.4  9.782364       6.093019 0.96 
1 1 1 -21 9  15 o 166.6279 2.703365 199.2708  31.7  -14.45399      5.406731 0.96 
1 1 1 -21 9  16 o 81.62714 4.950912 128.5428  92.3  -15.52351      9.901823 0.82 
1 1 1 -21 9  17 o 80.45423 4.887291 80.86744  40.7  -15.84586      9.774583 0.76 
1 1 1 -21 9  18 o 125.0002 3.527015 160.7611  264.6 -14.75079      7.054029 0.94 
1 1 1 -21 9  19 o 138.1365 3.738216 196.5829  306.1 3.962753       7.476432 0.97 
1 1 1 -21 9  20 o 128.8312 3.743616 179.7593  273.8 37.75857       7.487232 0.96 
1 1 1 -21 9  21 f 56.96296 8.417987 131.8408  90.4  -3.334618      16.83597 0.00 
1 1 1 -21 9  22 o 65.82140 8.325859 112.1345  134.8 -4.471584      16.65172 0.90 
1 1 1 -21 9  23 o 55.37422 9.262847 92.54041  113.2 -22.95509      18.52569 0.88 
1 1 1 -21 9  24 o 63.38844 8.926332 115.0422  211.9 30.91911       17.85266 0.90 
1 1 1 -21 9  25 o 75.55853 8.695072 182.2557  10.8  -32.73096      17.39014 0.94 
1 1 1 -21 9  26 o 177.6244 4.338994 269.4431  127.0 -14.94896      8.677988 0.99 
1 1 1 -21 9  27 f 53.07316 13.28556 104.5254  68.6  -9.185040      26.57112 0.00 
1 1 1 -21 9  28 o 83.72035 7.435246 92.99284  334.8 4.193748       14.87049 0.93 
1 1 1 -21 9  29 o 85.06752 7.728261 188.8171  231.3 -12.64601      15.45652 0.97 
1 1 1 -21 9  30 o 112.2758 12.78390 183.3214  231.5 -33.92732      25.56781 0.98 
1 1 1 -21 9  31 o 47.79356 14.24739 73.77547  40.2  -31.61388      28.49478 0.85 
1 1 1 -21 9  32 o 49.13846 14.55754 64.00687  176.9 -31.76289      29.11508 0.84 
1 1 1 -21 11 1  o 121.6830 3.344453 246.8335  32.5  26.98566       6.688906 0.95 
1 1 1 -21 11 2  o 211.7478 2.856704 408.6262  16.2  6.510666       5.713409 0.98 
1 1 1 -21 11 3  o 46.81866 7.661620 51.84205  296.1 -33.09443      15.32324 0.44 
1 1 1 -21 11 4  o 234.9277 3.317996 393.6652  168.6 -50.88283      6.635993 0.98 
1 1 1 -21 11 5  o 242.7714 4.762818 409.7281  92.8  ?              ?        0.99 
1 1 1 -21 11 6  f 77.20766 4.882417 74.17425  183.6 -17.99000      9.764833 0.00 
1 1 1 -21 11 7  o 234.7764 3.131045 301.6759  265.6 -28.45490      6.262090 0.98 
1 1 1 -21 11 8  o 185.5796 2.983580 389.6952  218.8 -36.00790      5.967160 0.98 
1 1 1 -21 11 9  o 239.5964 3.712255 447.5150  167.9 ?              ?        0.99 
1 1 1 -21 11 10 o 65.60682 6.764319 69.41518  74.6  12.26125       13.52864 0.65 
1 1 1 -21 11 11 f 129.8368 4.303656 101.8381  69.1  18.00034       8.607312 0.00 
1 1 1 -21 11 12 o 130.2470 4.719605 186.6792  163.1 -32.36278      9.439211 0.96 
1 1 1 -21 11 13 o 174.3009 4.351065 304.4774  78.3  24.53867       8.702130 0.98 
1 1 1 -21 11 14 o 135.0278 5.360376 219.4519  99.1  -13.04095      10.72075 0.97 
1 1 1 -21 11 15 o 144.0651 4.782313 223.7358  337.9 26.46269       9.564626 0.97 
1 1 1 -21 11 16 o 172.5058 4.139546 345.6310  55.3  -4.662842      8.279093 0.99 
1 1 1 -21 11 17 o 210.8188 4.914011 358.4607  120.0 0.3213806      9.828023 0.99 
1 1 1 -21 11 18 o 67.19244 6.499948 81.15068  116.9 -30.50926      12.99990 0.88 
1 1 1 -21 11 19 o 114.5737 3.927367 158.4446  283.2 -19.42368      7.854733 0.97 
1 1 1 -21 11 20 o 96.59016 4.383993 86.10555  350.3 16.45602       8.767985 0.92 
1 1 1 -21 11 21 o 45.11666 9.709716 79.22625  60.5  9.029148       19.41943 0.74 
1 1 1 -21 11 22 o 62.27909 8.660936 140.0566  150.6 4.570538       17.32187 0.91 
1 1 1 -21 11 23 f 156.8441 4.216581 301.2756  185.7 7.213989       8.433162 0.00 
1 1 1 -21 11 24 o 51.44088 11.23947 66.01198  277.5 7.509636       22.47895 0.78 
1 1 1 -21 11 25 o 40.15441 10.53074 33.67818  328.5 -12.25593      21.06149 0.54 
1 1 1 -21 11 26 o 159.5744 5.249179 267.3268  217.0 -3.896973      10.49836 0.99 
1 1 1 -21 11 27 o 56.40453 11.10382 107.5107  236.3 4.054752       22.20764 0.93 
1 1 1 -21 11 28 o 36.55415 16.65663 36.94857  26.0  ?              ?        0.52 
1 1 1 -21 11 29 o 60.59600 19.01356 120.5296  185.4 ?              ?        0.91 
1 1 1 -21 11 30 o 43.37474 18.33358 69.65504  172.1 ?              ?        0.79 
1 1 1 -21 13 1  o 31.75288 8.459857 50.06017  101.1 -2.832418      16.91971 0.47 
1 1 1 -21 13 2  o 90.11522 4.357922 188.0252  27.2  -2.103851      8.715844 0.96 
1 1 1 -21 13 3  o 206.5065 3.135483 335.5491  121.6 20.24120       6.270965 0.99 
1 1 1 -21 13 4  o 125.2176 3.746873 211.3710  219.1 12.19925       7.493746 0.97 
1 1 1 -21 13 5  o 108.8522 4.215184 95.82950  158.3 19.62002       8.430367 0.93 
1 1 1 -21 13 6  o 102.4144 4.533819 169.3151  91.3  -12.71472      9.067637 0.96 
1 1 1 -21 13 7  o 61.55376 6.999413 139.5293  199.4 0.8910484      13.99883 0.91 
1 1 1 -21 13 8  o 30.52686 8.737806 44.98920  230.6 2.175749       17.47561 0.44 
1 1 1 -21 13 9  o 124.8981 6.466917 259.0109  281.9 -23.12482      12.93383 0.98 
1 1 1 -21 13 10 o 53.87610 10.66230 51.42058  174.2 26.31408       21.32460 0.72 
1 1 1 -21 13 11 o 197.0678 5.105029 417.0550  83.4  -7.246643      10.21006 0.99 
1 1 1 -21 13 12 o 244.0480 4.547944 404.2976  63.7  -37.61862      9.095888 1.00 
1 1 1 -21 13 13 o 56.07655 10.45263 38.38831  275.1 -9.444328      20.90527 0.64 
1 1 1 -21 13 14 o 39.94329 11.74308 70.77416  89.0  33.27501       23.48615 0.69 
1 1 1 -21 13 15 o 70.84207 9.976514 99.56153  200.5 -40.13161      19.95303 0.89 
1 1 1 -21 13 16 o 159.8551 3.282794 321.3846  222.6 ?              ?        0.99 
1 1 1 -21 13 17 o 114.3063 7.165419 172.4342  92.7  1.339798       14.33084 0.97 
1 1 1 -21 13 18 o 66.99742 10.75432 150.3815  80.8  -20.29060      21.50864 0.93 
1 1 1 -21 13 19 o 130.4072 8.879667 201.5447  178.5 7.939461       17.75933 0.98 
1 1 1 -21 13 20 o 121.1407 9.628815 177.8934  207.8 -13.36285      19.25763 0.98 
1 1 1 -21 13 21 o 60.31251 14.16239 135.5009  293.5 -3.583866      28.32479 0.93 
1 1 1 -21 13 22 o 53.66644 14.60339 101.5856  314.2 22.35434       29.20678 0.90 
1 1 1 -21 13 23 o 63.68382 11.99473 74.90351  43.0  -36.02593      23.98947 0.91 
1 1 1 -21 13 24 o 61.23495 14.04411 60.08254  47.4  -1.528130      28.08821 0.86 
1 1 1 -21 13 25 o 35.45063 17.42448 52.02566  237.2 ?              ?        0.63 
1 1 1 -21 13 26 o 57.26447 12.94724 59.00401  112.9 ?              ?        0.87 
1 1 1 -21 13 27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -21 15 1  o 62.89341 8.319277 154.4600  335.4 28.93561       16.63855 0.93 
1 1 1 -21 15 2  o 134.1871 4.642194 269.6915  11.4  10.22427       9.284389 0.98 
1 1 1 -21 15 3  o 240.0642 3.825915 397.8570  300.6 -6.147476      7.651830 0.99 
1 1 1 -21 15 4  o 52.28040 9.668901 191.0165  282.5 -8.479710      19.33780 0.93 
1 1 1 -21 15 5  o 68.80480 8.285329 99.68887  354.8 -12.56758      16.57066 0.90 
1 1 1 -21 15 6  o 75.15981 7.517757 140.6209  12.2  24.97946       15.03551 0.94 
1 1 1 -21 15 7  o 73.61183 8.549613 140.9910  165.7 -21.65027      17.09923 0.94 
1 1 1 -21 15 8  o 34.59222 9.327958 58.41057  240.7 -2.915066      18.65592 0.63 
1 1 1 -21 15 9  o 99.67300 6.523938 200.4001  250.6 -17.06107      13.04788 0.97 
1 1 1 -21 15 10 o 57.96801 10.63452 119.7735  197.1 -24.87778      21.26904 0.91 
1 1 1 -21 15 11 o 82.47592 10.50725 157.3460  102.3 0.9961700E-01  21.01449 0.96 
1 1 1 -21 15 12 o 41.29160 11.11174 43.57002  208.5 1.869820       22.22348 0.64 
1 1 1 -21 15 13 o 80.74454 11.55467 145.4963  245.3 13.18340       23.10934 0.96 
1 1 1 -21 15 14 o 41.98219 12.55711 65.66129  127.4 17.76413       25.11422 0.79 
1 1 1 -21 15 15 o 102.6317 9.551148 146.6477  170.1 19.86243       19.10230 0.97 
1 1 1 -21 15 16 o 45.66279 10.46250 139.3575  86.6  -3.182156      20.92499 0.94 
1 1 1 -21 15 17 o 48.25897 12.44567 77.52321  341.0 -10.37427      24.89133 0.88 
1 1 1 -21 15 18 o 57.67941 14.21484 121.1128  293.9 2.652576       28.42967 0.93 
1 1 1 -21 15 19 o 72.38454 31.19128 106.8604  256.4 ?              ?        0.81 
1 1 1 -21 15 20 o 47.71597 14.38378 30.20769  299.5 32.71363       28.76757 0.61 
1 1 1 -21 15 21 o 48.98742 14.45092 103.0551  258.4 ?              ?        0.91 
1 1 1 -21 15 22 o 51.58208 10.87197 129.0922  176.4 ?              ?        0.95 
1 1 1 -21 17 1  o 36.39252 10.66590 68.21060  240.3 6.221478       21.33180 0.83 
1 1 1 -21 17 2  o 91.08360 8.088770 201.6754  177.7 -2.611801      16.17754 0.98 
1 1 1 -21 17 3  o 69.94089 8.879467 174.4602  173.2 25.79150       17.75893 0.97 
1 1 1 -21 17 4  o 44.53115 9.988822 83.65097  147.4 49.08794       19.97764 0.90 
1 1 1 -21 17 5  o 33.90408 10.27980 54.17904  229.3 14.57686       20.55961 0.77 
1 1 1 -21 17 6  o 111.7298 10.33210 239.6678  306.6 -15.02873      20.66419 0.99 
1 1 1 -21 17 7  o 79.87910 8.212394 148.6907  306.8 19.15617       16.42479 0.97 
1 1 1 -21 17 8  o 45.10397 10.92417 81.67639  178.5 -7.396152      21.84834 0.89 
1 1 1 -21 17 9  o 47.91386 10.46515 124.1886  132.4 -11.33386      20.93029 0.94 
1 1 1 -21 17 10 o 41.97335 12.75056 75.47549  32.5  7.685448       25.50112 0.86 
1 1 1 -21 17 11 o 62.21239 14.53489 145.3046  268.2 10.35259       29.06977 0.95 
1 1 1 -21 17 12 f 33.84747 9.863134 90.61422  201.1 ?              ?        0.00 
1 1 1 -21 17 13 o 36.65295 12.14550 92.65182  164.8 ?              ?        0.88 
1 1 1 -21 17 14 o 61.36727 13.68644 65.71675  78.1  ?              ?        0.89 
1 1 1 -20 0  1  o 141.2640 4.100231 925.6721  0.0   -0.000000      0.000000 0.91 
1 1 1 -20 0  2  o 124.1016 4.167193 142.0160  180.0 -0.000000      0.000000 0.16 
1 1 1 -20 0  3  o 277.1518 5.235209 342.0568  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  4  o 316.5147 5.765007 171.0843  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  5  o 435.9366 6.859220 736.5280  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  6  o 244.4133 4.990194 293.3636  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  7  o 101.9976 4.201140 90.62360  0.0   -0.000000      0.000000 0.49 
1 1 1 -20 0  8  o 53.80600 5.561611 390.1961  180.0 -0.000000      0.000000 0.18 
1 1 1 -20 0  9  o 480.2961 6.929201 853.8076  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  10 o 407.4727 5.961980 1223.439  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  11 o 327.3535 5.301399 104.7528  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  12 o 741.2136 9.339186 1068.813  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  13 f 701.2032 8.945855 1206.372  180.0 -0.000000      0.000000 0.00 
1 1 1 -20 0  14 o 275.6063 4.456173 584.8215  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  15 o 668.7152 8.662061 1153.077  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  16 o 97.83409 6.327253 62.60678  180.0 -0.000000      0.000000 0.55 
1 1 1 -20 0  17 o 304.6566 4.907598 512.7321  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  18 o 504.9683 6.854614 738.2474  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  19 o 276.5170 4.441463 329.7874  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  20 o 56.95173 7.549115 59.13308  180.0 -0.000000      0.000000 0.25 
1 1 1 -20 0  21 o 508.4163 6.562845 743.7112  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  22 o 154.7959 4.201358 75.06797  180.0 -0.000000      0.000000 0.70 
1 1 1 -20 0  23 o 184.3056 3.719330 349.4433  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  24 o 116.2201 4.684888 194.3589  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  25 o 119.7901 4.918462 115.8388  180.0 -0.000000      0.000000 0.96 
1 1 1 -20 0  26 o 241.6384 7.636202 391.3080  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  27 o 162.6952 5.205291 97.53762  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  28 o 52.09419 12.19236 9.275356  180.0 -0.000000      0.000000 0.13 
1 1 1 -20 0  29 o 97.16480 10.08049 117.2024  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  30 o 63.76357 12.90361 101.4397  0.0   -0.000000      0.000000 0.97 
1 1 1 -20 0  31 o 78.45529 10.13373 90.70190  0.0   -0.000000      0.000000 0.97 
1 1 1 -20 0  32 f 116.2140 9.617920 179.7613  0.0   -0.000000      0.000000 0.00 
1 1 1 -20 0  33 o 114.1050 9.561461 100.4777  180.0 -0.000000      0.000000 1.00 
1 1 1 -20 0  34 o 22.90570 15.54153 83.86308  0.0   -0.000000      0.000000 0.74 
1 1 1 -20 0  35 o 118.8895 8.388319 173.5914  0.0   -0.000000      0.000000 1.00 
1 1 1 -20 0  36 o 40.36084 20.62710 47.34673  0.0   -0.000000      0.000000 0.74 
1 1 1 -20 0  37 o 54.07456 19.71240 57.50046  0.0   ?              ?        0.94 
1 1 1 -20 2  1  o 145.5424 2.514106 549.8779  306.7 3.469574       5.028212 0.72 
1 1 1 -20 2  2  o 74.97943 2.955870 302.1940  49.0  -7.357498      5.911740 0.35 
1 1 1 -20 2  3  o 338.0974 3.712223 673.7385  213.3 60.23553       7.424446 0.95 
1 1 1 -20 2  4  o 287.1476 3.732358 676.8744  0.1   -20.57800      7.464716 0.95 
1 1 1 -20 2  5  o 315.2640 3.791938 659.9975  169.3 84.29523       7.583877 0.95 
1 1 1 -20 2  6  o 77.43343 4.513680 48.11839  133.4 73.76273       9.027360 0.63 
1 1 1 -20 2  7  o 463.0231 4.737217 758.2028  287.1 67.67911       9.474435 0.98 
1 1 1 -20 2  8  o 278.1455 3.249302 236.9995  231.6 4.204651       6.498605 0.95 
1 1 1 -20 2  9  o 777.3711 6.987003 1428.800  184.0 110.2714       13.97401 0.99 
1 1 1 -20 2  10 o 312.2911 3.444681 586.3139  232.0 -25.50540      6.889362 0.96 
1 1 1 -20 2  11 o 767.5733 6.784225 961.8016  355.2 19.32703       13.56845 0.99 
1 1 1 -20 2  12 o 299.1218 3.364509 599.4697  328.3 -7.700012      6.729018 0.95 
1 1 1 -20 2  13 o 624.8206 5.581713 901.2602  165.2 2.604248       11.16343 0.99 
1 1 1 -20 2  14 o 444.0662 4.327088 783.2777  305.0 50.35153       8.654177 0.98 
1 1 1 -20 2  15 o 676.0641 5.935833 820.7547  9.1   -49.82568      11.87167 0.99 
1 1 1 -20 2  16 o 533.5564 4.817178 897.0236  119.3 68.30496       9.634356 0.99 
1 1 1 -20 2  17 o 185.8972 3.320159 206.2785  338.9 5.033539       6.640318 0.85 
1 1 1 -20 2  18 o 357.1096 3.460873 441.0304  340.2 13.34552       6.921747 0.96 
1 1 1 -20 2  19 o 192.1808 3.574686 259.3143  257.3 41.91801       7.149372 0.88 
1 1 1 -20 2  20 o 69.94037 3.956046 97.99708  268.5 -2.661003      7.912091 0.35 
1 1 1 -20 2  21 o 84.26900 7.305507 243.3676  350.6 -46.35730      14.61101 0.83 
1 1 1 -20 2  22 o 91.35455 3.720371 110.8352  58.1  16.37263       7.440743 0.78 
1 1 1 -20 2  23 o 272.4922 3.497364 327.2840  167.3 -11.23950      6.994728 0.98 
1 1 1 -20 2  24 o 55.17479 5.874740 21.45407  210.2 -4.807194      11.74948 0.16 
1 1 1 -20 2  25 o 81.93604 4.580775 130.1956  331.1 -14.38177      9.161550 0.86 
1 1 1 -20 2  26 o 223.0745 3.708292 347.8577  39.7  28.49875       7.416584 0.99 
1 1 1 -20 2  27 o 142.5613 3.772318 190.4371  50.3  -5.713669      7.544637 0.96 
1 1 1 -20 2  28 o 165.3949 3.809624 251.8787  74.2  7.296875       7.619248 0.98 
1 1 1 -20 2  29 o 294.8029 4.198835 445.6523  110.1 -14.28391      8.397671 1.00 
1 1 1 -20 2  30 o 153.5372 5.271479 226.6378  93.5  -28.68028      10.54296 0.98 
1 1 1 -20 2  31 o 83.45656 7.379838 106.5797  339.8 -4.788925      14.75968 0.90 
1 1 1 -20 2  32 o 100.0921 6.698065 134.0173  343.3 -14.81673      13.39613 0.94 
1 1 1 -20 2  33 o 133.1722 6.170121 161.6847  192.2 1.825897       12.34024 0.97 
1 1 1 -20 2  34 o 139.6865 6.035287 147.6844  187.0 0.5563660      12.07057 0.98 
1 1 1 -20 2  35 o 73.88741 9.826887 120.1282  207.4 -17.03390      19.65377 0.95 
1 1 1 -20 2  36 o 54.24877 11.97447 65.14890  321.2 19.39915       23.94894 0.86 
1 1 1 -20 2  37 o 37.73058 11.65741 64.25570  97.2  ?              ?        0.82 
1 1 1 -20 4  1  o 276.9166 2.836446 242.9996  14.5  56.29892       5.672893 0.91 
1 1 1 -20 4  2  o 353.1479 3.638965 772.9120  300.5 -52.18677      7.277930 0.97 
1 1 1 -20 4  3  o 190.0110 3.348664 203.5768  181.7 -64.03139      6.697328 0.67 
1 1 1 -20 4  4  f 643.2681 5.428326 1366.622  73.2  61.64722       10.85665 0.00 
1 1 1 -20 4  5  o 908.6899 7.165977 1249.140  91.6  -0.5443726     14.33195 0.99 
1 1 1 -20 4  6  o 367.8456 3.809617 540.6137  47.9  38.38492       7.619235 0.96 
1 1 1 -20 4  7  o 848.1185 7.266079 1240.933  316.4 32.40344       14.53216 0.99 
1 1 1 -20 4  8  o 321.2737 3.302579 833.2092  22.0  75.97659       6.605159 0.96 
1 1 1 -20 4  9  o 458.2166 4.344194 883.4943  348.0 55.94437       8.688388 0.98 
1 1 1 -20 4  10 o 52.30142 7.444211 236.0460  17.5  -10.12390      14.88842 0.10 
1 1 1 -20 4  11 f 501.1451 4.584881 679.9250  204.0 -32.33832      9.169762 0.00 
1 1 1 -20 4  12 f 482.5255 4.529520 883.9545  236.4 -61.53470      9.059039 0.00 
1 1 1 -20 4  13 o 273.7415 3.637228 404.3648  151.6 -29.60809      7.274455 0.91 
1 1 1 -20 4  14 o 639.8053 7.220563 902.9357  312.2 -50.40289      14.44113 0.99 
1 1 1 -20 4  15 f 69.90851 3.831515 93.22083  76.2  -19.98283      7.663029 0.00 
1 1 1 -20 4  16 o 20.71991 6.079776 38.80803  194.2 -6.655914      12.15955 0.05 
1 1 1 -20 4  17 o 278.7157 3.157004 435.8710  298.8 -26.40161      6.314008 0.95 
1 1 1 -20 4  18 o 263.0572 3.080252 368.9632  52.9  0.4437866      6.160505 0.95 
1 1 1 -20 4  19 o 526.2040 4.835471 842.8149  326.4 26.13855       9.670941 0.99 
1 1 1 -20 4  20 o 188.0471 2.743340 301.4949  307.7 -20.31697      5.486680 0.95 
1 1 1 -20 4  21 o 387.6645 4.064023 615.5110  86.5  2.244110       8.128046 0.99 
1 1 1 -20 4  22 o 80.54079 6.980048 96.76936  47.6  17.78363       13.96010 0.74 
1 1 1 -20 4  23 o 262.3185 3.369861 366.9764  303.3 -21.17590      6.739722 0.98 
1 1 1 -20 4  24 o 221.8312 3.172240 305.2750  155.0 -20.50917      6.344479 0.98 
1 1 1 -20 4  25 o 52.84371 7.505914 167.2916  143.0 32.14156       15.01183 0.86 
1 1 1 -20 4  26 f 37.88795 9.143806 75.85984  167.4 10.12249       18.28761 0.00 
1 1 1 -20 4  27 o 40.39268 13.00527 89.45664  79.6  ?              ?        0.68 
1 1 1 -20 4  28 o 53.65038 7.721451 163.9042  108.4 -39.63285      15.44290 0.92 
1 1 1 -20 4  29 o 43.37305 8.431043 44.43095  358.4 29.75333       16.86209 0.54 
1 1 1 -20 4  30 o 83.82692 6.072229 63.50420  129.7 -4.770119      12.14446 0.82 
1 1 1 -20 4  31 o 145.7605 5.224490 179.0800  45.8  2.870026       10.44898 0.97 
1 1 1 -20 4  32 o 74.48251 7.147178 87.86783  358.1 6.820305       14.29436 0.90 
1 1 1 -20 4  33 o 135.6166 5.532356 174.1640  209.4 -17.48019      11.06471 0.98 
1 1 1 -20 4  34 o 97.75933 6.056078 131.6678  46.7  -13.87234      12.11216 0.97 
1 1 1 -20 4  35 o 46.71284 10.80376 81.54848  152.0 -27.71419      21.60753 0.88 
1 1 1 -20 4  36 o 67.59467 15.66547 92.04088  280.3 ?              ?        0.92 
1 1 1 -20 6  1  o 211.1535 2.751421 407.3714  67.6  -58.37260      5.502842 0.87 
1 1 1 -20 6  2  o 431.7729 3.953562 779.3358  244.7 20.15247       7.907125 0.98 
1 1 1 -20 6  3  o 544.1006 4.220201 721.6216  174.4 51.77881       8.440401 0.98 
1 1 1 -20 6  4  o 402.1324 3.313981 581.3588  152.1 64.05420       6.627963 0.97 
1 1 1 -20 6  5  o 365.3158 3.417201 457.6115  125.6 -15.78671      6.834403 0.97 
1 1 1 -20 6  6  o 417.0881 3.706393 570.3824  176.3 10.28796       7.412786 0.98 
1 1 1 -20 6  7  o 226.8552 2.966874 488.9038  93.4  14.58078       5.933748 0.94 
1 1 1 -20 6  8  o 259.7124 2.839891 63.80254  65.7  17.95561       5.679783 0.84 
1 1 1 -20 6  9  o 666.7203 5.349689 979.3381  83.4  2.463013       10.69938 0.99 
1 1 1 -20 6  10 o 488.6535 4.500097 825.8483  23.9  -45.52844      9.000194 0.98 
1 1 1 -20 6  11 o 632.6251 6.975892 1021.727  286.0 -22.40613      13.95178 0.99 
1 1 1 -20 6  12 o 160.9687 2.617510 111.8538  0.0   5.686737       5.235020 0.51 
1 1 1 -20 6  13 o 345.3803 3.486391 404.2068  32.6  15.19681       6.972783 0.96 
1 1 1 -20 6  14 o 134.5481 3.180258 182.5772  95.3  -36.50031      6.360515 0.68 
1 1 1 -20 6  15 o 179.9341 2.823785 330.9585  8.1   15.43343       5.647570 0.91 
1 1 1 -20 6  16 o 226.2126 3.068484 393.8215  299.3 11.25377       6.136967 0.95 
1 1 1 -20 6  17 o 128.5369 3.327181 97.98354  60.9  -26.77364      6.654362 0.72 
1 1 1 -20 6  18 o 279.0998 3.351719 490.3944  215.7 -40.41248      6.703438 0.98 
1 1 1 -20 6  19 o 290.1522 3.342688 406.7583  266.4 -8.442596      6.685376 0.98 
1 1 1 -20 6  20 o 132.0747 3.322412 215.8186  181.7 9.333672       6.644824 0.94 
1 1 1 -20 6  21 o 164.5180 3.020725 320.0686  99.8  -17.69357      6.041450 0.97 
1 1 1 -20 6  22 o 187.6244 3.364228 274.5742  314.8 22.11449       6.728457 0.97 
1 1 1 -20 6  23 o 159.5023 3.152421 276.3979  292.5 -12.87457      6.304843 0.97 
1 1 1 -20 6  24 o 157.2747 3.442410 229.5348  160.5 -5.383301      6.884820 0.97 
1 1 1 -20 6  25 o 114.3992 7.192825 229.3698  189.8 -4.972214      14.38565 0.96 
1 1 1 -20 6  26 o 103.2877 4.751120 163.4771  307.1 -3.100082      9.502239 0.96 
1 1 1 -20 6  27 f 163.9554 4.354962 175.2600  290.6 -21.87607      8.709925 0.00 
1 1 1 -20 6  28 o 157.4714 4.231500 238.5993  301.4 -1.133636      8.462999 0.98 
1 1 1 -20 6  29 o 170.4001 4.024549 288.1469  245.7 1.521667       8.049097 0.98 
1 1 1 -20 6  30 o 78.65814 7.071146 118.8734  46.2  7.863075       14.14229 0.92 
1 1 1 -20 6  31 o 124.6899 5.320683 168.2458  342.9 18.12225       10.64137 0.97 
1 1 1 -20 6  32 o 77.34525 12.91621 56.85747  107.8 -8.299995      25.83242 0.87 
1 1 1 -20 6  33 o 96.59088 11.51109 140.6660  33.1  -8.037292      23.02217 0.97 
1 1 1 -20 6  34 o 50.24061 11.79226 92.58412  7.2   -0.9382820     23.58453 0.90 
1 1 1 -20 6  35 o 63.15144 10.31999 82.49950  127.3 ?              ?        0.93 
1 1 1 -20 8  1  o 135.9449 2.599776 131.2911  235.5 62.06567       5.199552 0.53 
1 1 1 -20 8  2  o 294.5734 3.713897 337.2516  204.7 ?              ?        0.94 
1 1 1 -20 8  3  o 152.5858 2.575044 317.8787  194.4 -6.887939      5.150087 0.87 
1 1 1 -20 8  4  o 130.5788 3.269403 86.22422  224.9 36.60530       6.538807 0.34 
1 1 1 -20 8  5  o 186.7141 2.476918 223.5872  27.3  -26.00960      4.953836 0.85 
1 1 1 -20 8  6  o 423.4957 3.896928 490.0576  216.0 -11.77255      7.793856 0.97 
1 1 1 -20 8  7  o 222.2101 3.338611 317.8506  4.9   -9.588379      6.677221 0.91 
1 1 1 -20 8  8  o 385.7839 4.816156 491.4121  94.5  -24.93857      9.632313 0.97 
1 1 1 -20 8  9  o 403.7521 3.735348 593.4991  318.1 -28.34036      7.470695 0.98 
1 1 1 -20 8  10 o 182.3769 2.648595 373.3428  69.5  -3.233704      5.297190 0.93 
1 1 1 -20 8  11 o 291.0739 3.120230 383.1623  118.9 8.073700       6.240460 0.96 
1 1 1 -20 8  12 o 91.15137 3.700012 65.14270  112.9 24.14284       7.400024 0.29 
1 1 1 -20 8  13 o 88.89124 4.348846 176.0747  311.7 -36.67444      8.697692 0.79 
1 1 1 -20 8  14 o 297.2462 3.237566 485.4738  62.9  -10.34402      6.475131 0.98 
1 1 1 -20 8  15 o 174.3353 2.768478 374.7531  55.7  -15.24794      5.536956 0.97 
1 1 1 -20 8  16 o 248.4749 3.108631 400.6965  223.5 17.70172       6.217263 0.98 
1 1 1 -20 8  17 o 161.3838 2.981103 231.3439  218.2 21.38834       5.962206 0.96 
1 1 1 -20 8  18 f 215.6869 3.124595 341.3741  275.4 -65.32668      6.249190 0.00 
1 1 1 -20 8  19 o 45.35018 7.748938 202.8968  93.7  -15.24591      15.49788 0.82 
1 1 1 -20 8  20 o 73.27869 6.993896 149.1414  92.1  -49.89541      13.98779 0.88 
1 1 1 -20 8  21 o 224.0977 3.290725 322.7178  14.2  -38.61279      6.581450 0.99 
1 1 1 -20 8  22 o 93.60272 4.929427 124.1572  222.1 11.48881       9.858853 0.92 
1 1 1 -20 8  23 o 135.1503 4.036540 225.9456  60.5  -7.114136      8.073080 0.97 
1 1 1 -20 8  24 o 146.4413 4.076559 193.3943  73.4  -21.25699      8.153118 0.98 
1 1 1 -20 8  25 o 262.3564 3.902982 405.1909  347.1 -17.57025      7.805965 0.99 
1 1 1 -20 8  26 f 92.74744 5.323802 202.3647  239.4 15.46619       10.64760 0.00 
1 1 1 -20 8  27 o 116.5297 4.797231 186.6292  211.6 15.21175       9.594462 0.96 
1 1 1 -20 8  28 o 124.0129 4.461029 233.5715  343.1 -11.57430      8.922058 0.98 
1 1 1 -20 8  29 o 111.5736 5.165446 179.6331  292.7 6.205963       10.33089 0.97 
1 1 1 -20 8  30 o 124.0714 5.582727 215.2004  228.6 -11.72636      11.16545 0.98 
1 1 1 -20 8  31 f 105.0278 12.15190 163.2809  33.6  29.46593       24.30379 0.00 
1 1 1 -20 8  32 o 31.42389 10.99553 80.51846  175.8 -18.83296      21.99106 0.81 
1 1 1 -20 8  33 o 82.80888 8.203814 140.9899  248.2 6.173218       16.40763 0.97 
1 1 1 -20 10 1  o 276.6728 3.385439 596.6401  261.7 23.02148       6.770878 0.99 
1 1 1 -20 10 2  o 197.0563 2.845450 439.4892  32.8  1.678024       5.690900 0.98 
1 1 1 -20 10 3  o 271.7184 3.080774 290.5071  92.4  24.74316       6.161548 0.97 
1 1 1 -20 10 4  o 144.2321 2.840619 278.5771  279.1 30.81731       5.681238 0.95 
1 1 1 -20 10 5  o 142.3633 3.766644 273.7006  76.4  -11.90170      7.533288 0.95 
1 1 1 -20 10 6  o 190.2589 2.723868 303.1819  111.5 25.20589       5.447736 0.97 
1 1 1 -20 10 7  o 321.7064 3.327116 466.0790  201.5 -36.62338      6.654233 0.99 
1 1 1 -20 10 8  o 307.2895 4.125846 491.7737  231.5 -27.07202      8.251693 0.99 
1 1 1 -20 10 9  o 30.92344 7.429970 114.2049  71.9  -15.47497      14.85994 0.48 
1 1 1 -20 10 10 o 84.26440 5.254582 68.33313  73.8  19.71748       10.50916 0.70 
1 1 1 -20 10 11 f 195.6550 3.968917 338.1798  183.4 -50.03000      7.937834 0.00 
1 1 1 -20 10 12 o 302.8007 4.267494 484.0256  188.3 -13.70361      8.534988 0.99 
1 1 1 -20 10 13 o 126.5458 4.344478 95.39656  183.8 4.465630       8.688956 0.86 
1 1 1 -20 10 14 o 177.1011 2.876835 288.9076  214.0 -44.01776      5.753669 0.97 
1 1 1 -20 10 15 o 139.1750 2.951410 250.7956  267.2 -35.03117      5.902820 0.97 
1 1 1 -20 10 16 o 71.46870 4.715133 137.8406  184.2 -5.417404      9.430265 0.89 
1 1 1 -20 10 17 o 74.98133 5.028221 121.7337  145.4 -13.61423      10.05644 0.89 
1 1 1 -20 10 18 f 54.99268 6.200666 150.2522  234.0 18.75932       12.40133 0.00 
1 1 1 -20 10 19 o 96.70277 4.686999 191.1419  334.8 -7.330673      9.373998 0.96 
1 1 1 -20 10 20 o 92.56649 4.687139 115.0976  83.5  23.04893       9.374277 0.93 
1 1 1 -20 10 21 o 156.7728 4.125210 290.9438  131.8 -34.06290      8.250420 0.99 
1 1 1 -20 10 22 o 58.52536 8.695050 111.9328  150.5 -27.28162      17.39010 0.90 
1 1 1 -20 10 23 o 156.0712 4.709057 260.3415  188.8 -16.28835      9.418115 0.98 
1 1 1 -20 10 24 o 87.16577 7.094304 96.79150  239.3 12.80684       14.18861 0.91 
1 1 1 -20 10 25 o 104.8836 6.308364 134.9189  316.4 -1.444321      12.61673 0.95 
1 1 1 -20 10 26 o 119.6882 6.248949 181.7149  155.1 -28.40964      12.49790 0.97 
1 1 1 -20 10 27 o 110.6149 6.496633 171.2245  68.6  -5.712372      12.99327 0.98 
1 1 1 -20 10 28 o 131.0770 8.548077 238.0072  33.5  -27.88689      17.09615 0.99 
1 1 1 -20 10 29 o 56.52527 14.92350 114.3176  324.9 -17.18375      29.84700 0.92 
1 1 1 -20 10 30 o 32.02995 9.922614 14.96167  53.6  -0.1752644     19.84523 0.30 
1 1 1 -20 10 31 o 48.81956 11.88183 64.31523  136.6 ?              ?        0.87 
1 1 1 -20 12 1  o 188.2614 3.581034 323.7617  312.0 19.17703       7.162067 0.98 
1 1 1 -20 12 2  o 113.4036 4.544233 196.2005  91.7  -14.71626      9.088467 0.95 
1 1 1 -20 12 3  o 201.6536 2.848308 398.1483  111.4 -24.19933      5.696617 0.99 
1 1 1 -20 12 4  o 107.3769 3.921257 225.2273  153.1 -3.702026      7.842515 0.96 
1 1 1 -20 12 5  o 43.62538 7.464840 22.26313  337.0 -22.21287      14.92968 0.23 
1 1 1 -20 12 6  o 144.9376 3.438297 241.7668  157.2 -5.715576      6.876593 0.97 
1 1 1 -20 12 7  o 282.2165 3.315729 446.7831  188.8 25.14624       6.631459 0.99 
1 1 1 -20 12 8  o 262.4494 5.083512 382.6733  198.4 ?              ?        0.99 
1 1 1 -20 12 9  o 265.5013 4.370654 413.9488  249.5 5.438232       8.741308 0.99 
1 1 1 -20 12 10 o 214.0386 4.734505 372.5398  12.3  -20.06441      9.469010 0.99 
1 1 1 -20 12 11 o 173.3547 4.584669 313.4352  21.0  -15.24353      9.169338 0.98 
1 1 1 -20 12 12 o 144.1581 3.763647 220.7135  252.2 ?              ?        0.98 
1 1 1 -20 12 13 o 122.5804 5.105348 224.0634  158.4 31.68314       10.21070 0.97 
1 1 1 -20 12 14 o 87.12826 9.225645 133.0947  45.2  -9.177124      18.45129 0.93 
1 1 1 -20 12 15 o 42.42027 10.22213 122.9639  287.9 15.24177       20.44425 0.86 
1 1 1 -20 12 16 o 187.9639 4.997500 299.0164  248.0 -12.57066      9.995001 0.99 
1 1 1 -20 12 17 o 183.8435 5.119609 390.9778  223.0 -30.65884      10.23922 0.99 
1 1 1 -20 12 18 o 140.5157 5.723716 207.5625  239.4 -6.065018      11.44743 0.98 
1 1 1 -20 12 19 o 38.68125 11.44908 74.07695  105.1 40.04872       22.89817 0.65 
1 1 1 -20 12 20 o 61.61636 12.00962 98.54572  207.6 -22.22470      24.01923 0.86 
1 1 1 -20 12 21 o 147.7133 8.272819 257.2564  291.0 -10.41647      16.54564 0.98 
1 1 1 -20 12 22 o 41.08432 12.42875 73.35825  291.5 18.74273       24.85750 0.74 
1 1 1 -20 12 23 o 52.63330 13.30639 60.19131  38.7  -4.404716      26.61277 0.79 
1 1 1 -20 12 24 o 119.1350 4.620969 204.2322  33.2  -2.867760      9.241938 0.98 
1 1 1 -20 12 25 o 139.6915 4.618358 201.3953  84.2  -0.6935272     9.236715 0.99 
1 1 1 -20 12 26 f 40.39699 11.95990 90.75471  245.4 -0.7283669     23.91981 0.00 
1 1 1 -20 12 27 o 60.81361 17.02770 138.3428  326.2 ?              ?        0.93 
1 1 1 -20 12 28 o 33.64936 11.56726 69.07166  307.6 ?              ?        0.82 
1 1 1 -20 14 1  o 69.50571 6.674092 100.7387  253.6 -2.498894      13.34818 0.91 
1 1 1 -20 14 2  o 113.5523 4.695167 172.1776  278.4 -11.58077      9.390334 0.97 
1 1 1 -20 14 3  o 157.3771 4.206988 223.7077  252.6 -21.03661      8.413977 0.98 
1 1 1 -20 14 4  o 251.2343 3.535954 465.7512  337.4 -10.50316      7.071908 1.00 
1 1 1 -20 14 5  o 294.7465 3.583409 474.3642  351.4 16.77771       7.166818 1.00 
1 1 1 -20 14 6  o 291.7434 3.816606 517.8403  358.4 14.95398       7.633211 1.00 
1 1 1 -20 14 7  o 43.62899 8.997326 90.48711  66.0  -5.285526      17.99465 0.82 
1 1 1 -20 14 8  o 117.6636 4.509623 225.5514  175.2 9.303215       9.019246 0.98 
1 1 1 -20 14 9  o 91.72913 5.695524 160.0046  114.4 10.82644       11.39105 0.96 
1 1 1 -20 14 10 o 130.4446 6.543076 250.2992  30.0  9.482391       13.08615 0.98 
1 1 1 -20 14 11 o 97.07635 7.998329 94.63917  20.8  1.648010       15.99666 0.92 
1 1 1 -20 14 12 o 66.60054 10.66252 136.8292  160.6 -18.63003      21.32504 0.91 
1 1 1 -20 14 13 o 65.75034 11.42909 102.5940  183.3 7.401516       22.85819 0.88 
1 1 1 -20 14 14 o 78.45923 11.69072 199.3238  106.2 -12.71090      23.38144 0.95 
1 1 1 -20 14 15 o 51.73458 11.56006 43.20565  203.4 15.00098       23.12012 0.64 
1 1 1 -20 14 16 o 125.1801 11.00826 258.5555  301.7 -58.38799      22.01653 0.98 
1 1 1 -20 14 17 o 73.81537 13.57830 71.88303  248.2 31.47694       27.15660 0.88 
1 1 1 -20 14 18 o 90.33040 12.08580 144.5793  338.5 -19.98588      24.17159 0.96 
1 1 1 -20 14 19 o 100.2385 9.849327 153.7400  265.3 ?              ?        0.97 
1 1 1 -20 14 20 o 41.67704 13.35668 84.12614  170.6 26.53828       26.71337 0.86 
1 1 1 -20 14 21 o 40.98100 13.27613 61.78437  100.7 7.358395       26.55227 0.80 
1 1 1 -20 14 22 o 57.93743 14.27370 50.24189  310.8 -6.290657      28.54740 0.81 
1 1 1 -20 14 23 o 38.99522 12.30120 50.36377  230.7 0.9581718      24.60239 0.76 
1 1 1 -20 14 24 o 42.51641 19.99488 86.69991  176.1 ?              ?        0.80 
1 1 1 -20 16 1  o 42.00820 10.61803 71.87955  299.9 6.169399       21.23606 0.83 
1 1 1 -20 16 2  o 49.37428 9.652892 39.79355  345.5 -15.29581      19.30578 0.74 
1 1 1 -20 16 3  o 59.89943 9.388828 100.6412  280.1 31.71873       18.77766 0.92 
1 1 1 -20 16 4  o 98.74101 5.901405 113.5500  289.4 27.76897       11.80281 0.97 
1 1 1 -20 16 5  o 75.54143 11.68691 173.7665  133.6 -9.070007      23.37382 0.96 
1 1 1 -20 16 6  o 53.44915 10.48956 56.18215  214.2 5.081863       20.97911 0.83 
1 1 1 -20 16 7  o 95.53859 6.517383 169.1405  242.0 17.29784       13.03477 0.98 
1 1 1 -20 16 8  o 43.68055 10.35915 71.74211  343.2 15.48630       20.71829 0.85 
1 1 1 -20 16 9  o 59.01598 10.13895 151.1603  43.7  7.439751       20.27790 0.95 
1 1 1 -20 16 10 o 103.5294 10.18334 138.6734  111.5 27.02368       20.36667 0.97 
1 1 1 -20 16 11 o 47.32373 12.95761 10.29600  115.5 6.841438       25.91522 0.27 
1 1 1 -20 16 12 o 127.6909 8.246580 228.0535  357.0 42.67081       16.49316 0.99 
1 1 1 -20 16 13 o 56.11419 12.07660 104.3853  342.5 58.79223       24.15321 0.93 
1 1 1 -20 16 14 o 49.56608 13.28282 108.5005  246.2 14.41511       26.56565 0.91 
1 1 1 -20 16 15 f 67.47513 11.53511 172.3643  172.4 -29.15167      23.07022 0.00 
1 1 1 -20 16 16 o 42.33296 12.45832 96.21738  43.1  -0.7653542     24.91664 0.89 
1 1 1 -20 16 17 o 84.17481 13.42501 273.2221  334.9 -49.09372      26.85001 0.98 
1 1 1 -20 16 18 o 90.02075 14.23882 167.6718  324.0 ?              ?        0.97 
1 1 1 -20 16 19 x ?        ?        46.73683  253.2 ?              ?        0.00 
1 1 1 -20 18 1  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -20 18 2  x ?        ?        77.56644  280.9 ?              ?        0.00 
1 1 1 -20 18 3  x ?        ?        95.60281  145.1 ?              ?        0.00 
1 1 1 -20 18 4  x ?        ?        109.1911  118.1 ?              ?        0.00 
1 1 1 -20 18 5  x ?        ?        65.26398  42.5  ?              ?        0.00 
1 1 1 -20 18 6  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -19 1  1  o 177.1776 2.854377 370.7494  356.4 -20.99368      5.708754 0.87 
1 1 1 -19 1  2  o 282.7435 3.635988 432.2009  109.6 -12.93750      7.271976 0.96 
1 1 1 -19 1  3  o 287.2073 3.801363 221.3341  40.2  -9.756958      7.602727 0.89 
1 1 1 -19 1  4  o 407.3912 4.584959 834.5386  322.7 -10.71497      9.169918 0.97 
1 1 1 -19 1  5  o 270.5555 3.661457 503.3919  165.0 -7.292786      7.322915 0.93 
1 1 1 -19 1  6  o 528.9838 5.332816 547.9021  353.9 -72.64374      10.66563 0.98 
1 1 1 -19 1  7  f 185.7775 3.061008 412.2722  18.6  -17.68279      6.122016 0.00 
1 1 1 -19 1  8  o 293.9263 3.455940 363.1087  344.2 2.712097       6.911881 0.95 
1 1 1 -19 1  9  o 502.8037 4.928174 528.3704  71.8  8.446716       9.856349 0.99 
1 1 1 -19 1  10 o 532.1074 5.136656 349.9679  184.4 -0.2376709     10.27331 0.98 
1 1 1 -19 1  11 o 327.2788 3.435257 582.8333  307.0 -38.38934      6.870514 0.95 
1 1 1 -19 1  12 o 329.5077 3.567873 296.2032  304.6 -56.58176      7.135746 0.93 
1 1 1 -19 1  13 o 189.2601 2.461876 287.0982  292.1 -10.38608      4.923752 0.90 
1 1 1 -19 1  14 o 920.6017 7.748679 1470.414  188.3 42.37347       15.49736 0.99 
1 1 1 -19 1  15 o 305.1898 3.876341 393.4459  93.0  10.72168       7.752682 0.94 
1 1 1 -19 1  16 o 762.0707 6.677323 1143.851  91.7  50.68298       13.35465 0.99 
1 1 1 -19 1  17 o 142.9770 2.688542 216.5892  296.2 -32.65120      5.377084 0.71 
1 1 1 -19 1  18 o 104.4471 4.146477 210.5663  227.2 38.76945       8.292953 0.62 
1 1 1 -19 1  19 o 193.3796 2.700065 284.8597  262.4 -20.32077      5.400130 0.90 
1 1 1 -19 1  20 o 273.4525 3.121020 463.8102  108.9 -38.58813      6.242040 0.96 
1 1 1 -19 1  21 o 368.3731 4.576086 561.4358  86.0  -9.212555      9.152172 0.98 
1 1 1 -19 1  22 o 79.86554 3.970734 78.95486  12.7  14.60177       7.941468 0.56 
1 1 1 -19 1  23 o 111.2296 3.452011 184.0226  131.0 10.62039       6.904022 0.91 
1 1 1 -19 1  24 o 125.7072 3.692809 170.9082  87.5  -19.28783      7.385617 0.92 
1 1 1 -19 1  25 o 198.6375 3.178030 311.4610  64.8  -22.46768      6.356061 0.97 
1 1 1 -19 1  26 o 185.5880 3.423114 277.9479  111.0 -37.03188      6.846228 0.98 
1 1 1 -19 1  27 o 53.40342 8.386006 65.40247  295.4 7.449673       16.77201 0.64 
1 1 1 -19 1  28 o 139.0883 4.212517 220.8483  53.0  -2.255692      8.425034 0.97 
1 1 1 -19 1  29 o 327.1694 5.148008 456.5363  32.9  27.07281       10.29602 1.00 
1 1 1 -19 1  30 o 143.9116 4.369253 207.0285  85.4  -29.21494      8.738506 0.98 
1 1 1 -19 1  31 o 90.37215 6.647493 119.6536  62.6  -2.731476      13.29499 0.92 
1 1 1 -19 1  32 o 128.2354 6.971162 179.8400  22.2  9.040535       13.94232 0.97 
1 1 1 -19 1  33 o 154.8402 5.960268 194.8793  224.4 -0.1307220     11.92054 0.98 
1 1 1 -19 1  34 o 102.4437 8.236174 101.0454  264.1 5.585747       16.47235 0.95 
1 1 1 -19 1  35 o 30.13859 9.840893 13.87120  128.5 -8.126137      19.68179 0.24 
1 1 1 -19 1  36 o 58.81413 12.00324 83.35853  15.9  0.5450554      24.00648 0.90 
1 1 1 -19 1  37 o 30.81223 10.05881 12.35039  109.1 ?              ?        0.26 
1 1 1 -19 3  1  o 87.54442 2.299169 852.1523  163.5 5.992271       4.598337 0.80 
1 1 1 -19 3  2  o 229.0211 2.763610 569.2455  153.2 -15.50832      5.527221 0.91 
1 1 1 -19 3  3  o 247.4672 2.902781 80.77994  205.3 -76.52066      5.805563 0.93 
1 1 1 -19 3  4  o 167.3597 2.398983 115.3330  265.6 50.07988       4.797967 0.80 
1 1 1 -19 3  5  o 63.79648 3.337891 526.5588  144.8 -11.96883      6.675782 0.50 
1 1 1 -19 3  6  o 242.1570 3.026051 270.3067  17.0  5.434677       6.052102 0.89 
1 1 1 -19 3  7  o 179.2949 2.796955 281.0684  233.4 -82.33702      5.593911 0.67 
1 1 1 -19 3  8  o 216.1818 2.820666 222.6824  8.4   -47.26125      5.641333 0.86 
1 1 1 -19 3  9  o 333.6290 3.580339 425.1666  311.1 79.67902       7.160679 0.95 
1 1 1 -19 3  10 o 115.9218 2.694039 246.3287  247.7 -35.13533      5.388078 0.73 
1 1 1 -19 3  11 o 858.4381 7.292960 1294.635  103.8 82.40778       14.58592 0.99 
1 1 1 -19 3  12 f 77.75594 3.323868 194.7343  210.7 -6.062622      6.647736 0.00 
1 1 1 -19 3  13 o 428.7537 4.137820 744.6965  308.2 9.809784       8.275640 0.98 
1 1 1 -19 3  14 o 627.9224 5.619310 902.4083  298.7 -29.55713      11.23862 0.99 
1 1 1 -19 3  15 o 278.0648 2.995339 419.4529  350.4 24.38232       5.990677 0.94 
1 1 1 -19 3  16 o 483.0386 4.511373 636.2128  54.9  -31.46631      9.022746 0.98 
1 1 1 -19 3  17 o 704.3617 6.007592 1171.338  322.9 -63.84924      12.01518 0.99 
1 1 1 -19 3  18 o 287.0299 3.848697 339.8787  194.4 3.974365       7.697395 0.93 
1 1 1 -19 3  19 o 197.7208 2.757188 270.3631  163.6 -57.81801      5.514377 0.90 
1 1 1 -19 3  20 o 74.21279 4.237417 165.4000  302.2 7.445572       8.474834 0.62 
1 1 1 -19 3  21 o 173.4911 2.854303 264.9764  326.1 -41.07236      5.708606 0.94 
1 1 1 -19 3  22 o 316.5844 4.029607 498.6289  135.5 -5.488953      8.059215 0.99 
1 1 1 -19 3  23 o 150.3570 2.861383 201.5934  196.5 -42.06396      5.722765 0.94 
1 1 1 -19 3  24 f 74.98540 5.472241 27.32397  262.4 0.7997589      10.94448 0.00 
1 1 1 -19 3  25 o 75.58453 5.045160 144.2829  359.3 19.22421       10.09032 0.87 
1 1 1 -19 3  26 o 121.3371 4.512540 164.1763  81.5  8.053932       9.025080 0.95 
1 1 1 -19 3  27 o 82.74542 5.095269 125.2453  123.5 7.651741       10.19054 0.91 
1 1 1 -19 3  28 o 93.41940 6.093423 144.8149  106.8 11.91289       12.18685 0.94 
1 1 1 -19 3  29 f 148.5074 4.635403 209.7986  87.3  16.56187       9.270806 0.00 
1 1 1 -19 3  30 f 129.7124 5.040268 106.2027  130.2 -7.958382      10.08054 0.00 
1 1 1 -19 3  31 o 179.7345 4.965912 271.3505  62.4  -9.027252      9.931825 0.98 
1 1 1 -19 3  32 o 94.03860 9.040988 127.8878  143.3 -17.07668      18.08198 0.94 
1 1 1 -19 3  33 o 88.52454 8.853477 86.82121  244.8 -40.62370      17.70695 0.93 
1 1 1 -19 3  34 o 59.34861 9.826011 109.2716  326.2 -55.45048      19.65202 0.93 
1 1 1 -19 3  35 o 52.45916 9.861414 65.44602  188.5 -34.84723      19.72283 0.86 
1 1 1 -19 3  36 o 39.01086 11.72347 11.24115  61.0  2.971104       23.44695 0.25 
1 1 1 -19 5  1  o 683.7508 5.095756 1017.650  300.9 28.63062       10.19151 0.99 
1 1 1 -19 5  2  o 1054.760 7.362860 1423.790  5.1   -38.46362      14.72572 0.99 
1 1 1 -19 5  3  o 179.6620 2.468114 342.2189  245.4 36.83224       4.936228 0.74 
1 1 1 -19 5  4  o 266.0543 2.671944 321.3182  153.2 -14.03848      5.343887 0.93 
1 1 1 -19 5  5  o 295.0214 2.895308 429.4919  39.0  -11.04022      5.790616 0.93 
1 1 1 -19 5  6  o 517.9855 4.495576 512.3315  17.5  -14.20755      8.991152 0.98 
1 1 1 -19 5  7  o 1104.090 8.428668 1882.336  339.7 13.77844       16.85734 1.00 
1 1 1 -19 5  8  o 366.2659 3.623660 549.9211  341.1 23.69342       7.247319 0.96 
1 1 1 -19 5  9  o 500.5573 5.857983 863.5279  19.9  54.59338       11.71597 0.98 
1 1 1 -19 5  10 o 110.7510 2.890228 312.7130  92.2  48.65576       5.780457 0.71 
1 1 1 -19 5  11 o 398.0571 3.878965 477.2399  174.7 0.2429199      7.757930 0.96 
1 1 1 -19 5  12 o 261.2165 3.083829 440.2675  308.8 -26.34689      6.167658 0.95 
1 1 1 -19 5  13 o 480.6152 6.022961 707.9662  62.3  54.51880       12.04592 0.98 
1 1 1 -19 5  14 o 497.0703 4.467084 957.8672  30.9  -25.70404      8.934169 0.99 
1 1 1 -19 5  15 o 431.8129 4.176129 702.2980  131.9 -15.06760      8.352259 0.98 
1 1 1 -19 5  16 o 411.3796 3.916540 558.8482  128.8 21.47598       7.833079 0.98 
1 1 1 -19 5  17 o 270.0320 3.164199 354.2936  175.8 24.00342       6.328398 0.95 
1 1 1 -19 5  18 o 74.29996 4.233123 92.28909  221.0 18.04268       8.466247 0.48 
1 1 1 -19 5  19 o 232.1428 2.971494 307.9425  303.6 -32.72810      5.942988 0.96 
1 1 1 -19 5  20 o 75.21004 4.059700 54.00360  156.2 -2.842667      8.119399 0.45 
1 1 1 -19 5  21 o 256.6617 3.137707 445.0305  90.1  -9.133514      6.275413 0.99 
1 1 1 -19 5  22 o 87.82159 3.904464 181.0373  194.7 4.095978       7.808928 0.89 
1 1 1 -19 5  23 o 111.3900 3.728444 167.1243  223.1 -43.43889      7.456888 0.92 
1 1 1 -19 5  24 o 130.3169 3.317001 218.5351  234.2 6.379890       6.634002 0.96 
1 1 1 -19 5  25 o 80.74640 4.453139 158.9276  311.1 -0.7864532     8.906278 0.92 
1 1 1 -19 5  26 o 124.1604 3.796650 211.5245  294.6 -13.02358      7.593300 0.97 
1 1 1 -19 5  27 o 184.4767 4.203823 332.3701  229.8 2.101059       8.407646 0.99 
1 1 1 -19 5  28 o 68.41343 8.078259 49.59727  341.6 44.62018       16.15652 0.77 
1 1 1 -19 5  29 o 134.3639 4.705016 178.6494  289.7 -14.44405      9.410032 0.96 
1 1 1 -19 5  30 o 109.1950 5.105337 184.7189  298.3 -21.68822      10.21067 0.96 
1 1 1 -19 5  31 o 71.86542 7.687786 79.79472  3.6   21.76212       15.37557 0.87 
1 1 1 -19 5  32 o 69.80431 8.536800 93.40147  141.4 -14.91230      17.07360 0.92 
1 1 1 -19 5  33 o 54.69227 10.13490 96.19962  271.6 32.67287       20.26980 0.91 
1 1 1 -19 5  34 o 121.0041 5.673394 147.4327  78.6  -43.26611      11.34679 0.98 
1 1 1 -19 5  35 o 116.0766 7.436740 166.5755  112.5 8.472862       14.87348 0.98 
1 1 1 -19 5  36 x ?        ?        84.14477  47.8  ?              ?        0.00 
1 1 1 -19 7  1  o 274.3670 3.086178 396.8344  72.7  -10.84027      6.172355 0.94 
1 1 1 -19 7  2  o 434.5150 3.909792 915.0352  178.0 -9.707275      7.819584 0.98 
1 1 1 -19 7  3  o 165.4958 3.278394 152.6934  48.3  ?              ?        0.78 
1 1 1 -19 7  4  o 469.3129 3.953306 657.3531  5.5   -12.03098      7.906612 0.98 
1 1 1 -19 7  5  o 138.1988 2.352758 169.4864  224.9 -2.836044      4.705516 0.81 
1 1 1 -19 7  6  o 116.5499 2.889205 258.9301  335.0 -13.65654      5.778409 0.75 
1 1 1 -19 7  7  o 166.6113 2.443026 391.4978  55.7  2.981293       4.886053 0.91 
1 1 1 -19 7  8  o 209.4130 2.562601 578.6102  74.6  14.76163       5.125202 0.95 
1 1 1 -19 7  9  o 250.7017 2.814727 304.2796  186.4 14.70110       5.629454 0.92 
1 1 1 -19 7  10 o 119.7772 3.460578 179.0014  171.1 37.66661       6.921155 0.60 
1 1 1 -19 7  11 o 530.4231 4.857097 742.2489  276.2 22.04358       9.714194 0.99 
1 1 1 -19 7  12 o 573.4719 5.209856 929.2189  137.0 11.86597       10.41971 0.99 
1 1 1 -19 7  13 o 112.0424 3.090976 193.3670  172.8 50.44653       6.181953 0.75 
1 1 1 -19 7  14 o 114.0580 2.995584 239.0490  193.7 24.66807       5.991167 0.83 
1 1 1 -19 7  15 o 247.2980 2.942549 343.2262  261.9 40.11482       5.885098 0.96 
1 1 1 -19 7  16 o 111.7168 3.218447 203.7963  306.5 38.33159       6.436894 0.85 
1 1 1 -19 7  17 o 108.7505 4.136386 230.6169  38.3  -67.92770      8.272772 0.90 
1 1 1 -19 7  18 o 61.06339 6.511605 161.0572  84.0  -22.09088      13.02321 0.82 
1 1 1 -19 7  19 o 163.5856 3.042879 273.5315  76.8  2.895096       6.085759 0.96 
1 1 1 -19 7  20 o 164.3997 3.304034 215.0809  156.6 40.96545       6.608069 0.96 
1 1 1 -19 7  21 o 54.49149 7.669849 137.2292  184.2 -17.86581      15.33970 0.78 
1 1 1 -19 7  22 o 117.9670 3.814856 188.4023  186.8 5.400940       7.629711 0.95 
1 1 1 -19 7  23 o 167.2577 3.687652 289.7015  339.1 2.154312       7.375304 0.98 
1 1 1 -19 7  24 o 116.9319 3.962218 151.9141  164.8 38.83227       7.924436 0.95 
1 1 1 -19 7  25 o 115.0461 4.290782 116.4021  43.6  -4.036209      8.581564 0.95 
1 1 1 -19 7  26 f 95.93105 5.264641 105.6704  358.7 -22.47500      10.52928 0.00 
1 1 1 -19 7  27 o 40.60506 13.86190 112.6142  100.1 ?              ?        0.77 
1 1 1 -19 7  28 o 32.35759 9.430824 95.95848  28.7  13.01012       18.86165 0.68 
1 1 1 -19 7  29 o 40.45148 9.833726 20.92762  194.0 5.421818       19.66745 0.28 
1 1 1 -19 7  30 o 34.89044 9.907322 15.09046  18.9  -5.943375      19.81464 0.22 
1 1 1 -19 7  31 o 125.0858 9.390307 168.7682  10.9  -4.275566      18.78061 0.98 
1 1 1 -19 7  32 o 100.1386 6.578894 140.7369  143.8 -1.313080      13.15779 0.97 
1 1 1 -19 7  33 o 36.20870 10.36668 53.73070  75.5  7.277950       20.73336 0.75 
1 1 1 -19 7  34 o 52.41437 11.43877 119.0036  337.2 ?              ?        0.94 
1 1 1 -19 9  1  o 218.7675 2.667908 395.8077  263.3 35.02788       5.335816 0.95 
1 1 1 -19 9  2  o 450.1263 4.159967 776.5827  119.0 74.18088       8.319934 0.99 
1 1 1 -19 9  3  o 349.2972 3.637820 692.2568  218.5 -12.77475      7.275641 0.98 
1 1 1 -19 9  4  o 232.9633 2.827996 368.4193  227.8 -13.28094      5.655993 0.95 
1 1 1 -19 9  5  o 332.5692 3.596580 543.3369  279.7 9.249908       7.193159 0.98 
1 1 1 -19 9  6  o 160.2832 2.766387 386.4337  336.5 -21.16168      5.532773 0.93 
1 1 1 -19 9  7  o 176.3956 3.649307 194.3550  234.7 0.6122742      7.298614 0.88 
1 1 1 -19 9  8  o 375.7673 4.112841 742.6188  280.3 -74.42526      8.225681 0.99 
1 1 1 -19 9  9  o 452.8720 4.750853 867.6290  331.7 -26.48309      9.501705 0.99 
1 1 1 -19 9  10 o 45.39067 7.736178 67.07917  355.7 44.56495       15.47236 0.27 
1 1 1 -19 9  11 o 159.2563 2.771665 267.9936  181.8 -24.60484      5.543330 0.94 
1 1 1 -19 9  12 o 145.1021 2.755585 288.1030  32.2  7.651718       5.511171 0.95 
1 1 1 -19 9  13 o 188.8006 2.797946 229.0605  349.8 -2.001511      5.595891 0.96 
1 1 1 -19 9  14 o 24.61981 7.222512 145.2635  12.0  9.519760       14.44502 0.49 
1 1 1 -19 9  15 o 96.80476 3.480448 101.7858  233.8 -18.65244      6.960896 0.84 
1 1 1 -19 9  16 o 90.55339 4.034386 169.2819  198.9 -18.56178      8.068771 0.90 
1 1 1 -19 9  17 o 250.7414 3.169551 476.1414  40.5  -21.61496      6.339101 0.99 
1 1 1 -19 9  18 o 182.0013 2.947455 352.6236  14.6  -11.64954      5.894911 0.98 
1 1 1 -19 9  19 o 46.86115 8.278027 64.13513  229.3 12.90195       16.55605 0.60 
1 1 1 -19 9  20 o 84.37944 5.698348 88.11421  54.5  3.921532       11.39670 0.87 
1 1 1 -19 9  21 o 48.12680 8.565904 81.78647  169.5 -18.06013      17.13181 0.73 
1 1 1 -19 9  22 o 89.78190 5.663836 177.8804  229.8 -20.79688      11.32767 0.95 
1 1 1 -19 9  23 o 61.60248 8.955684 124.1888  159.1 -8.203163      17.91137 0.92 
1 1 1 -19 9  24 o 163.8304 4.246171 275.9662  68.8  -7.983109      8.492342 0.99 
1 1 1 -19 9  25 o 77.48172 7.473001 119.6863  5.3   -0.8224869     14.94600 0.91 
1 1 1 -19 9  26 o 109.9303 5.834426 231.9974  241.1 -8.854233      11.66885 0.97 
1 1 1 -19 9  27 o 62.68575 11.73729 104.7801  139.6 -55.68549      23.47458 0.88 
1 1 1 -19 9  28 o 134.5792 5.798495 251.2287  72.4  -26.58624      11.59699 0.99 
1 1 1 -19 9  29 o 40.68869 11.09168 39.86334  1.2   0.8932152      22.18336 0.65 
1 1 1 -19 9  30 o 28.93271 9.362841 82.29479  10.6  5.673603       18.72568 0.81 
1 1 1 -19 9  31 o 56.50671 10.96842 90.89813  97.0  -0.7165413     21.93684 0.91 
1 1 1 -19 9  32 o 93.41219 7.416427 94.72808  163.1 ?              ?        0.96 
1 1 1 -19 11 1  o 109.3452 3.271321 178.5606  306.3 14.73264       6.542643 0.92 
1 1 1 -19 11 2  o 251.2525 2.923256 417.9370  76.7  -13.29727      5.846512 0.99 
1 1 1 -19 11 3  o 258.9110 2.961079 487.7898  1.2   -34.59717      5.922158 0.99 
1 1 1 -19 11 4  o 487.5222 5.710543 750.8256  331.6 9.795441       11.42109 1.00 
1 1 1 -19 11 5  o 59.49807 6.181460 120.6942  23.6  -22.17705      12.36292 0.78 
1 1 1 -19 11 6  f 293.0544 3.177710 430.1940  98.4  -23.22763      6.355419 0.00 
1 1 1 -19 11 7  o 177.9511 2.922851 310.9105  110.1 -5.656326      5.845701 0.97 
1 1 1 -19 11 8  o 53.69159 7.048393 41.34742  23.0  -19.95407      14.09679 0.35 
1 1 1 -19 11 9  o 104.9222 3.814724 206.0722  257.2 ?              ?        0.94 
1 1 1 -19 11 10 o 121.9386 3.909390 204.6275  293.6 4.211220       7.818780 0.94 
1 1 1 -19 11 11 o 249.3633 4.103450 478.8549  266.3 -4.032181      8.206901 0.99 
1 1 1 -19 11 12 o 155.4442 3.811445 347.6054  246.6 2.027344       7.622890 0.98 
1 1 1 -19 11 13 o 109.5706 6.491425 224.6004  143.3 -22.70869      12.98285 0.96 
1 1 1 -19 11 14 o 210.6960 4.634663 391.7646  198.0 -4.154297      9.269326 0.99 
1 1 1 -19 11 15 o 284.5659 4.392066 518.6595  182.5 -20.71167      8.784131 0.99 
1 1 1 -19 11 16 o 215.6841 4.584324 316.5794  187.9 -30.42738      9.168649 0.99 
1 1 1 -19 11 17 o 133.1017 5.630469 261.0521  221.0 -27.09017      11.26094 0.98 
1 1 1 -19 11 18 o 103.7648 7.189298 266.0912  235.9 10.94188       14.37860 0.98 
1 1 1 -19 11 19 o 164.7257 2.961062 251.0286  337.5 -4.934631      5.922124 0.99 
1 1 1 -19 11 20 o 94.96705 4.266601 142.8555  303.7 10.26990       8.533202 0.96 
1 1 1 -19 11 21 o 163.1915 3.522762 271.3099  123.3 -22.90372      7.045523 0.98 
1 1 1 -19 11 22 o 196.1525 3.689075 348.8331  77.5  2.314713       7.378150 0.99 
1 1 1 -19 11 23 o 48.21259 10.45628 46.78688  220.0 9.944210       20.91256 0.61 
1 1 1 -19 11 24 o 116.9720 5.886969 147.4357  294.2 -10.66061      11.77394 0.97 
1 1 1 -19 11 25 o 88.84055 8.965734 157.7660  33.1  -38.51127      17.93147 0.96 
1 1 1 -19 11 26 o 52.37074 13.84450 100.0227  121.7 0.8984375      27.68900 0.89 
1 1 1 -19 11 27 o 77.46786 9.600320 135.3012  24.9  26.41322       19.20064 0.96 
1 1 1 -19 11 28 o 95.75264 9.231091 234.3353  36.9  1.642189       18.46218 0.98 
1 1 1 -19 11 29 o 49.49249 13.99017 124.7739  48.4  -36.12325      27.98034 0.92 
1 1 1 -19 11 30 o 30.22524 14.55376 46.45694  47.6  ?              ?        0.62 
1 1 1 -19 13 1  o 130.2593 4.938857 206.3419  177.0 -12.72781      9.877713 0.97 
1 1 1 -19 13 2  o 191.3211 4.330254 353.9066  152.6 -20.92094      8.660508 0.99 
1 1 1 -19 13 3  o 94.87746 4.536039 101.4320  10.0  -8.357353      9.072079 0.92 
1 1 1 -19 13 4  o 266.3607 3.330365 465.3951  326.5 -23.12732      6.660730 0.99 
1 1 1 -19 13 5  o 122.2564 3.949592 187.3941  57.6  6.360191       7.899184 0.97 
1 1 1 -19 13 6  o 68.49181 6.592794 171.0368  16.1  54.20662       13.18559 0.93 
1 1 1 -19 13 7  o 101.9240 4.112156 171.5271  140.4 25.41786       8.224313 0.96 
1 1 1 -19 13 8  o 87.31134 5.164325 199.4693  129.2 18.07372       10.32865 0.96 
1 1 1 -19 13 9  o 73.24370 8.820437 80.90147  225.5 6.451347       17.64087 0.87 
1 1 1 -19 13 10 o 106.9053 6.172022 141.7234  102.1 9.697357       12.34404 0.96 
1 1 1 -19 13 11 f 56.28552 11.60659 125.1720  253.2 6.852852       23.21318 0.00 
1 1 1 -19 13 12 o 46.32345 11.49591 35.66871  283.3 13.27015       22.99182 0.56 
1 1 1 -19 13 13 o 94.11438 7.999142 179.6452  141.4 5.774040       15.99828 0.97 
1 1 1 -19 13 14 o 62.08952 10.40503 114.5321  74.5  -4.989910      20.81006 0.90 
1 1 1 -19 13 15 o 166.4382 5.578633 246.4750  304.1 2.849792       11.15727 0.98 
1 1 1 -19 13 16 o 206.9917 5.442569 399.2980  291.5 -20.00684      10.88514 0.99 
1 1 1 -19 13 17 o 149.0607 7.452354 243.9401  247.4 -5.655975      14.90471 0.98 
1 1 1 -19 13 18 o 89.11804 12.56706 180.3389  348.5 -5.125153      25.13412 0.95 
1 1 1 -19 13 19 o 84.60280 13.50219 114.0657  69.7  -34.87719      27.00437 0.92 
1 1 1 -19 13 20 o 61.80783 12.38019 167.8504  169.5 -21.77702      24.76037 0.94 
1 1 1 -19 13 21 o 80.59626 13.26337 117.3947  229.7 -32.52556      26.52674 0.94 
1 1 1 -19 13 22 o 71.17834 14.21781 143.4949  155.1 -6.497490      28.43563 0.95 
1 1 1 -19 13 23 o 95.70418 13.46846 186.4767  92.1  -10.42006      26.93693 0.97 
1 1 1 -19 13 24 o 36.03593 11.80988 41.50002  135.8 18.58072       23.61975 0.66 
1 1 1 -19 13 25 o 49.24138 22.81849 30.14038  223.4 ?              ?        0.43 
1 1 1 -19 13 26 o 77.51404 27.44441 141.3600  302.5 ?              ?        0.90 
1 1 1 -19 13 27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -19 15 1  o 154.7008 4.095823 238.3852  206.4 3.579315       8.191647 0.98 
1 1 1 -19 15 2  o 50.79959 9.065140 99.66640  93.4  -20.10746      18.13028 0.85 
1 1 1 -19 15 3  f 118.2315 4.473831 283.6263  137.5 23.15490       8.947661 0.00 
1 1 1 -19 15 4  o 33.16224 9.406453 49.43248  310.4 17.78555       18.81291 0.51 
1 1 1 -19 15 5  o 208.5387 3.755542 353.5628  22.5  2.599091       7.511083 0.99 
1 1 1 -19 15 6  o 166.6899 4.123456 264.9788  346.1 -25.19176      8.246911 0.99 
1 1 1 -19 15 7  o 31.24167 8.951430 79.24845  306.5 18.46431       17.90286 0.68 
1 1 1 -19 15 8  o 65.19791 8.819077 107.5365  110.5 -5.559841      17.63815 0.90 
1 1 1 -19 15 9  o 155.6432 4.012385 240.9336  67.2  17.25398       8.024770 0.98 
1 1 1 -19 15 10 o 95.30110 9.056056 233.9805  13.9  35.33323       18.11211 0.97 
1 1 1 -19 15 11 o 76.13531 11.98536 164.4908  5.2   -20.48850      23.97071 0.95 
1 1 1 -19 15 12 o 54.62854 11.08922 143.8578  319.7 -17.08752      22.17844 0.93 
1 1 1 -19 15 13 o 91.01996 11.24575 182.3699  49.5  -12.22015      22.49150 0.97 
1 1 1 -19 15 14 o 51.41451 11.90206 77.77883  39.4  3.199932       23.80412 0.86 
1 1 1 -19 15 15 o 53.45279 10.63801 75.72810  254.6 -16.41939      21.27601 0.88 
1 1 1 -19 15 16 o 78.67255 12.44018 170.8236  319.2 -14.38928      24.88035 0.97 
1 1 1 -19 15 17 o 41.09264 12.24169 39.18627  22.5  -3.899471      24.48338 0.69 
1 1 1 -19 15 18 o 32.12714 10.59071 117.2147  33.9  -4.467400      21.18143 0.89 
1 1 1 -19 15 19 o 55.30626 23.78343 91.81013  36.6  ?              ?        0.81 
1 1 1 -19 15 20 o 32.18460 11.22701 86.61221  24.4  9.308691       22.45403 0.85 
1 1 1 -19 15 21 o 40.11945 19.45812 127.0305  0.4   ?              ?        0.86 
1 1 1 -19 15 22 o 71.16556 13.18282 172.4804  335.6 ?              ?        0.97 
1 1 1 -19 17 1  o 90.87486 7.046033 147.6018  61.4  19.27055       14.09207 0.98 
1 1 1 -19 17 2  o 35.86134 9.829512 24.32968  140.3 -4.445862      19.65902 0.52 
1 1 1 -19 17 3  o 49.97194 10.79367 63.49885  180.2 -2.014862      21.58735 0.87 
1 1 1 -19 17 4  o 37.58407 10.55081 98.77974  107.4 16.77545       21.10162 0.89 
1 1 1 -19 17 5  o 132.3418 6.390087 287.0059  122.6 -2.651947      12.78017 0.99 
1 1 1 -19 17 6  o 54.95867 8.845446 62.66508  117.3 -37.84037      17.69089 0.90 
1 1 1 -19 17 7  o 39.81236 10.50552 110.3978  299.1 -6.910278      21.01104 0.91 
1 1 1 -19 17 8  o 36.02122 9.091391 58.04348  217.9 -18.63902      18.18278 0.82 
1 1 1 -19 17 9  f 90.30704 8.886603 159.4433  114.7 -18.11523      17.77321 0.00 
1 1 1 -19 17 10 o 50.71159 11.00754 128.0014  74.2  -17.82285      22.01508 0.94 
1 1 1 -19 17 11 o 56.69220 9.462386 148.3857  28.4  -42.36969      18.92477 0.96 
1 1 1 -19 17 12 o 36.76899 10.45066 25.06888  331.9 -5.490040      20.90132 0.56 
1 1 1 -19 17 13 o 34.51748 11.73997 33.65660  170.4 ?              ?        0.62 
1 1 1 -19 17 14 o 29.27619 10.32089 18.35296  280.1 ?              ?        0.39 
1 1 1 -19 17 15 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -18 0  1  o 906.0464 12.12855 1459.277  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  2  o 309.5196 5.838091 310.7863  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  3  o 517.3927 7.670902 1100.560  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  4  o 36.11288 7.881090 295.7303  180.0 -0.000000      0.000000 0.16 
1 1 1 -18 0  5  o 178.9647 4.229692 49.45584  0.0   -0.000000      0.000000 0.61 
1 1 1 -18 0  6  o 350.0345 5.949818 750.7226  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  7  o 37.51957 6.789479 55.64083  0.0   -0.000000      0.000000 0.39 
1 1 1 -18 0  8  o 57.90976 4.507929 230.6999  180.0 -0.000000      0.000000 0.24 
1 1 1 -18 0  9  o 61.39726 4.242112 122.7388  180.0 -0.000000      0.000000 0.27 
1 1 1 -18 0  10 o 334.2526 5.138429 990.6878  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  11 o 576.6243 7.545722 543.7604  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  12 o 237.5338 3.934128 68.71897  360.0 -0.000000      0.000000 0.97 
1 1 1 -18 0  13 x ?        ?        705.2665  0.0   ?              ?        0.00 
1 1 1 -18 0  14 o 1081.551 12.88253 1534.137  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  15 o 99.45576 4.129224 142.6661  180.0 -0.000000      0.000000 0.72 
1 1 1 -18 0  16 o 71.98611 5.245120 205.2885  360.0 -0.000000      0.000000 0.03 
1 1 1 -18 0  17 o 80.68333 4.213377 67.38224  180.0 -0.000000      0.000000 0.05 
1 1 1 -18 0  18 o 347.8656 5.064983 258.1241  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  19 o 680.8474 8.481335 959.5970  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  20 o 107.0745 5.513441 8.084376  360.0 -0.000000      0.000000 0.07 
1 1 1 -18 0  21 o 167.9482 3.976906 159.3961  0.0   -0.000000      0.000000 0.94 
1 1 1 -18 0  22 o 503.7356 7.012851 670.7890  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  23 f 200.3290 4.355695 49.76485  180.0 -0.000000      0.000000 0.00 
1 1 1 -18 0  24 o 263.4490 4.865359 548.8314  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  25 o 86.19075 7.325323 284.7604  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  26 o 363.6918 9.159409 437.5193  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  27 o 104.5450 8.974799 170.8394  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  28 o 145.8689 5.627964 164.0567  360.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  29 o 189.5068 6.257274 284.1528  0.0   -0.000000      0.000000 1.00 
1 1 1 -18 0  30 o 128.7504 9.284819 208.9717  180.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  31 o 34.27118 18.43982 67.72015  0.0   -0.000000      0.000000 0.54 
1 1 1 -18 0  32 o 116.2998 11.12454 169.6225  360.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  33 o 36.71945 19.54201 111.3358  180.0 -0.000000      0.000000 0.90 
1 1 1 -18 0  34 o 30.20696 17.84630 27.77935  180.0 -0.000000      0.000000 0.37 
1 1 1 -18 0  35 o 77.91054 13.08267 55.71960  0.0   -0.000000      0.000000 0.99 
1 1 1 -18 0  36 o 68.70676 17.86298 85.44421  360.0 -0.000000      0.000000 1.00 
1 1 1 -18 0  37 o 166.5761 8.157822 189.3501  180.0 ?              ?        1.00 
1 1 1 -18 2  1  o 588.4742 4.788713 778.9968  52.9  52.02631       9.577427 0.99 
1 1 1 -18 2  2  o 635.4245 5.831985 732.7169  224.3 -30.65869      11.66397 0.99 
1 1 1 -18 2  3  o 389.7874 4.347091 255.6513  277.5 85.97913       8.694181 0.96 
1 1 1 -18 2  4  o 371.1960 4.090979 922.6570  287.0 -17.36206      8.181957 0.97 
1 1 1 -18 2  5  o 290.4518 3.529989 683.9399  22.3  26.55600       7.059978 0.93 
1 1 1 -18 2  6  o 522.4479 5.217336 1139.241  347.7 -25.13208      10.43467 0.99 
1 1 1 -18 2  7  o 458.5170 4.659874 765.9933  121.5 99.03973       9.319749 0.98 
1 1 1 -18 2  8  o 162.2787 2.591971 521.1458  79.9  -19.54785      5.183942 0.84 
1 1 1 -18 2  9  o 116.1499 2.440847 64.77075  118.1 -4.596794      4.881693 0.40 
1 1 1 -18 2  10 o 122.0287 3.883808 374.6385  294.8 -26.82278      7.767617 0.63 
1 1 1 -18 2  11 o 454.0796 4.452388 328.3801  83.9  73.87921       8.904776 0.95 
1 1 1 -18 2  12 o 369.0051 3.774647 599.5977  134.3 17.03961       7.549294 0.97 
1 1 1 -18 2  13 o 288.0718 3.519099 518.6028  91.8  35.97339       7.038198 0.95 
1 1 1 -18 2  14 o 912.2753 9.304594 1243.306  234.1 -23.86023      18.60919 0.99 
1 1 1 -18 2  15 o 286.5045 3.139897 376.8156  248.6 -4.813446      6.279793 0.94 
1 1 1 -18 2  16 o 637.9853 5.628964 909.0570  76.0  -82.30737      11.25793 0.99 
1 1 1 -18 2  17 o 415.8563 4.056172 573.4902  252.1 -41.74353      8.112344 0.97 
1 1 1 -18 2  18 f 477.5357 4.490180 504.6039  157.9 -20.84241      8.980361 0.00 
1 1 1 -18 2  19 o 122.8679 3.018445 140.0794  309.0 23.58366       6.036889 0.51 
1 1 1 -18 2  20 o 353.8657 3.678134 482.2726  214.9 15.91885       7.356269 0.97 
1 1 1 -18 2  21 o 229.1387 4.167381 304.1186  158.9 -12.74100      8.334763 0.95 
1 1 1 -18 2  22 o 111.0423 3.195497 193.7791  113.4 13.55729       6.390993 0.88 
1 1 1 -18 2  23 o 275.4553 3.356705 297.8687  260.2 10.15604       6.713409 0.98 
1 1 1 -18 2  24 o 126.6305 3.292625 237.7133  188.6 31.05199       6.585250 0.95 
1 1 1 -18 2  25 o 76.06879 5.217809 86.12379  63.1  4.818802       10.43562 0.71 
1 1 1 -18 2  26 o 204.4684 3.389135 276.8363  263.2 -2.552216      6.778270 0.98 
1 1 1 -18 2  27 o 249.2193 3.836879 322.9927  306.3 -22.75076      7.673758 0.99 
1 1 1 -18 2  28 o 51.65667 9.636016 105.6855  319.4 -37.40375      19.27203 0.81 
1 1 1 -18 2  29 o 196.2570 4.080949 235.9537  32.9  -7.191498      8.161898 0.99 
1 1 1 -18 2  30 o 104.0834 6.418026 111.8151  50.0  5.120064       12.83605 0.93 
1 1 1 -18 2  31 o 61.13877 13.45675 82.85839  337.4 ?              ?        0.78 
1 1 1 -18 2  32 o 167.4910 5.299299 180.2070  163.4 -0.4804993E-01 10.59860 0.98 
1 1 1 -18 2  33 o 98.48540 8.776139 135.2563  96.5  43.42458       17.55228 0.96 
1 1 1 -18 2  34 o 45.84535 11.28492 54.32240  112.3 -12.75930      22.56984 0.77 
1 1 1 -18 2  35 o 194.7267 6.164284 231.1028  144.2 -17.29463      12.32857 0.99 
1 1 1 -18 2  36 o 90.80936 7.941362 98.79474  107.8 9.582718       15.88272 0.96 
1 1 1 -18 2  37 o 36.76209 11.34343 40.88372  299.4 ?              ?        0.70 
1 1 1 -18 4  1  o 438.0876 3.699542 621.9175  128.0 -88.30115      7.399083 0.98 
1 1 1 -18 4  2  o 569.2548 4.560203 954.0128  46.5  -40.78949      9.120405 0.99 
1 1 1 -18 4  3  o 227.2093 2.390745 375.9254  215.4 41.59322       4.781491 0.84 
1 1 1 -18 4  4  o 273.5429 2.937316 824.7437  217.8 78.42458       5.874633 0.94 
1 1 1 -18 4  5  o 114.5390 2.031431 329.1350  357.0 -4.657562      4.062861 0.69 
1 1 1 -18 4  6  o 113.1974 2.361663 97.11761  191.4 16.73819       4.723325 0.22 
1 1 1 -18 4  7  o 296.7180 3.182450 377.6043  183.9 81.00018       6.364899 0.94 
1 1 1 -18 4  8  o 577.9907 5.330442 803.3540  44.1  -60.91644      10.66088 0.98 
1 1 1 -18 4  9  o 686.3307 5.985008 977.3716  12.3  52.31354       11.97002 0.99 
1 1 1 -18 4  10 o 209.9598 2.562273 350.0044  121.8 16.47629       5.124547 0.91 
1 1 1 -18 4  11 o 478.6486 5.350783 707.3996  105.2 7.866058       10.70157 0.97 
1 1 1 -18 4  12 o 396.2827 3.895178 457.1173  282.7 31.71579       7.790356 0.97 
1 1 1 -18 4  13 o 326.2085 3.489658 809.8161  97.8  24.12347       6.979315 0.97 
1 1 1 -18 4  14 o 514.7270 4.590445 873.6755  119.1 50.46854       9.180889 0.99 
1 1 1 -18 4  15 o 156.5627 2.636300 243.4590  315.7 33.89801       5.272599 0.84 
1 1 1 -18 4  16 o 81.53283 3.636705 59.71268  24.7  2.170822       7.273410 0.23 
1 1 1 -18 4  17 o 108.3624 3.060328 200.3525  282.0 1.218292       6.120655 0.63 
1 1 1 -18 4  18 o 428.2485 4.103290 531.1929  269.5 -44.09189      8.206580 0.98 
1 1 1 -18 4  19 o 217.4360 3.481921 299.6931  246.9 1.858231       6.963842 0.94 
1 1 1 -18 4  20 o 85.82566 4.287214 215.3823  1.2   59.96196       8.574429 0.80 
1 1 1 -18 4  21 f 41.56673 6.630954 115.0817  337.3 24.95342       13.26191 0.00 
1 1 1 -18 4  22 o 99.36514 3.451985 113.8170  237.7 -3.991600      6.903971 0.84 
1 1 1 -18 4  23 o 267.3391 3.212073 414.8430  146.3 -27.97847      6.424146 0.99 
1 1 1 -18 4  24 o 74.41908 5.591727 130.7073  348.6 0.1037827      11.18345 0.84 
1 1 1 -18 4  25 o 179.0898 3.858972 263.1814  358.3 52.81230       7.717944 0.98 
1 1 1 -18 4  26 o 177.7832 3.434814 275.0483  8.0   6.164719       6.869628 0.98 
1 1 1 -18 4  27 o 196.3923 3.945717 269.8055  262.2 -19.20573      7.891435 0.98 
1 1 1 -18 4  28 o 192.7523 4.753457 259.1892  287.5 -0.2901001     9.506914 0.99 
1 1 1 -18 4  29 o 61.16336 9.314339 3.841222  192.6 -33.89736      18.62868 0.08 
1 1 1 -18 4  30 o 176.3929 4.639657 267.1018  216.4 -5.358597      9.279315 0.98 
1 1 1 -18 4  31 o 183.0759 4.380778 204.0108  74.9  11.40091       8.761556 0.98 
1 1 1 -18 4  32 o 137.2145 4.806829 149.7155  128.7 -6.046585      9.613658 0.97 
1 1 1 -18 4  33 o 110.9398 6.306274 155.8447  292.3 -19.16146      12.61255 0.97 
1 1 1 -18 4  34 o 47.98063 10.35508 70.34803  88.9  -29.50920      20.71016 0.86 
1 1 1 -18 4  35 o 90.49798 8.333226 98.78145  72.0  23.58368       16.66645 0.96 
1 1 1 -18 4  36 o 46.09312 14.05966 59.15458  67.4  ?              ?        0.82 
1 1 1 -18 6  1  o 244.1738 3.000449 416.8612  336.5 92.90460       6.000898 0.92 
1 1 1 -18 6  2  o 567.2191 4.854188 940.6915  31.7  -42.59131      9.708377 0.99 
1 1 1 -18 6  3  o 589.6440 4.931952 983.5837  314.9 24.02362       9.863905 0.99 
1 1 1 -18 6  4  o 396.1535 3.150893 597.7878  322.5 30.61456       6.301787 0.97 
1 1 1 -18 6  5  o 351.8295 3.047868 690.7575  221.5 10.41266       6.095736 0.96 
1 1 1 -18 6  6  o 422.9932 3.751361 495.2786  351.1 -31.31503      7.502722 0.97 
1 1 1 -18 6  7  o 300.2074 3.021843 555.5722  321.0 80.61926       6.043685 0.96 
1 1 1 -18 6  8  o 122.3501 3.082214 123.1764  9.0   -9.152306      6.164428 0.45 
1 1 1 -18 6  9  o 400.5471 3.579543 812.7584  31.5  -5.405792      7.159086 0.98 
1 1 1 -18 6  10 o 470.7872 4.412777 701.3062  85.0  -32.24927      8.825554 0.98 
1 1 1 -18 6  11 o 143.6693 5.324179 373.3173  241.5 ?              ?        0.82 
1 1 1 -18 6  12 o 203.0223 2.913593 274.5652  256.1 -39.20308      5.827186 0.88 
1 1 1 -18 6  13 o 102.9343 3.430501 150.5242  170.2 -10.46798      6.861001 0.57 
1 1 1 -18 6  14 o 194.5498 2.778486 331.9865  87.2  -39.86716      5.556972 0.91 
1 1 1 -18 6  15 o 135.1916 2.657557 260.5722  262.1 -2.254089      5.315114 0.81 
1 1 1 -18 6  16 o 273.8421 3.033337 472.9838  96.7  12.21704       6.066673 0.96 
1 1 1 -18 6  17 o 283.3266 3.193109 379.8815  28.9  -12.68057      6.386217 0.97 
1 1 1 -18 6  18 o 58.72466 5.542570 80.26241  337.5 -4.043755      11.08514 0.39 
1 1 1 -18 6  19 o 146.9944 3.027102 219.7160  115.6 -11.83148      6.054204 0.93 
1 1 1 -18 6  20 o 257.3124 3.227420 508.8558  114.7 4.759537       6.454841 0.99 
1 1 1 -18 6  21 o 137.3605 3.382796 272.4509  173.6 7.063293       6.765591 0.96 
1 1 1 -18 6  22 o 186.4060 3.128204 252.8348  167.6 30.45062       6.256408 0.97 
1 1 1 -18 6  23 o 195.9221 3.746326 353.1570  28.2  -12.56407      7.492652 0.98 
1 1 1 -18 6  24 o 91.83923 4.407534 122.1228  232.1 7.590988       8.815068 0.91 
1 1 1 -18 6  25 o 172.7400 4.016105 249.2982  184.3 40.75777       8.032210 0.98 
1 1 1 -18 6  26 o 104.9324 4.841330 133.8040  154.1 24.99412       9.682660 0.95 
1 1 1 -18 6  27 o 212.9485 3.723895 266.2550  63.5  -16.47652      7.447789 0.99 
1 1 1 -18 6  28 o 98.52043 5.671817 146.4543  49.1  -41.43517      11.34363 0.94 
1 1 1 -18 6  29 o 166.7952 4.210590 209.4532  218.2 31.25623       8.421181 0.98 
1 1 1 -18 6  30 o 76.78806 7.579518 169.9258  188.1 38.54167       15.15904 0.94 
1 1 1 -18 6  31 o 76.29652 7.161539 119.2485  277.0 -9.076118      14.32308 0.94 
1 1 1 -18 6  32 o 38.17786 10.30813 53.47625  263.2 5.465706       20.61627 0.73 
1 1 1 -18 6  33 o 63.95627 9.862707 44.49412  94.5  18.63428       19.72541 0.84 
1 1 1 -18 6  34 o 26.81477 8.992522 17.37018  277.6 2.351992       17.98504 0.29 
1 1 1 -18 6  35 o 40.14737 11.47356 21.43670  53.5  ?              ?        0.49 
1 1 1 -18 8  1  o 175.3071 2.600199 393.6798  349.0 19.31079       5.200399 0.89 
1 1 1 -18 8  2  o 639.0089 5.328617 937.0558  105.8 -0.6902466     10.65723 0.99 
1 1 1 -18 8  3  o 353.7684 3.296811 600.0249  220.5 -4.232880      6.593623 0.97 
1 1 1 -18 8  4  f 450.8503 3.905529 720.9807  237.0 -34.94843      7.811057 0.00 
1 1 1 -18 8  5  o 185.9084 2.998095 362.5980  229.8 3.719070       5.996189 0.90 
1 1 1 -18 8  6  f 408.7112 4.678860 541.7934  20.8  ?              ?        0.00 
1 1 1 -18 8  7  o 39.57068 7.906820 132.0672  21.6  -2.303810      15.81364 0.21 
1 1 1 -18 8  8  o 96.72451 4.707094 173.2455  341.3 -26.62009      9.414187 0.43 
1 1 1 -18 8  9  o 200.5003 2.739545 309.3651  34.1  1.036469       5.479090 0.90 
1 1 1 -18 8  10 o 212.3601 2.800450 267.9931  331.0 -35.26735      5.600900 0.90 
1 1 1 -18 8  11 o 457.5158 4.110618 655.4927  356.1 6.444580       8.221235 0.98 
1 1 1 -18 8  12 o 363.3268 3.409500 699.7623  88.1  -34.30951      6.819000 0.98 
1 1 1 -18 8  13 o 66.88692 4.474991 174.2112  105.0 17.60506       8.949983 0.68 
1 1 1 -18 8  14 f 71.01041 5.207329 168.6676  316.7 -21.66429      10.41466 0.00 
1 1 1 -18 8  15 o 255.2505 3.027136 365.1275  157.1 -19.16986      6.054272 0.98 
1 1 1 -18 8  16 o 420.7438 3.978780 712.1048  116.7 29.51740       7.957560 0.99 
1 1 1 -18 8  17 o 272.2109 3.171800 431.8295  86.4  -9.715729      6.343600 0.99 
1 1 1 -18 8  18 o 232.9915 3.102738 354.7092  140.9 -9.986542      6.205477 0.98 
1 1 1 -18 8  19 o 179.5909 3.246534 320.3296  149.0 -13.47368      6.493069 0.97 
1 1 1 -18 8  20 f 290.4238 3.504177 597.5421  24.8  -6.726318      7.008354 0.00 
1 1 1 -18 8  21 o 220.5926 3.409292 324.5694  166.7 -20.27007      6.818583 0.99 
1 1 1 -18 8  22 f 42.63754 9.859656 72.77415  194.5 -7.288532      19.71931 0.00 
1 1 1 -18 8  23 o 132.1532 4.182095 255.6873  22.6  15.13335       8.364189 0.98 
1 1 1 -18 8  24 o 52.71118 7.883574 127.1677  56.3  -22.84733      15.76715 0.89 
1 1 1 -18 8  25 o 88.36760 5.480522 148.5611  122.2 -1.006523      10.96104 0.95 
1 1 1 -18 8  26 o 44.84958 7.542373 51.54802  119.4 40.14910       15.08475 0.59 
1 1 1 -18 8  27 o 31.38582 9.086047 63.41529  203.4 -14.97327      18.17209 0.52 
1 1 1 -18 8  28 o 56.02859 8.323660 11.54863  114.4 39.43414       16.64732 0.23 
1 1 1 -18 8  29 o 58.33571 13.77378 52.27994  138.0 ?              ?        0.75 
1 1 1 -18 8  30 o 44.86244 10.30657 90.55898  15.4  -2.151478      20.61315 0.87 
1 1 1 -18 8  31 o 30.38645 9.397449 76.27715  195.3 1.491703       18.79490 0.80 
1 1 1 -18 8  32 o 35.60527 10.28274 15.12092  314.0 2.022186       20.56549 0.31 
1 1 1 -18 8  33 o 31.02617 9.190845 53.25311  50.5  8.869228       18.38169 0.75 
1 1 1 -18 10 1  o 366.0452 5.147987 419.0058  240.2 17.19495       10.29597 0.98 
1 1 1 -18 10 2  o 438.9501 4.542753 730.5124  167.8 21.32303       9.085505 0.99 
1 1 1 -18 10 3  o 248.9321 2.824708 474.5000  258.8 20.40150       5.649415 0.98 
1 1 1 -18 10 4  o 95.65253 3.303738 105.8529  323.7 -4.228355      6.607476 0.73 
1 1 1 -18 10 5  o 392.0145 3.807264 584.0244  346.6 10.17618       7.614529 0.99 
1 1 1 -18 10 6  o 435.6121 5.281723 616.8044  40.7  4.901459       10.56345 0.99 
1 1 1 -18 10 7  o 143.1429 3.159042 208.5731  316.0 -21.01590      6.318084 0.93 
1 1 1 -18 10 8  o 159.2256 3.434795 231.4758  345.1 -5.693451      6.869589 0.95 
1 1 1 -18 10 9  o 182.5809 3.503937 460.1714  103.5 -18.64015      7.007874 0.98 
1 1 1 -18 10 10 o 200.8471 4.018254 461.3719  41.4  -31.66504      8.036508 0.98 
1 1 1 -18 10 11 o 68.88503 8.639301 54.21909  222.6 -15.73811      17.27860 0.59 
1 1 1 -18 10 12 o 60.53070 8.261824 139.5212  195.2 -31.28789      16.52365 0.77 
1 1 1 -18 10 13 o 135.4421 4.688601 269.5507  71.0  -35.71800      9.377201 0.96 
1 1 1 -18 10 14 o 67.31505 8.972465 168.4100  325.4 -46.34087      17.94493 0.87 
1 1 1 -18 10 15 o 311.3708 2.995695 533.1892  237.2 -14.53854      5.991390 0.99 
1 1 1 -18 10 16 o 135.0720 2.773689 246.5792  195.2 -2.514282      5.547378 0.97 
1 1 1 -18 10 17 o 85.16679 3.895903 259.8394  102.8 -15.41814      7.791807 0.96 
1 1 1 -18 10 18 o 69.46266 4.810407 100.7560  114.6 16.78828       9.620814 0.86 
1 1 1 -18 10 19 o 55.72263 6.878129 104.6049  253.4 2.054760       13.75626 0.84 
1 1 1 -18 10 20 o 145.8685 3.752379 247.2615  290.6 -26.20651      7.504759 0.98 
1 1 1 -18 10 21 o 35.00027 9.170769 87.80965  257.3 -6.379795      18.34154 0.76 
1 1 1 -18 10 22 o 62.78407 8.981153 174.7400  146.4 1.640350       17.96231 0.94 
1 1 1 -18 10 23 o 92.97153 6.300840 189.7419  151.4 6.845154       12.60168 0.96 
1 1 1 -18 10 24 o 66.56269 9.075575 149.4991  154.0 -36.03125      18.15115 0.92 
1 1 1 -18 10 25 o 51.27577 11.67604 82.40923  186.8 -6.029495      23.35208 0.79 
1 1 1 -18 10 26 f 59.33569 11.26200 60.13617  245.6 -14.03326      22.52400 0.00 
1 1 1 -18 10 27 o 46.79395 11.72144 55.54446  219.3 18.92400       23.44287 0.76 
1 1 1 -18 10 28 o 60.48636 15.11557 44.82492  94.0  -19.40655      30.23113 0.78 
1 1 1 -18 10 29 o 40.07449 12.72795 35.83915  93.8  -4.300663      25.45589 0.62 
1 1 1 -18 10 30 o 46.39619 11.49837 112.9772  31.9  -3.396198      22.99674 0.92 
1 1 1 -18 10 31 o 46.44709 10.79852 37.87310  344.8 ?              ?        0.76 
1 1 1 -18 12 1  o 94.91640 3.865501 188.9982  29.4  14.21940       7.731002 0.94 
1 1 1 -18 12 2  f 69.35215 4.702576 155.3844  75.3  14.13020       9.405152 0.00 
1 1 1 -18 12 3  o 53.86324 8.398941 89.68784  269.5 -13.21473      16.79788 0.71 
1 1 1 -18 12 4  o 266.4577 3.187424 437.9336  343.9 -40.91302      6.374849 0.99 
1 1 1 -18 12 5  o 161.9408 2.985894 186.8364  329.9 -8.897568      5.971788 0.96 
1 1 1 -18 12 6  o 190.7744 2.981622 376.8675  308.5 27.39890       5.963244 0.99 
1 1 1 -18 12 7  o 176.0353 2.987627 275.5144  22.6  13.49696       5.975253 0.98 
1 1 1 -18 12 8  o 64.34098 6.458398 132.0549  113.6 30.10762       12.91680 0.88 
1 1 1 -18 12 9  o 129.2495 4.509580 180.1955  212.0 8.689560       9.019159 0.96 
1 1 1 -18 12 10 o 108.0474 5.682815 139.4403  135.0 9.484039       11.36563 0.94 
1 1 1 -18 12 11 o 98.30568 7.209391 176.7373  277.8 -13.57298      14.41878 0.95 
1 1 1 -18 12 12 o 38.96908 10.33003 75.10561  271.0 ?              ?        0.63 
1 1 1 -18 12 13 o 63.33210 8.784695 98.77209  8.5   0.8543320      17.56939 0.85 
1 1 1 -18 12 14 o 147.8447 4.927231 277.9114  245.7 -0.7059479     9.854462 0.98 
1 1 1 -18 12 15 o 149.4575 5.248826 260.7121  200.4 2.715851       10.49765 0.98 
1 1 1 -18 12 16 o 109.7427 8.070870 204.5585  124.9 -19.72620      16.14174 0.97 
1 1 1 -18 12 17 o 88.60576 10.99329 245.9532  109.1 -56.05621      21.98657 0.97 
1 1 1 -18 12 18 o 88.38932 10.51425 152.2491  11.7  34.78003       21.02850 0.95 
1 1 1 -18 12 19 o 105.1094 9.131408 140.8816  21.2  1.797546       18.26282 0.95 
1 1 1 -18 12 20 o 52.08013 11.74111 71.13732  149.0 -21.14432      23.48222 0.75 
1 1 1 -18 12 21 o 146.1575 8.337122 266.1285  194.0 -14.60471      16.67424 0.98 
1 1 1 -18 12 22 o 139.0721 7.867332 264.4299  175.4 -14.76076      15.73466 0.98 
1 1 1 -18 12 23 o 116.3988 11.44022 259.4019  279.2 -31.99684      22.88043 0.98 
1 1 1 -18 12 24 o 67.88606 24.58724 144.1936  264.2 ?              ?        0.90 
1 1 1 -18 12 25 o 38.08809 12.73483 45.70737  313.0 22.47070       25.46966 0.70 
1 1 1 -18 12 26 o 46.75919 10.36835 62.57008  345.3 -7.271122      20.73670 0.85 
1 1 1 -18 12 27 o 62.13629 17.08408 118.7513  63.3  ?              ?        0.92 
1 1 1 -18 12 28 o 38.96430 12.78743 45.46225  190.3 ?              ?        0.73 
1 1 1 -18 14 1  f 132.2281 4.659091 306.3839  82.7  8.114548       9.318181 0.00 
1 1 1 -18 14 2  o 81.03796 7.256556 74.34335  123.7 -6.379990      14.51311 0.91 
1 1 1 -18 14 3  o 150.2184 3.805559 291.2603  124.4 9.950821       7.611119 0.99 
1 1 1 -18 14 4  f 128.9677 3.692231 212.2430  177.9 38.82512       7.384463 0.00 
1 1 1 -18 14 5  o 123.2135 4.157509 211.4046  105.5 -17.50733      8.315018 0.98 
1 1 1 -18 14 6  o 106.4693 4.537080 177.0064  358.3 19.44455       9.074160 0.97 
1 1 1 -18 14 7  o 76.23047 5.599822 111.9164  267.2 14.02862       11.19964 0.94 
1 1 1 -18 14 8  o 82.64755 5.545762 197.6704  110.7 21.90077       11.09152 0.97 
1 1 1 -18 14 9  o 150.6557 3.834522 247.2060  98.1  -12.44392      7.669043 0.98 
1 1 1 -18 14 10 o 74.49329 11.48529 92.19570  317.5 0.2327271      22.97059 0.89 
1 1 1 -18 14 11 o 84.22779 10.40388 100.2307  309.8 -3.018173      20.80775 0.91 
1 1 1 -18 14 12 o 74.69374 11.93049 115.3446  265.8 -13.97159      23.86097 0.90 
1 1 1 -18 14 13 o 93.70979 8.492620 233.4050  49.8  14.36197       16.98524 0.97 
1 1 1 -18 14 14 o 79.50354 10.68213 153.0415  60.7  -13.53166      21.36427 0.94 
1 1 1 -18 14 15 o 83.87553 21.27389 131.4552  155.3 ?              ?        0.90 
1 1 1 -18 14 16 o 81.62624 11.67101 93.00012  246.3 -11.39639      23.34201 0.91 
1 1 1 -18 14 17 o 57.16967 14.08566 104.2359  91.8  5.604607       28.17131 0.89 
1 1 1 -18 14 18 o 81.15688 13.85151 201.0695  44.0  13.07143       27.70301 0.96 
1 1 1 -18 14 19 o 123.2436 8.443832 249.1203  1.1   ?              ?        0.99 
1 1 1 -18 14 20 o 50.06847 14.20539 52.85556  311.1 12.76001       28.41079 0.79 
1 1 1 -18 14 21 o 65.89090 14.86308 109.7672  123.6 15.90739       29.72616 0.93 
1 1 1 -18 14 22 o 73.28940 15.08285 143.0360  69.8  18.33292       30.16570 0.95 
1 1 1 -18 14 23 f 69.11093 13.01631 164.1180  24.5  -32.76307      26.03261 0.00 
1 1 1 -18 14 24 o 44.97490 20.15411 115.2145  14.5  ?              ?        0.86 
1 1 1 -18 14 25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -18 16 1  o 133.3660 5.412771 250.5266  71.0  30.27824       10.82554 0.99 
1 1 1 -18 16 2  o 67.90216 7.820832 92.46098  48.6  25.79796       15.64166 0.93 
1 1 1 -18 16 3  o 30.70240 9.293706 95.31889  203.0 7.856245       18.58741 0.82 
1 1 1 -18 16 4  o 66.22034 12.45993 151.6676  244.9 23.86954       24.91986 0.95 
1 1 1 -18 16 5  o 74.81346 8.759942 173.3375  173.3 -15.36021      17.51988 0.97 
1 1 1 -18 16 6  o 58.63667 9.020232 102.6772  122.5 49.27873       18.04046 0.92 
1 1 1 -18 16 7  o 75.49408 7.724305 175.1817  72.8  0.3349915      15.44861 0.97 
1 1 1 -18 16 8  o 37.50936 10.20609 58.24907  118.2 19.33817       20.41217 0.76 
1 1 1 -18 16 9  o 49.49677 10.14626 6.717660  306.5 8.821499       20.29251 0.19 
1 1 1 -18 16 10 o 42.13659 12.68262 36.60642  204.4 36.56414       25.36524 0.63 
1 1 1 -18 16 11 f 80.32941 12.13305 121.7662  152.6 -28.85060      24.26610 0.00 
1 1 1 -18 16 12 o 92.56422 10.33314 166.5548  161.1 -11.34165      20.66628 0.98 
1 1 1 -18 16 13 o 55.37784 12.82232 101.5216  71.9  18.44535       25.64465 0.92 
1 1 1 -18 16 14 o 50.88182 10.03786 104.6247  327.6 -25.55247      20.07573 0.93 
1 1 1 -18 16 15 f 40.77872 12.85694 84.66114  188.5 8.375320       25.71387 0.00 
1 1 1 -18 16 16 o 74.65673 14.72774 135.1160  114.8 22.99487       29.45549 0.95 
1 1 1 -18 16 17 o 45.85649 21.58199 147.9835  66.0  ?              ?        0.88 
1 1 1 -18 16 18 o 47.58279 12.72659 121.1825  42.3  ?              ?        0.93 
1 1 1 -18 16 19 o 43.46751 13.45622 24.01096  231.2 ?              ?        0.55 
1 1 1 -18 18 1  o 25.33992 8.726616 45.48742  218.4 ?              ?        0.71 
1 1 1 -18 18 2  o 50.29610 11.09786 134.9605  254.6 ?              ?        0.95 
1 1 1 -18 18 3  o 49.34417 11.42753 33.92922  54.8  ?              ?        0.76 
1 1 1 -18 18 4  o 62.88486 10.25528 122.0719  92.9  ?              ?        0.96 
1 1 1 -18 18 5  o 31.22310 9.865685 105.2277  164.1 ?              ?        0.90 
1 1 1 -18 18 6  o 26.59723 8.902740 62.94684  281.0 ?              ?        0.81 
1 1 1 -18 18 7  o 94.14542 8.662255 200.7457  348.6 ?              ?        0.99 
1 1 1 -18 18 8  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -17 1  1  o 549.7367 5.423150 826.0685  66.0  65.70709       10.84630 0.98 
1 1 1 -17 1  2  o 589.4863 6.113685 858.1659  256.1 -17.58185      12.22737 0.99 
1 1 1 -17 1  3  o 749.2546 7.256023 679.8420  346.4 104.0079       14.51205 0.99 
1 1 1 -17 1  4  o 550.2797 5.547114 840.4427  12.3  31.88116       11.09423 0.99 
1 1 1 -17 1  5  o 398.2153 4.334392 940.7484  177.8 -93.16367      8.668783 0.97 
1 1 1 -17 1  6  o 80.77985 2.963909 299.0565  145.5 45.02585       5.927818 0.40 
1 1 1 -17 1  7  o 63.30122 2.877245 325.1418  259.1 -16.00720      5.754490 0.29 
1 1 1 -17 1  8  f 416.2668 4.381268 1041.346  32.4  53.45541       8.762536 0.00 
1 1 1 -17 1  9  o 398.6616 4.112759 921.4379  83.4  -41.83524      8.225517 0.97 
1 1 1 -17 1  10 o 152.2928 2.325384 549.9438  252.9 -50.02974      4.650767 0.64 
1 1 1 -17 1  11 o 337.5764 3.629480 602.9244  224.1 -36.99985      7.258960 0.97 
1 1 1 -17 1  12 o 240.8194 2.910441 390.7531  335.2 15.64587       5.820881 0.88 
1 1 1 -17 1  13 o 108.7008 2.334878 156.4868  334.3 36.89743       4.669756 0.57 
1 1 1 -17 1  14 o 834.5807 7.199828 1483.186  240.3 -26.10223      14.39966 0.99 
1 1 1 -17 1  15 o 169.3988 2.555189 493.2667  161.5 -41.31097      5.110377 0.89 
1 1 1 -17 1  16 f 148.2005 3.660989 174.7617  157.1 ?              ?        0.00 
1 1 1 -17 1  17 o 915.9218 7.692975 1167.097  263.5 -31.13129      15.38595 0.99 
1 1 1 -17 1  18 o 287.0329 3.187060 296.6836  279.4 17.52646       6.374121 0.94 
1 1 1 -17 1  19 o 207.0677 3.169509 279.3429  355.8 -33.34914      6.339017 0.89 
1 1 1 -17 1  20 o 145.7912 2.744972 340.9917  205.3 15.61389       5.489943 0.89 
1 1 1 -17 1  21 o 315.5305 3.578514 433.3309  346.2 46.08548       7.157027 0.97 
1 1 1 -17 1  22 o 166.6454 3.073853 254.7986  180.9 12.97427       6.147707 0.93 
1 1 1 -17 1  23 f 134.2326 2.960592 268.6107  107.3 49.97427       5.921185 0.00 
1 1 1 -17 1  24 o 101.5254 3.801642 140.8515  215.1 -13.39427      7.603284 0.87 
1 1 1 -17 1  25 o 187.6224 3.151278 238.2778  304.1 -0.5791626     6.302556 0.96 
1 1 1 -17 1  26 o 285.4609 3.719539 385.3085  251.2 -26.17105      7.439077 0.99 
1 1 1 -17 1  27 o 169.2683 3.992781 186.5395  333.0 1.334717       7.985563 0.97 
1 1 1 -17 1  28 o 74.10776 6.356371 108.7535  254.9 -8.065712      12.71274 0.88 
1 1 1 -17 1  29 o 104.5170 5.330767 135.5660  69.8  25.98406       10.66153 0.95 
1 1 1 -17 1  30 o 81.76158 9.509233 130.2103  344.4 15.91457       19.01847 0.92 
1 1 1 -17 1  31 o 94.47934 7.516378 95.30199  258.7 26.64291       15.03276 0.90 
1 1 1 -17 1  32 o 239.0900 5.511274 381.2929  144.5 -1.291794      11.02255 0.99 
1 1 1 -17 1  33 o 181.3296 5.273148 224.6646  75.2  -15.96758      10.54630 0.99 
1 1 1 -17 1  34 o 102.4090 7.809372 115.8220  41.3  -26.11313      15.61874 0.96 
1 1 1 -17 1  35 o 57.69331 11.36193 127.5772  100.3 14.82281       22.72386 0.94 
1 1 1 -17 1  36 o 76.85229 10.25822 118.9333  151.9 -10.54604      20.51644 0.95 
1 1 1 -17 1  37 o 106.1594 8.229779 123.8295  194.9 ?              ?        0.97 
1 1 1 -17 3  1  o 238.8618 2.914465 646.3568  12.9  -92.58659      5.828931 0.95 
1 1 1 -17 3  2  o 220.3976 2.449207 658.3895  338.3 40.04951       4.898413 0.92 
1 1 1 -17 3  3  o 297.9460 3.188305 500.4582  150.0 26.12381       6.376611 0.95 
1 1 1 -17 3  4  o 150.5279 2.443109 238.9238  33.1  94.12715       4.886218 0.82 
1 1 1 -17 3  5  o 139.1510 2.484645 238.6801  21.6  10.28372       4.969289 0.78 
1 1 1 -17 3  6  o 287.4153 3.272624 602.9448  287.7 -89.53824      6.545248 0.96 
1 1 1 -17 3  7  o 324.7905 3.555090 362.5410  116.5 -65.20065      7.110181 0.95 
1 1 1 -17 3  8  o 141.7677 2.446469 369.3553  193.9 19.25667       4.892938 0.65 
1 1 1 -17 3  9  o 434.1022 4.163799 714.0374  129.8 27.88016       8.327598 0.97 
1 1 1 -17 3  10 o 532.5186 4.889341 1187.215  49.3  9.844177       9.778683 0.99 
1 1 1 -17 3  11 o 295.6089 3.160365 642.1371  82.6  8.620758       6.320730 0.96 
1 1 1 -17 3  12 o 529.4048 4.821386 783.7045  171.7 31.46106       9.642773 0.98 
1 1 1 -17 3  13 o 780.8000 6.576912 1087.413  78.5  -2.484558      13.15382 0.99 
1 1 1 -17 3  14 f 474.7849 4.392495 694.7482  43.5  15.67575       8.784990 0.00 
1 1 1 -17 3  15 o 235.5622 2.740124 414.4155  259.8 -3.969452      5.480247 0.91 
1 1 1 -17 3  16 o 431.0259 4.969430 429.9609  146.7 -51.61240      9.938860 0.97 
1 1 1 -17 3  17 o 285.5006 3.149750 670.3032  267.5 -17.34326      6.299500 0.96 
1 1 1 -17 3  18 o 392.6453 4.958550 624.9080  301.0 -57.69864      9.917101 0.97 
1 1 1 -17 3  19 o 147.5317 2.617473 275.1848  296.8 -37.06470      5.234946 0.85 
1 1 1 -17 3  20 o 146.8965 2.740542 216.1181  295.7 -0.2458344     5.481085 0.87 
1 1 1 -17 3  21 o 169.7073 4.123019 269.9752  4.1   38.30824       8.246037 0.94 
1 1 1 -17 3  22 o 69.29093 6.532314 67.49274  299.3 3.769241       13.06463 0.41 
1 1 1 -17 3  23 o 253.8737 3.247241 482.0021  97.9  -4.529434      6.494482 0.99 
1 1 1 -17 3  24 o 148.7077 3.727005 174.4468  77.7  20.84846       7.454010 0.93 
1 1 1 -17 3  25 o 136.6724 4.072093 201.3941  294.5 -29.60152      8.144186 0.95 
1 1 1 -17 3  26 o 260.0300 3.991904 444.8728  324.5 -16.58194      7.983809 0.99 
1 1 1 -17 3  27 o 90.48946 5.552574 162.1118  238.1 -22.84081      11.10515 0.93 
1 1 1 -17 3  28 o 159.3573 3.990468 286.5469  172.1 -4.621552      7.980936 0.98 
1 1 1 -17 3  29 o 141.3150 4.563668 202.2907  282.9 -30.38776      9.127337 0.98 
1 1 1 -17 3  30 o 152.1216 4.506647 195.5553  316.2 -15.97725      9.013293 0.97 
1 1 1 -17 3  31 o 137.4632 5.365064 141.9225  254.8 -25.49667      10.73013 0.96 
1 1 1 -17 3  32 o 191.8567 5.766452 212.9946  185.9 -16.48268      11.53290 0.98 
1 1 1 -17 3  33 o 51.26148 12.14253 41.88197  260.1 -1.770058      24.28506 0.67 
1 1 1 -17 3  34 o 48.61585 12.84523 42.11462  51.5  -9.643196      25.69047 0.72 
1 1 1 -17 3  35 o 113.9422 7.282249 138.0362  96.2  -8.818939      14.56450 0.97 
1 1 1 -17 3  36 o 125.9201 7.615547 160.9069  121.1 -7.962692      15.23109 0.98 
1 1 1 -17 5  1  f 620.7230 5.320516 1005.624  185.5 20.79486       10.64103 0.00 
1 1 1 -17 5  2  o 350.3642 3.120253 924.2612  126.4 93.32925       6.240507 0.97 
1 1 1 -17 5  3  o 357.6987 3.005370 310.2398  181.3 82.01654       6.010740 0.95 
1 1 1 -17 5  4  o 275.4813 2.511305 636.9762  277.1 19.88266       5.022610 0.94 
1 1 1 -17 5  5  o 342.7214 3.170001 471.0992  207.4 1.993317       6.340002 0.96 
1 1 1 -17 5  6  o 268.0548 2.677682 219.0848  242.4 66.65273       5.355363 0.93 
1 1 1 -17 5  7  o 624.4228 5.221201 1095.322  214.2 104.4180       10.44240 0.99 
1 1 1 -17 5  8  o 1001.480 8.311661 1564.562  84.7  -13.74701      16.62332 1.00 
1 1 1 -17 5  9  o 420.8232 3.937799 640.1953  207.0 12.75812       7.875598 0.98 
1 1 1 -17 5  10 o 861.3712 8.909433 1069.710  200.6 22.29950       17.81887 0.99 
1 1 1 -17 5  11 o 297.9178 3.026520 618.8665  60.3  -26.61490      6.053041 0.96 
1 1 1 -17 5  12 o 182.9437 2.756448 301.4560  167.2 -52.35524      5.512896 0.89 
1 1 1 -17 5  13 o 249.0491 2.871207 457.2273  222.2 38.21974       5.742414 0.94 
1 1 1 -17 5  14 o 417.6854 4.013593 456.2858  69.0  -48.11636      8.027185 0.97 
1 1 1 -17 5  15 o 208.2932 2.739937 343.3802  336.0 3.223358       5.479875 0.92 
1 1 1 -17 5  16 o 161.9102 2.818211 259.7659  260.0 36.82130       5.636422 0.85 
1 1 1 -17 5  17 o 143.1914 2.770994 224.5484  110.3 -65.19996      5.541988 0.84 
1 1 1 -17 5  18 o 66.48010 4.502662 100.5315  274.6 -2.173309      9.005324 0.38 
1 1 1 -17 5  19 o 355.4418 3.859235 632.6152  193.8 -10.64182      7.718471 0.99 
1 1 1 -17 5  20 o 130.3318 3.072008 217.2215  99.4  -12.07593      6.144015 0.92 
1 1 1 -17 5  21 o 198.3802 3.185681 253.1019  234.5 7.059158       6.371363 0.97 
1 1 1 -17 5  22 o 37.49801 7.134792 121.2516  350.4 21.62589       14.26958 0.56 
1 1 1 -17 5  23 o 191.5383 3.341088 258.2997  98.6  -61.65605      6.682176 0.97 
1 1 1 -17 5  24 o 128.0715 6.048635 180.1694  200.9 -20.15868      12.09727 0.95 
1 1 1 -17 5  25 o 142.5319 3.452733 155.1665  142.8 13.10466       6.905466 0.96 
1 1 1 -17 5  26 o 111.5309 4.699809 130.4857  30.6  -19.37493      9.399618 0.94 
1 1 1 -17 5  27 o 87.84406 7.067720 113.7320  25.4  -0.9403610     14.13544 0.92 
1 1 1 -17 5  28 o 132.2457 4.775113 216.5128  176.1 -1.271530      9.550225 0.98 
1 1 1 -17 5  29 o 230.7115 4.289907 342.8887  137.6 -3.235138      8.579815 0.99 
1 1 1 -17 5  30 o 61.97281 8.921542 94.58715  98.0  -34.71172      17.84308 0.85 
1 1 1 -17 5  31 o 64.16191 8.750160 96.38307  22.0  21.49400       17.50032 0.88 
1 1 1 -17 5  32 o 120.0540 5.287396 167.9401  268.2 -9.169456      10.57479 0.98 
1 1 1 -17 5  33 o 40.43250 10.12064 65.14632  17.2  -13.44436      20.24128 0.82 
1 1 1 -17 5  34 o 36.64658 10.56865 91.81390  110.1 11.91147       21.13729 0.86 
1 1 1 -17 5  35 f 45.02962 11.86005 32.83367  27.0  4.127655       23.72011 0.00 
1 1 1 -17 5  36 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -17 7  1  o 642.5675 5.188845 912.3455  313.6 21.51849       10.37769 0.99 
1 1 1 -17 7  2  o 343.6403 3.490155 325.4636  73.0  -39.09369      6.980310 0.95 
1 1 1 -17 7  3  o 229.0783 2.603435 623.6949  191.7 -25.62973      5.206870 0.95 
1 1 1 -17 7  4  o 196.3115 2.347681 437.2554  313.9 -14.86734      4.695362 0.92 
1 1 1 -17 7  5  o 369.6124 3.445031 656.9999  349.1 17.05862       6.890061 0.97 
1 1 1 -17 7  6  o 200.0166 2.288919 253.2680  208.8 -52.37518      4.577837 0.90 
1 1 1 -17 7  7  o 298.5730 3.316649 317.9590  159.1 -15.59372      6.633298 0.94 
1 1 1 -17 7  8  o 213.6511 2.516936 314.8144  337.9 14.10175       5.033873 0.92 
1 1 1 -17 7  9  o 417.6320 3.629473 642.8831  43.1  11.13876       7.258946 0.98 
1 1 1 -17 7  10 o 132.4038 2.534410 108.8268  238.1 24.16558       5.068820 0.18 
1 1 1 -17 7  11 o 297.0320 3.196857 615.4740  19.2  29.98758       6.393714 0.96 
1 1 1 -17 7  12 o 350.2480 3.432363 533.1418  348.3 -15.82086      6.864727 0.97 
1 1 1 -17 7  13 o 139.1744 3.356037 58.71608  359.3 -74.96725      6.712074 0.13 
1 1 1 -17 7  14 o 243.2360 2.863074 291.3826  242.5 -35.21121      5.726149 0.94 
1 1 1 -17 7  15 o 395.9622 3.791525 476.7406  147.2 5.685455       7.583049 0.98 
1 1 1 -17 7  16 o 390.6068 3.731877 571.5259  119.2 42.98523       7.463755 0.99 
1 1 1 -17 7  17 o 190.3878 2.912504 399.9021  0.7   17.44395       5.825007 0.97 
1 1 1 -17 7  18 o 169.0872 2.993074 191.8074  261.2 21.15987       5.986148 0.95 
1 1 1 -17 7  19 o 151.5743 3.323679 172.5305  197.1 -14.89673      6.647358 0.93 
1 1 1 -17 7  20 o 250.5208 3.506743 447.1068  22.8  17.68073       7.013487 0.99 
1 1 1 -17 7  21 o 212.8574 3.162916 364.4253  140.2 -13.62897      6.325832 0.98 
1 1 1 -17 7  22 o 70.50779 5.396308 101.6113  302.6 5.622726       10.79262 0.82 
1 1 1 -17 7  23 o 72.76235 6.179351 148.2761  36.7  16.09676       12.35870 0.91 
1 1 1 -17 7  24 o 183.9390 3.702039 279.5196  215.7 -0.9326019     7.404079 0.98 
1 1 1 -17 7  25 o 187.0345 4.001175 297.1920  219.8 18.11591       8.002350 0.99 
1 1 1 -17 7  26 o 41.85395 9.796845 62.41146  320.5 -2.018909      19.59369 0.71 
1 1 1 -17 7  27 o 60.72879 12.29280 58.23351  96.1  ?              ?        0.71 
1 1 1 -17 7  28 o 85.41789 6.541896 124.6308  180.1 22.86168       13.08379 0.92 
1 1 1 -17 7  29 o 41.36842 8.220804 100.4171  149.8 -38.83273      16.44161 0.80 
1 1 1 -17 7  30 o 30.48974 9.374252 40.05657  84.9  -3.902067      18.74850 0.47 
1 1 1 -17 7  31 o 109.8429 5.619659 147.5254  208.4 1.595253       11.23932 0.97 
1 1 1 -17 7  32 o 35.85354 10.36509 33.79159  165.5 -8.385813      20.73018 0.58 
1 1 1 -17 7  33 o 28.15805 9.118746 102.0118  120.3 -1.768816      18.23749 0.85 
1 1 1 -17 7  34 o 37.63072 10.81514 66.52664  216.0 ?              ?        0.83 
1 1 1 -17 9  1  o 316.9268 3.137037 452.6788  348.3 -11.40582      6.274075 0.97 
1 1 1 -17 9  2  o 92.08401 4.312330 84.12996  248.5 34.26946       8.624660 0.48 
1 1 1 -17 9  3  o 174.8784 2.460216 187.9834  52.3  -45.46140      4.920433 0.77 
1 1 1 -17 9  4  o 125.2915 3.254038 188.5027  113.9 -37.12469      6.508075 0.76 
1 1 1 -17 9  5  o 442.1501 4.118910 635.9945  240.1 -2.733917      8.237821 0.98 
1 1 1 -17 9  6  o 295.7144 3.970266 546.0543  64.7  ?              ?        0.97 
1 1 1 -17 9  7  o 380.2921 4.467188 608.4688  74.9  ?              ?        0.98 
1 1 1 -17 9  8  o 296.1805 3.878039 511.5703  99.7  -47.43201      7.756078 0.97 
1 1 1 -17 9  9  o 133.3033 3.975551 199.6579  103.2 -19.86201      7.951102 0.86 
1 1 1 -17 9  10 o 59.42262 6.559998 65.94017  323.7 34.80937       13.12000 0.31 
1 1 1 -17 9  11 o 366.7070 4.172810 500.6280  189.1 13.67847       8.345620 0.98 
1 1 1 -17 9  12 o 253.1581 2.780766 399.2352  198.4 -10.45871      5.561532 0.98 
1 1 1 -17 9  13 o 127.7682 2.691838 344.4023  45.5  -25.64853      5.383676 0.95 
1 1 1 -17 9  14 o 103.5988 2.916888 219.6479  100.7 -11.38704      5.833776 0.93 
1 1 1 -17 9  15 o 391.6829 3.550364 660.1658  216.4 -8.117218      7.100729 0.99 
1 1 1 -17 9  16 o 25.27198 5.884851 15.11756  58.6  -15.86442      11.76970 0.10 
1 1 1 -17 9  17 o 65.48147 6.007874 122.0443  323.4 -21.09637      12.01575 0.83 
1 1 1 -17 9  18 f 168.6975 3.154159 203.1186  211.9 -11.40274      6.308317 0.00 
1 1 1 -17 9  19 o 108.4562 4.090384 263.2410  168.6 10.06794       8.180767 0.96 
1 1 1 -17 9  20 o 165.5182 3.635898 268.5673  86.5  -6.356339      7.271796 0.98 
1 1 1 -17 9  21 o 65.13280 8.077880 95.91042  267.8 -29.43127      16.15576 0.84 
1 1 1 -17 9  22 o 143.1018 4.030310 246.3931  35.7  -6.081955      8.060619 0.98 
1 1 1 -17 9  23 o 42.72876 9.665863 43.57507  12.1  1.116322       19.33173 0.59 
1 1 1 -17 9  24 o 42.45104 10.05613 52.50662  151.9 -11.05280      20.11226 0.62 
1 1 1 -17 9  25 o 90.40941 6.275089 133.6045  280.5 -0.7765198E-01 12.55018 0.93 
1 1 1 -17 9  26 o 168.8750 4.621142 281.9791  315.9 -37.67477      9.242285 0.98 
1 1 1 -17 9  27 o 128.3116 7.129126 204.0186  288.8 -21.79404      14.25825 0.98 
1 1 1 -17 9  28 o 55.75209 10.12882 63.99339  252.8 -3.831669      20.25764 0.83 
1 1 1 -17 9  29 o 92.72440 6.308690 108.0676  141.1 0.5969162      12.61738 0.96 
1 1 1 -17 9  30 o 36.35740 10.32327 38.19505  24.6  -10.46678      20.64653 0.64 
1 1 1 -17 9  31 o 97.36215 9.592179 158.8136  302.3 ?              ?        0.97 
1 1 1 -17 9  32 o 42.71760 11.41009 79.35259  333.2 ?              ?        0.88 
1 1 1 -17 11 1  o 267.5977 4.954234 399.2176  218.2 -13.32162      9.908467 0.99 
1 1 1 -17 11 2  o 306.3121 3.257936 626.8037  166.3 12.42450       6.515873 0.99 
1 1 1 -17 11 3  f 108.0150 3.233730 204.7683  251.4 -4.431961      6.467460 0.00 
1 1 1 -17 11 4  o 145.5296 2.845741 270.6815  245.3 -18.02475      5.691483 0.96 
1 1 1 -17 11 5  o 133.8174 3.024139 148.8747  330.0 -21.60715      6.048278 0.93 
1 1 1 -17 11 6  o 146.5193 2.850131 144.9296  49.6  1.367737       5.700262 0.93 
1 1 1 -17 11 7  o 233.0030 2.857010 352.4267  337.0 3.615158       5.714021 0.98 
1 1 1 -17 11 8  o 162.8192 2.775090 290.2960  347.4 9.568008       5.550180 0.97 
1 1 1 -17 11 9  o 77.15692 6.134535 183.9553  60.4  5.357918       12.26907 0.89 
1 1 1 -17 11 10 o 179.0328 3.792863 289.9304  36.1  -24.71257      7.585725 0.97 
1 1 1 -17 11 11 f 37.21132 9.577418 163.4989  96.2  5.573357       19.15484 0.00 
1 1 1 -17 11 12 o 83.35077 5.553991 143.1946  61.6  42.98527       11.10798 0.89 
1 1 1 -17 11 13 o 192.9871 4.221850 255.3101  16.1  13.75340       8.443700 0.98 
1 1 1 -17 11 14 o 167.9656 4.856238 331.5102  352.1 -16.19908      9.712476 0.98 
1 1 1 -17 11 15 o 119.5469 6.211420 239.3419  320.0 -32.79005      12.42284 0.97 
1 1 1 -17 11 16 o 60.07970 9.451755 87.41235  282.3 -15.10620      18.90351 0.81 
1 1 1 -17 11 17 o 112.4927 6.519881 160.5846  218.3 -21.64606      13.03976 0.95 
1 1 1 -17 11 18 o 86.14023 10.37121 156.2988  238.0 -3.557518      20.74241 0.94 
1 1 1 -17 11 19 o 58.50097 12.71853 131.4073  141.3 11.71214       25.43706 0.91 
1 1 1 -17 11 20 o 153.6678 6.284420 214.8242  228.3 -5.827011      12.56884 0.98 
1 1 1 -17 11 21 o 234.1250 3.196531 396.3394  253.1 8.390427       6.393063 0.99 
1 1 1 -17 11 22 o 80.96395 6.091856 137.6848  144.0 -7.271576      12.18371 0.93 
1 1 1 -17 11 23 o 49.92718 9.649799 49.84893  336.5 -20.36487      19.29960 0.65 
1 1 1 -17 11 24 o 38.24357 10.46284 37.87122  288.9 10.18996       20.92568 0.49 
1 1 1 -17 11 25 o 93.46799 7.026549 160.8405  189.9 -0.3292618     14.05310 0.97 
1 1 1 -17 11 26 o 57.54662 13.20278 147.7301  227.0 15.61002       26.40555 0.94 
1 1 1 -17 11 27 o 57.64863 10.16970 132.5396  170.7 -38.98425      20.33941 0.95 
1 1 1 -17 11 28 o 106.1684 8.604114 157.9112  194.4 -22.32249      17.20823 0.98 
1 1 1 -17 11 29 o 54.23788 11.98728 77.84172  130.6 -12.55527      23.97457 0.90 
1 1 1 -17 11 30 o 30.95951 10.22559 33.97769  232.1 ?              ?        0.61 
1 1 1 -17 13 1  o 137.2560 5.037649 196.3906  10.7  19.99252       10.07530 0.97 
1 1 1 -17 13 2  o 34.29181 9.162407 103.0441  225.1 1.705254       18.32481 0.71 
1 1 1 -17 13 3  o 91.58441 4.344756 110.0842  236.6 -0.8953781     8.689511 0.92 
1 1 1 -17 13 4  o 77.18120 5.282584 113.3593  129.6 28.90075       10.56517 0.90 
1 1 1 -17 13 5  o 71.34541 5.898605 86.96988  299.5 1.213478       11.79721 0.86 
1 1 1 -17 13 6  o 222.5753 3.188833 429.2953  316.7 3.267776       6.377665 0.99 
1 1 1 -17 13 7  o 201.6302 3.134157 384.1309  354.8 12.56204       6.268315 0.99 
1 1 1 -17 13 8  f 161.8860 3.254950 314.0012  306.4 -2.177673      6.509899 0.00 
1 1 1 -17 13 9  o 71.07835 5.681865 92.99467  139.9 23.13957       11.36373 0.88 
1 1 1 -17 13 10 o 149.8857 4.823376 270.4963  177.2 16.84334       9.646751 0.98 
1 1 1 -17 13 11 o 81.35196 9.586751 110.5352  255.0 -10.05098      19.17350 0.92 
1 1 1 -17 13 12 o 52.79539 10.40095 149.7943  215.4 9.292076       20.80189 0.92 
1 1 1 -17 13 13 o 56.29331 9.587011 31.13324  308.3 -31.46733      19.17402 0.62 
1 1 1 -17 13 14 o 95.86172 9.115758 112.7487  288.4 -16.84105      18.23152 0.94 
1 1 1 -17 13 15 o 154.0146 6.699066 223.6713  69.4  ?              ?        0.98 
1 1 1 -17 13 16 o 49.25608 11.36004 112.6861  359.4 -22.66004      22.72007 0.84 
1 1 1 -17 13 17 o 59.04052 13.79308 103.8099  324.3 16.72604       27.58617 0.85 
1 1 1 -17 13 18 o 106.5378 10.64958 191.4798  169.2 2.051086       21.29916 0.96 
1 1 1 -17 13 19 o 78.37515 11.71120 114.3165  298.5 19.59051       23.42240 0.92 
1 1 1 -17 13 20 o 194.6064 7.073250 350.6953  31.1  -28.80948      14.14650 0.99 
1 1 1 -17 13 21 o 42.40356 13.00749 111.8533  83.5  23.27811       26.01497 0.87 
1 1 1 -17 13 22 o 104.1265 13.70989 192.1776  194.0 -41.17519      27.41977 0.97 
1 1 1 -17 13 23 o 50.40398 22.44404 110.6371  268.4 ?              ?        0.85 
1 1 1 -17 13 24 o 41.08604 12.95543 67.95161  41.1  0.1725922      25.91086 0.82 
1 1 1 -17 13 25 o 41.48160 19.92017 37.45913  249.2 ?              ?        0.51 
1 1 1 -17 13 26 o 55.63445 24.39929 101.9562  218.1 ?              ?        0.84 
1 1 1 -17 13 27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -17 15 1  o 55.85505 10.35808 89.96899  281.4 -6.760441      20.71616 0.84 
1 1 1 -17 15 2  o 118.9664 4.213808 106.8223  320.0 6.347374       8.427616 0.95 
1 1 1 -17 15 3  o 124.5579 6.456311 288.7138  125.4 -14.75356      12.91262 0.98 
1 1 1 -17 15 4  o 180.5953 3.457846 303.5818  183.9 8.983368       6.915693 0.99 
1 1 1 -17 15 5  o 199.8879 3.556151 417.9272  173.3 13.24391       7.112303 0.99 
1 1 1 -17 15 6  o 36.22105 9.352070 52.30731  245.4 6.069988       18.70414 0.56 
1 1 1 -17 15 7  o 179.2238 3.703823 352.5821  283.4 19.40114       7.407647 0.99 
1 1 1 -17 15 8  o 146.8258 4.151436 232.0745  194.4 5.785553       8.302873 0.98 
1 1 1 -17 15 9  o 85.21181 6.695405 212.1190  155.5 -7.693886      13.39081 0.97 
1 1 1 -17 15 10 o 126.9980 6.358781 246.3162  186.1 21.96224       12.71756 0.98 
1 1 1 -17 15 11 o 127.6557 7.226482 235.1313  219.3 16.38028       14.45296 0.98 
1 1 1 -17 15 12 o 76.46242 12.27304 176.7985  258.5 -22.81646      24.54609 0.95 
1 1 1 -17 15 13 o 80.17900 11.67825 149.6261  17.8  -29.06738      23.35650 0.95 
1 1 1 -17 15 14 o 52.84963 13.06146 110.0490  95.0  3.755608       26.12292 0.90 
1 1 1 -17 15 15 o 41.18254 13.10025 91.64296  9.0   28.54361       26.20049 0.85 
1 1 1 -17 15 16 o 47.71339 14.01012 42.71270  151.7 0.1121521      28.02024 0.71 
1 1 1 -17 15 17 o 71.47488 13.05286 159.6357  100.4 -14.51250      26.10572 0.96 
1 1 1 -17 15 18 o 72.22857 25.19422 144.2442  93.6  ?              ?        0.91 
1 1 1 -17 15 19 o 36.54348 17.87957 85.72924  218.5 ?              ?        0.78 
1 1 1 -17 15 20 o 84.34665 13.57334 187.4367  214.2 -39.62474      27.14668 0.97 
1 1 1 -17 15 21 o 47.22833 21.73269 59.83944  156.2 ?              ?        0.68 
1 1 1 -17 15 22 o 40.68122 13.25735 71.08317  22.8  ?              ?        0.85 
1 1 1 -17 17 1  o 32.49964 10.34215 34.03231  299.7 -6.489964      20.68430 0.60 
1 1 1 -17 17 2  o 99.72362 6.899431 192.5594  342.0 -11.84395      13.79886 0.98 
1 1 1 -17 17 3  o 118.8506 5.692272 256.2897  345.2 -8.480591      11.38454 0.99 
1 1 1 -17 17 4  o 135.9910 4.830518 262.2124  296.6 6.995148       9.661036 0.99 
1 1 1 -17 17 5  o 97.05489 6.707650 157.0955  266.3 -8.953461      13.41530 0.98 
1 1 1 -17 17 6  o 46.01131 10.88693 36.67446  201.4 23.82478       21.77386 0.73 
1 1 1 -17 17 7  o 38.14995 10.82134 48.70824  304.1 17.59156       21.64268 0.76 
1 1 1 -17 17 8  o 37.24347 10.53956 62.19741  334.3 13.71037       21.07913 0.82 
1 1 1 -17 17 9  o 49.40318 10.61914 112.1131  306.1 5.723103       21.23828 0.93 
1 1 1 -17 17 10 o 66.38710 10.43768 101.2446  277.2 -47.59423      20.87536 0.94 
1 1 1 -17 17 11 o 36.76466 12.56928 23.36173  51.5  27.05067       25.13856 0.46 
1 1 1 -17 17 12 o 33.53413 10.74715 42.21711  151.7 7.162685       21.49431 0.70 
1 1 1 -17 17 13 o 43.41941 10.17124 112.9213  65.7  -7.611813      20.34249 0.93 
1 1 1 -17 17 14 f 36.33640 11.96302 26.87149  244.0 ?              ?        0.00 
1 1 1 -17 17 15 o 49.36444 13.70505 119.1485  173.3 ?              ?        0.93 
1 1 1 -16 0  1  o 272.4424 5.162363 227.0773  0.0   -0.000000      0.000000 1.00 
1 1 1 -16 0  2  o 123.9854 4.026640 739.6467  0.0   -0.000000      0.000000 0.98 
1 1 1 -16 0  3  o 604.1524 8.808045 716.9620  0.0   -0.000000      0.000000 1.00 
1 1 1 -16 0  4  x ?        ?        1215.134  360.0 ?              ?        0.00 
1 1 1 -16 0  5  o 240.2556 4.557204 769.9990  180.0 -0.000000      0.000000 0.99 
1 1 1 -16 0  6  o 80.16064 4.015896 15.35443  180.0 -0.000000      0.000000 0.82 
1 1 1 -16 0  7  o 524.5669 7.480897 651.3572  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  8  o 225.3393 3.989392 522.0803  360.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  9  o 263.6684 4.455652 184.4585  180.0 -0.000000      0.000000 0.99 
1 1 1 -16 0  10 o 110.1537 3.235985 858.1669  0.0   -0.000000      0.000000 0.97 
1 1 1 -16 0  11 o 236.7312 4.022785 355.6588  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  12 o 78.83566 3.056190 507.7593  180.0 -0.000000      0.000000 0.56 
1 1 1 -16 0  13 o 692.5521 8.800625 1190.288  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  14 o 31.45293 9.133377 388.5255  180.0 -0.000000      0.000000 0.08 
1 1 1 -16 0  15 o 357.9919 5.419064 383.8507  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  16 o 374.3688 5.467059 589.1522  0.0   -0.000000      0.000000 1.00 
1 1 1 -16 0  17 o 575.8962 10.41721 749.1093  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  18 o 282.3340 4.760011 239.7536  0.0   -0.000000      0.000000 0.97 
1 1 1 -16 0  19 o 46.74284 8.906750 130.1888  0.0   -0.000000      0.000000 0.29 
1 1 1 -16 0  20 o 124.1103 4.094716 44.09439  360.0 -0.000000      0.000000 0.23 
1 1 1 -16 0  21 o 615.1087 7.854614 793.3740  0.0   -0.000000      0.000000 1.00 
1 1 1 -16 0  22 o 82.99800 6.508518 14.95701  0.0   -0.000000      0.000000 0.08 
1 1 1 -16 0  23 o 83.67049 6.783964 61.45357  180.0 -0.000000      0.000000 0.76 
1 1 1 -16 0  24 o 97.51569 5.695519 170.8588  360.0 -0.000000      0.000000 0.99 
1 1 1 -16 0  25 o 206.6464 5.128981 352.0209  0.0   -0.000000      0.000000 1.00 
1 1 1 -16 0  26 o 36.79148 20.18069 24.40855  180.0 -0.000000      0.000000 0.17 
1 1 1 -16 0  27 o 87.92757 7.804476 148.8339  0.0   -0.000000      0.000000 1.00 
1 1 1 -16 0  28 o 286.7300 6.210531 444.0948  360.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  29 o 26.64119 16.34158 12.28511  0.0   -0.000000      0.000000 0.11 
1 1 1 -16 0  30 o 72.44851 17.12115 78.22759  0.0   -0.000000      0.000000 0.94 
1 1 1 -16 0  31 o 84.88277 11.30906 132.1903  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  32 o 282.7621 7.687717 377.2546  180.0 -0.000000      0.000000 1.00 
1 1 1 -16 0  33 o 93.97287 10.64637 39.61237  0.0   -0.000000      0.000000 0.92 
1 1 1 -16 0  34 o 24.55515 15.80696 53.12461  0.0   -0.000000      0.000000 0.57 
1 1 1 -16 0  35 o 33.96958 18.87950 2.254653  0.0   -0.000000      0.000000 0.04 
1 1 1 -16 0  36 o 34.03495 18.94750 54.40248  180.0 -0.000000      0.000000 0.75 
1 1 1 -16 0  37 o 81.49303 21.52721 116.1413  0.0   ?              ?        1.00 
1 1 1 -16 2  1  f 728.0983 5.605677 1161.909  113.4 -120.7635      11.21135 0.00 
1 1 1 -16 2  2  f 52.87037 3.949471 285.8155  165.8 44.40805       7.898942 0.00 
1 1 1 -16 2  3  o 204.1516 2.956997 336.3286  183.9 8.446289       5.913993 0.79 
1 1 1 -16 2  4  o 230.2938 4.441542 431.0123  177.5 ?              ?        0.91 
1 1 1 -16 2  5  o 386.7571 4.121260 664.4638  126.0 -115.7224      8.242519 0.98 
1 1 1 -16 2  6  o 334.3801 3.612171 344.6362  90.3  -70.08640      7.224342 0.95 
1 1 1 -16 2  7  o 180.3438 2.614706 685.0170  24.8  -9.212433      5.229412 0.91 
1 1 1 -16 2  8  o 291.8694 3.250237 93.36471  289.8 27.53076       6.500474 0.90 
1 1 1 -16 2  9  o 210.6954 2.645288 343.3262  274.3 -24.85580      5.290577 0.91 
1 1 1 -16 2  10 o 563.1277 5.157882 1060.134  299.5 31.54285       10.31576 0.99 
1 1 1 -16 2  11 o 563.0724 5.187179 948.4980  326.3 25.64490       10.37436 0.99 
1 1 1 -16 2  12 o 603.6848 5.417198 1241.705  142.0 13.36395       10.83440 0.99 
1 1 1 -16 2  13 o 227.5230 2.710921 534.1657  130.5 -6.998749      5.421842 0.94 
1 1 1 -16 2  14 o 763.8148 6.437621 1313.805  321.1 33.16931       12.87524 0.99 
1 1 1 -16 2  15 o 231.9290 2.643887 200.0929  178.5 -11.46349      5.287774 0.90 
1 1 1 -16 2  16 o 269.0281 3.003169 452.9941  266.0 -16.65454      6.006337 0.94 
1 1 1 -16 2  17 o 557.0422 5.057598 852.3514  245.5 -19.04645      10.11520 0.99 
1 1 1 -16 2  18 o 552.1886 5.059042 760.3098  267.7 -48.56427      10.11808 0.98 
1 1 1 -16 2  19 o 536.8721 5.014798 788.6031  35.1  -48.36877      10.02960 0.99 
1 1 1 -16 2  20 o 340.0164 4.239725 550.0300  19.4  13.74402       8.479450 0.97 
1 1 1 -16 2  21 o 206.8565 2.808045 293.7574  355.5 39.68294       5.616090 0.95 
1 1 1 -16 2  22 o 259.9255 3.228720 343.0978  57.5  28.13649       6.457439 0.97 
1 1 1 -16 2  23 o 543.2462 6.180878 903.8861  60.2  -35.29810      12.36176 1.00 
1 1 1 -16 2  24 o 156.0088 3.217424 320.3044  33.8  31.75598       6.434848 0.97 
1 1 1 -16 2  25 o 181.9563 3.196304 212.3270  220.3 8.895935       6.392607 0.96 
1 1 1 -16 2  26 o 145.3746 3.627192 153.2148  131.4 19.30341       7.254385 0.95 
1 1 1 -16 2  27 o 43.85115 9.634757 66.59157  271.4 -24.05407      19.26951 0.58 
1 1 1 -16 2  28 o 91.82482 6.444992 142.4174  237.9 24.29660       12.88998 0.93 
1 1 1 -16 2  29 o 149.5414 3.857039 232.0596  215.6 -6.540176      7.714078 0.98 
1 1 1 -16 2  30 o 180.4552 5.018130 225.5822  359.9 -6.137207      10.03626 0.98 
1 1 1 -16 2  31 o 222.5594 6.594111 228.8273  276.0 ?              ?        0.98 
1 1 1 -16 2  32 o 125.8991 6.014508 169.0489  233.2 -17.73232      12.02902 0.97 
1 1 1 -16 2  33 o 163.6039 6.011065 177.2175  358.0 -5.513077      12.02213 0.98 
1 1 1 -16 2  34 o 114.5624 6.692125 143.8700  42.7  9.539368       13.38425 0.97 
1 1 1 -16 2  35 o 127.7765 6.421451 181.4177  64.5  -37.36322      12.84290 0.98 
1 1 1 -16 2  36 o 99.38344 7.912520 136.8965  124.9 4.258217       15.82504 0.97 
1 1 1 -16 2  37 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -16 4  1  o 622.6459 4.698940 1024.812  189.9 -45.30627      9.397881 0.99 
1 1 1 -16 4  2  o 215.3802 2.365892 469.4191  194.1 28.23598       4.731784 0.92 
1 1 1 -16 4  3  o 436.8321 3.676731 524.2737  81.2  -27.78162      7.353462 0.97 
1 1 1 -16 4  4  o 264.3789 2.633376 671.8040  229.2 -49.77090      5.266751 0.95 
1 1 1 -16 4  5  o 87.99876 2.272078 680.3597  128.0 -46.99083      4.544155 0.85 
1 1 1 -16 4  6  f 421.1245 3.950638 824.7853  318.6 -2.325195      7.901277 0.00 
1 1 1 -16 4  7  o 503.2947 4.686913 904.0334  162.2 53.15729       9.373826 0.98 
1 1 1 -16 4  8  o 329.5261 4.534585 498.0649  80.5  ?              ?        0.95 
1 1 1 -16 4  9  o 1091.405 8.934594 1675.315  157.0 17.68567       17.86919 1.00 
1 1 1 -16 4  10 o 503.9511 4.497725 667.6524  143.7 24.56525       8.995451 0.98 
1 1 1 -16 4  11 o 336.2974 3.347992 458.2827  40.8  -1.483795      6.695983 0.95 
1 1 1 -16 4  12 o 227.0763 2.620275 286.5394  289.8 62.68472       5.240551 0.92 
1 1 1 -16 4  13 o 116.7228 2.966859 221.8551  328.6 -57.14584      5.933719 0.68 
1 1 1 -16 4  14 o 728.0465 6.193959 1023.567  90.1  1.438171       12.38792 0.99 
1 1 1 -16 4  15 o 291.4962 3.889523 297.3616  181.0 38.43097       7.779046 0.93 
1 1 1 -16 4  16 o 225.9442 2.658763 280.1068  251.9 45.99109       5.317527 0.90 
1 1 1 -16 4  17 o 100.7644 3.075649 328.6999  21.4  -18.71973      6.151299 0.78 
1 1 1 -16 4  18 o 124.6638 2.655150 158.2305  100.7 -11.69978      5.310301 0.60 
1 1 1 -16 4  19 o 298.6406 3.805644 456.6099  232.1 75.79654       7.611288 0.97 
1 1 1 -16 4  20 o 200.6121 2.792659 280.7036  157.0 -16.17308      5.585318 0.94 
1 1 1 -16 4  21 o 157.1870 2.970322 287.1203  11.6  -44.11131      5.940644 0.95 
1 1 1 -16 4  22 o 273.1345 3.373540 411.1917  213.7 6.144745       6.747081 0.99 
1 1 1 -16 4  23 o 82.68150 5.044043 78.79693  144.0 9.251411       10.08809 0.73 
1 1 1 -16 4  24 o 73.32816 5.112611 47.58812  72.5  -2.208466      10.22522 0.53 
1 1 1 -16 4  25 o 188.9028 3.669832 252.5614  172.5 31.85497       7.339664 0.98 
1 1 1 -16 4  26 o 53.36472 7.679223 53.88946  218.0 -5.439377      15.35845 0.58 
1 1 1 -16 4  27 o 131.8754 4.313686 244.9939  176.6 -12.42747      8.627372 0.97 
1 1 1 -16 4  28 o 166.0262 4.171908 213.8227  129.6 -28.40439      8.343816 0.98 
1 1 1 -16 4  29 o 190.5373 3.868972 263.9266  18.5  -9.328079      7.737945 0.99 
1 1 1 -16 4  30 o 91.83850 5.813687 126.3385  350.5 -9.993095      11.62737 0.92 
1 1 1 -16 4  31 o 169.1426 5.153962 187.7507  214.9 -13.94414      10.30792 0.98 
1 1 1 -16 4  32 o 60.60922 9.445121 83.42914  214.7 -35.24778      18.89024 0.87 
1 1 1 -16 4  33 o 50.11294 11.98672 96.39029  344.9 -5.088535      23.97343 0.89 
1 1 1 -16 4  34 o 97.26730 6.344775 111.8678  295.3 -23.75893      12.68955 0.96 
1 1 1 -16 4  35 o 43.82889 11.37656 78.20599  131.8 -4.171154      22.75313 0.86 
1 1 1 -16 4  36 o 72.48935 13.82690 102.2321  158.5 ?              ?        0.94 
1 1 1 -16 6  1  o 464.9261 4.205156 971.5958  10.2  -18.80161      8.410312 0.98 
1 1 1 -16 6  2  f 685.8944 5.618627 1082.303  158.4 74.67474       11.23725 0.00 
1 1 1 -16 6  3  o 676.0833 5.500101 916.8817  164.2 52.63141       11.00020 0.99 
1 1 1 -16 6  4  o 681.0085 4.810954 904.0432  67.7  29.01959       9.621907 0.99 
1 1 1 -16 6  5  o 359.3505 2.981372 582.6913  68.2  64.99231       5.962744 0.97 
1 1 1 -16 6  6  o 286.9164 2.699480 693.5660  219.0 -26.50748      5.398959 0.96 
1 1 1 -16 6  7  o 239.0860 2.525151 573.2391  121.0 35.28471       5.050303 0.94 
1 1 1 -16 6  8  o 696.8203 5.552481 881.6787  135.6 33.95056       11.10496 0.99 
1 1 1 -16 6  9  o 795.5240 6.151848 1223.520  226.6 -1.160034      12.30370 0.99 
1 1 1 -16 6  10 o 738.6453 6.295192 973.6663  200.4 -63.11530      12.59038 0.99 
1 1 1 -16 6  11 o 530.2855 4.735523 782.2679  90.0  36.00714       9.471046 0.98 
1 1 1 -16 6  12 o 265.9327 3.733181 464.6117  295.9 -41.56747      7.466362 0.95 
1 1 1 -16 6  13 o 431.5333 3.995362 702.1062  272.4 15.76331       7.990723 0.98 
1 1 1 -16 6  14 o 74.77944 4.447049 77.32677  72.2  -25.12643      8.894098 0.19 
1 1 1 -16 6  15 o 241.0529 3.109634 378.8169  115.2 22.97313       6.219268 0.93 
1 1 1 -16 6  16 o 228.6863 3.118944 382.9232  282.7 -88.20764      6.237888 0.95 
1 1 1 -16 6  17 o 176.0860 2.851792 148.5087  207.7 0.2245636      5.703585 0.83 
1 1 1 -16 6  18 o 139.8853 2.972596 240.6904  334.9 -1.987671      5.945193 0.91 
1 1 1 -16 6  19 o 198.0219 3.046239 230.4728  213.5 -2.924301      6.092478 0.95 
1 1 1 -16 6  20 o 217.6282 3.251180 368.2545  321.4 0.5276489      6.502360 0.98 
1 1 1 -16 6  21 o 86.92552 4.245301 114.3285  116.0 -4.931343      8.490602 0.83 
1 1 1 -16 6  22 o 100.9513 3.795895 184.0688  88.0  -24.48254      7.591791 0.92 
1 1 1 -16 6  23 o 151.9562 3.802719 218.7081  45.7  41.00314       7.605439 0.96 
1 1 1 -16 6  24 f 273.7170 3.881508 467.6398  335.0 15.59003       7.763015 0.00 
1 1 1 -16 6  25 o 132.0166 4.502959 85.67693  301.0 0.6352692      9.005918 0.92 
1 1 1 -16 6  26 o 105.3387 4.265939 184.5202  222.5 -29.89295      8.531878 0.96 
1 1 1 -16 6  27 o 58.39755 8.128198 93.99763  179.7 -16.37423      16.25640 0.88 
1 1 1 -16 6  28 o 28.80560 8.699558 36.95750  146.0 -20.40177      17.39912 0.31 
1 1 1 -16 6  29 o 206.2209 4.429605 211.8583  69.6  -22.52367      8.859209 0.98 
1 1 1 -16 6  30 o 96.72334 5.729054 49.82522  129.0 -4.600151      11.45811 0.84 
1 1 1 -16 6  31 o 135.7540 4.996548 188.7618  152.3 16.42051       9.993096 0.98 
1 1 1 -16 6  32 o 96.92245 6.423137 87.40022  222.8 -22.68319      12.84627 0.95 
1 1 1 -16 6  33 o 48.91464 10.17959 99.20300  180.5 -26.66180      20.35918 0.91 
1 1 1 -16 6  34 o 72.35590 9.510377 101.7018  172.5 13.49538       19.02075 0.95 
1 1 1 -16 6  35 o 57.44503 10.47862 76.81969  237.9 ?              ?        0.91 
1 1 1 -16 8  1  o 440.7083 4.023060 735.3179  146.9 24.17914       8.046120 0.98 
1 1 1 -16 8  2  o 440.5029 4.012359 806.2426  241.6 3.636261       8.024717 0.98 
1 1 1 -16 8  3  o 679.2165 5.503241 1097.698  234.0 32.06226       11.00648 0.99 
1 1 1 -16 8  4  o 365.0283 3.326841 425.3886  297.1 39.87570       6.653682 0.96 
1 1 1 -16 8  5  o 218.3698 2.573937 318.0876  18.7  2.145615       5.147875 0.90 
1 1 1 -16 8  6  o 152.4053 2.976379 245.6789  32.8  ?              ?        0.76 
1 1 1 -16 8  7  o 372.3328 4.301388 530.7941  97.0  -0.2027893     8.602777 0.96 
1 1 1 -16 8  8  o 537.8989 6.008796 916.9033  181.0 -63.09027      12.01759 0.99 
1 1 1 -16 8  9  o 373.7596 4.307462 649.3394  216.7 -39.07870      8.614923 0.98 
1 1 1 -16 8  10 o 371.1500 3.372608 636.4297  289.8 -10.05927      6.745215 0.98 
1 1 1 -16 8  11 o 165.2289 2.643192 284.0244  321.3 -28.65135      5.286384 0.87 
1 1 1 -16 8  12 o 368.4133 3.322389 756.0507  324.7 29.81638       6.644778 0.98 
1 1 1 -16 8  13 o 182.0263 2.548669 330.0337  339.4 21.57915       5.097339 0.94 
1 1 1 -16 8  14 o 210.0294 2.792729 304.0421  244.0 -2.273331      5.585458 0.95 
1 1 1 -16 8  15 o 433.1442 4.079893 700.1933  226.5 0.8242798E-01  8.159785 0.99 
1 1 1 -16 8  16 o 81.32594 4.530909 204.6649  300.6 -27.55187      9.061817 0.87 
1 1 1 -16 8  17 o 251.0136 3.093023 384.5192  276.6 -34.58722      6.186046 0.98 
1 1 1 -16 8  18 o 323.3609 3.607790 591.2623  262.0 20.65381       7.215581 0.99 
1 1 1 -16 8  19 f 120.4910 3.715466 204.9957  269.0 -0.5547943     7.430933 0.00 
1 1 1 -16 8  20 o 167.2054 3.302274 297.4136  93.4  -17.06969      6.604548 0.97 
1 1 1 -16 8  21 f 80.28072 5.515776 147.4438  276.2 -5.803291      11.03155 0.00 
1 1 1 -16 8  22 o 215.1210 3.390911 324.9115  359.1 -12.51036      6.781823 0.99 
1 1 1 -16 8  23 o 121.9530 4.640418 214.8666  140.8 45.17630       9.280835 0.97 
1 1 1 -16 8  24 o 128.8746 4.192731 210.9950  204.9 11.90251       8.385462 0.98 
1 1 1 -16 8  25 o 192.3084 3.637259 346.2144  233.4 1.650833       7.274518 0.99 
1 1 1 -16 8  26 o 37.35988 11.06780 66.77180  330.2 -17.05920      22.13560 0.59 
1 1 1 -16 8  27 o 70.15919 7.170207 80.79584  37.3  -17.34061      14.34041 0.85 
1 1 1 -16 8  28 o 93.39076 5.239096 145.0827  195.8 8.595451       10.47819 0.95 
1 1 1 -16 8  29 o 48.78321 14.97666 87.69755  155.1 ?              ?        0.82 
1 1 1 -16 8  30 o 50.29751 9.678564 64.36036  183.1 27.38716       19.35713 0.84 
1 1 1 -16 8  31 o 92.49596 6.648252 93.22408  245.9 21.06921       13.29650 0.96 
1 1 1 -16 8  32 o 46.68808 10.23774 59.78712  120.7 -36.48277      20.47548 0.84 
1 1 1 -16 8  33 o 83.78471 7.314869 114.2449  61.5  ?              ?        0.97 
1 1 1 -16 10 1  o 125.3170 3.738554 287.2260  37.3  5.499733       7.477109 0.92 
1 1 1 -16 10 2  o 149.3379 2.669918 337.3489  301.0 -10.58366      5.339836 0.94 
1 1 1 -16 10 3  o 83.60973 3.790141 78.60078  283.7 -31.41537      7.580282 0.42 
1 1 1 -16 10 4  o 96.34091 3.094585 220.4645  233.1 34.73259       6.189170 0.84 
1 1 1 -16 10 5  f 321.4869 4.184097 447.9223  327.2 -23.06802      8.368194 0.00 
1 1 1 -16 10 6  o 57.22224 5.623393 134.9835  0.5   -17.20526      11.24679 0.62 
1 1 1 -16 10 7  o 216.3711 2.857133 299.6665  265.5 14.83286       5.714266 0.96 
1 1 1 -16 10 8  o 180.0640 3.591197 244.1496  186.1 -16.85094      7.182395 0.95 
1 1 1 -16 10 9  o 47.78121 8.447433 121.3467  312.5 0.3027077      16.89487 0.60 
1 1 1 -16 10 10 o 138.6759 4.298313 190.8371  118.8 -3.046829      8.596626 0.94 
1 1 1 -16 10 11 o 201.5912 3.705456 332.1740  105.0 19.93066       7.410912 0.98 
1 1 1 -16 10 12 o 79.43884 6.323921 126.4947  45.4  8.854408       12.64784 0.83 
1 1 1 -16 10 13 o 247.8590 3.954298 386.6969  88.8  -18.42732      7.908597 0.98 
1 1 1 -16 10 14 o 151.2221 4.319217 162.5887  51.1  -25.41075      8.638434 0.94 
1 1 1 -16 10 15 o 208.9913 4.040601 389.3949  301.6 -17.09341      8.081203 0.98 
1 1 1 -16 10 16 o 85.86874 6.886219 126.8034  74.7  -10.40219      13.77244 0.89 
1 1 1 -16 10 17 o 41.57027 6.454767 131.3144  93.3  -9.309418      12.90953 0.79 
1 1 1 -16 10 18 o 70.38263 4.459666 168.0387  114.2 8.838539       8.919333 0.92 
1 1 1 -16 10 19 o 36.43322 8.881004 60.19708  86.0  4.191097       17.76201 0.53 
1 1 1 -16 10 20 o 28.87380 8.568377 76.93893  177.7 1.365810       17.13675 0.58 
1 1 1 -16 10 21 o 127.3326 4.134767 198.7728  277.9 -6.252716      8.269534 0.98 
1 1 1 -16 10 22 o 188.2191 3.803274 345.3424  37.6  -21.57361      7.606548 0.99 
1 1 1 -16 10 23 o 75.64627 6.753026 74.34402  100.4 -2.237221      13.50605 0.86 
1 1 1 -16 10 24 o 101.8047 7.787146 157.1414  207.2 -22.35493      15.57429 0.95 
1 1 1 -16 10 25 o 100.5427 7.216549 88.41065  348.2 1.999695       14.43310 0.92 
1 1 1 -16 10 26 o 144.3321 5.434660 186.3005  311.5 8.356186       10.86932 0.98 
1 1 1 -16 10 27 o 41.75281 10.44732 57.05573  306.7 -22.04277      20.89465 0.75 
1 1 1 -16 10 28 o 106.6903 6.621193 179.0143  219.8 -11.82451      13.24239 0.98 
1 1 1 -16 10 29 o 113.6259 6.532647 199.2892  166.3 -17.04945      13.06529 0.98 
1 1 1 -16 10 30 o 66.79296 11.07695 168.5974  213.6 5.175964       22.15389 0.96 
1 1 1 -16 10 31 o 78.24776 8.917732 166.8487  270.9 ?              ?        0.97 
1 1 1 -16 12 1  f 41.64410 8.442286 129.5786  204.8 -2.119282      16.88457 0.00 
1 1 1 -16 12 2  o 77.92422 4.907680 231.2199  225.6 27.34444       9.815359 0.93 
1 1 1 -16 12 3  o 147.2295 3.178098 252.0077  198.7 -23.46480      6.356195 0.97 
1 1 1 -16 12 4  o 129.8164 3.138407 217.8759  96.9  -13.70425      6.276814 0.96 
1 1 1 -16 12 5  o 81.40089 4.689657 167.4633  356.0 -18.85159      9.379314 0.91 
1 1 1 -16 12 6  o 206.8257 3.036452 411.0454  283.4 2.309860       6.072904 0.99 
1 1 1 -16 12 7  o 90.25180 4.210174 170.0064  8.0   26.18590       8.420348 0.93 
1 1 1 -16 12 8  o 158.3370 3.071385 292.5026  19.7  18.00644       6.142770 0.98 
1 1 1 -16 12 9  o 176.9012 4.077913 314.5370  24.6  -8.103210      8.155826 0.98 
1 1 1 -16 12 10 o 93.66369 6.119706 264.1147  297.5 -20.71185      12.23941 0.96 
1 1 1 -16 12 11 o 219.2050 3.701253 436.3402  213.1 0.1946716      7.402506 0.99 
1 1 1 -16 12 12 o 201.2253 3.094095 435.5721  156.0 ?              ?        0.99 
1 1 1 -16 12 13 o 170.9608 4.707580 322.8845  325.3 -24.91148      9.415159 0.99 
1 1 1 -16 12 14 o 148.5157 4.711346 291.1601  301.2 18.11510       9.422691 0.98 
1 1 1 -16 12 15 o 70.21229 10.08908 162.8509  348.2 -52.98130      20.17817 0.93 
1 1 1 -16 12 16 o 45.50430 12.09009 84.37506  289.8 -2.972443      24.18017 0.79 
1 1 1 -16 12 17 o 43.99267 11.45962 44.34536  359.8 -4.784180      22.91924 0.63 
1 1 1 -16 12 18 o 160.4653 6.990753 265.4248  103.9 -23.47879      13.98151 0.99 
1 1 1 -16 12 19 o 43.93949 12.40046 59.82713  87.3  42.00378       24.80092 0.62 
1 1 1 -16 12 20 o 189.1614 6.031804 278.0982  342.2 -12.77138      12.06361 0.99 
1 1 1 -16 12 21 o 93.14369 20.14595 109.7565  113.2 ?              ?        0.90 
1 1 1 -16 12 22 o 85.47884 11.71773 139.9149  126.7 15.12123       23.43546 0.94 
1 1 1 -16 12 23 o 69.01495 12.71125 74.90482  332.9 -14.94777      25.42249 0.88 
1 1 1 -16 12 24 o 47.41528 21.12822 133.3173  85.6  ?              ?        0.87 
1 1 1 -16 12 25 o 50.24590 21.87038 53.44439  154.6 ?              ?        0.68 
1 1 1 -16 12 26 o 49.89194 16.44779 43.51523  195.3 ?              ?        0.70 
1 1 1 -16 12 27 o 36.24804 10.94974 90.69827  167.4 -2.858891      21.89948 0.87 
1 1 1 -16 12 28 o 85.73075 15.28128 108.6620  123.4 ?              ?        0.95 
1 1 1 -16 14 1  o 105.8863 5.958681 201.3455  225.5 -31.88780      11.91736 0.98 
1 1 1 -16 14 2  o 134.5925 4.439085 261.1552  297.6 8.245697       8.878171 0.99 
1 1 1 -16 14 3  o 66.92432 6.350715 146.4358  336.1 27.67754       12.70143 0.94 
1 1 1 -16 14 4  o 45.88782 8.361154 50.62647  196.6 2.173004       16.72231 0.71 
1 1 1 -16 14 5  o 75.60817 5.512147 80.29397  143.4 -1.730766      11.02429 0.91 
1 1 1 -16 14 6  o 123.0199 3.974021 185.4960  159.0 -9.158249      7.948042 0.98 
1 1 1 -16 14 7  f 139.1820 3.802407 263.0038  250.5 -10.83012      7.604815 0.00 
1 1 1 -16 14 8  o 156.7325 3.665739 310.4915  305.5 2.315308       7.331478 0.99 
1 1 1 -16 14 9  o 120.6716 4.102871 185.0382  314.2 11.98893       8.205742 0.98 
1 1 1 -16 14 10 o 47.78763 11.68560 52.52606  102.4 33.15436       23.37120 0.66 
1 1 1 -16 14 11 o 70.42886 10.03765 129.2036  319.4 14.63127       20.07529 0.92 
1 1 1 -16 14 12 f 194.6835 5.080647 382.5573  258.5 20.04413       10.16129 0.00 
1 1 1 -16 14 13 o 80.93660 10.96378 214.4763  314.3 -61.52787      21.92755 0.96 
1 1 1 -16 14 14 o 174.5503 6.497725 346.8158  46.6  -6.570526      12.99545 0.99 
1 1 1 -16 14 15 o 114.6257 8.877385 186.5430  71.6  -23.11131      17.75477 0.97 
1 1 1 -16 14 16 o 64.70822 13.52215 154.3974  176.6 -14.66459      27.04430 0.93 
1 1 1 -16 14 17 o 75.43887 13.30180 126.5115  247.2 -14.77463      26.60360 0.93 
1 1 1 -16 14 18 o 208.1690 6.826612 348.3135  223.7 -21.22589      13.65322 0.99 
1 1 1 -16 14 19 o 69.22212 13.98109 165.4147  209.4 ?              ?        0.95 
1 1 1 -16 14 20 o 49.44966 14.00830 95.82687  168.0 10.69025       28.01660 0.89 
1 1 1 -16 14 21 o 76.31647 14.39742 109.4937  265.9 25.95465       28.79483 0.94 
1 1 1 -16 14 22 o 90.26992 24.91573 177.8673  232.3 ?              ?        0.94 
1 1 1 -16 14 23 o 66.37846 13.28580 119.3861  238.9 -30.74111      26.57160 0.94 
1 1 1 -16 14 24 o 49.35685 22.32919 35.16268  292.9 ?              ?        0.50 
1 1 1 -16 14 25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -16 16 1  o 52.01775 9.445081 163.1380  89.3  -31.74094      18.89016 0.94 
1 1 1 -16 16 2  o 66.72343 9.704278 134.9808  87.8  -37.33019      19.40856 0.94 
1 1 1 -16 16 3  o 151.9299 4.418687 237.0988  341.2 9.438507       8.837374 0.99 
1 1 1 -16 16 4  o 76.11018 8.748298 178.7827  312.9 -27.53008      17.49660 0.96 
1 1 1 -16 16 5  o 87.32880 5.600504 115.4506  237.8 20.70893       11.20101 0.96 
1 1 1 -16 16 6  o 82.75214 6.726132 150.6327  234.1 10.47963       13.45226 0.96 
1 1 1 -16 16 7  o 99.18819 6.445502 148.4181  349.6 -25.11694      12.89100 0.97 
1 1 1 -16 16 8  o 31.56347 9.616509 71.91250  61.8  20.71198       19.23302 0.77 
1 1 1 -16 16 9  o 54.84261 9.808820 160.2661  195.8 25.17433       19.61764 0.95 
1 1 1 -16 16 10 o 59.35545 12.20541 76.85178  245.6 33.37183       24.41081 0.89 
1 1 1 -16 16 11 o 67.44921 12.39896 80.91148  313.4 21.32549       24.79793 0.91 
1 1 1 -16 16 12 o 73.28580 12.65088 158.4656  189.8 -23.83361      25.30177 0.96 
1 1 1 -16 16 13 o 34.04908 11.60833 26.95479  124.7 30.39562       23.21667 0.50 
1 1 1 -16 16 14 o 35.35567 11.70422 47.99446  137.2 5.949242       23.40845 0.72 
1 1 1 -16 16 15 o 73.98090 13.93416 83.46597  149.3 13.34411       27.86832 0.92 
1 1 1 -16 16 16 o 58.83384 15.10165 73.96540  277.5 47.41984       30.20330 0.88 
1 1 1 -16 16 17 o 34.69133 17.08538 38.25006  282.5 ?              ?        0.51 
1 1 1 -16 16 18 o 38.26234 12.61147 41.79080  221.8 ?              ?        0.70 
1 1 1 -16 16 19 o 36.56721 11.99766 52.48015  339.0 ?              ?        0.78 
1 1 1 -16 18 1  f 30.93506 10.08168 46.28154  353.8 ?              ?        0.00 
1 1 1 -16 18 2  o 36.90306 10.84531 28.26972  278.0 ?              ?        0.61 
1 1 1 -16 18 3  f 37.27055 10.72713 55.53186  238.4 ?              ?        0.00 
1 1 1 -16 18 4  o 32.67538 9.579825 47.68219  4.8   ?              ?        0.77 
1 1 1 -16 18 5  o 40.60690 11.69251 32.86668  21.2  ?              ?        0.67 
1 1 1 -16 18 6  o 101.8172 7.396525 158.5560  214.2 ?              ?        0.98 
1 1 1 -16 18 7  f 73.58633 9.247431 161.8722  229.5 ?              ?        0.00 
1 1 1 -16 18 8  o 37.76364 10.52459 57.21610  67.9  ?              ?        0.84 
1 1 1 -16 18 9  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -15 1  1  o 254.8021 3.047723 677.9983  103.4 -107.9404      6.095447 0.91 
1 1 1 -15 1  2  o 209.4104 2.972291 696.7592  300.7 -10.99536      5.944583 0.85 
1 1 1 -15 1  3  o 376.3516 4.319539 502.3699  77.0  -10.20108      8.639077 0.96 
1 1 1 -15 1  4  o 309.2153 3.709563 522.2493  221.5 -58.93121      7.419127 0.94 
1 1 1 -15 1  5  o 267.5585 3.347693 1098.361  98.2  22.65988       6.695387 0.95 
1 1 1 -15 1  6  o 325.2788 3.708436 135.0512  324.8 -30.73187      7.416872 0.93 
1 1 1 -15 1  7  o 610.5071 5.834986 536.6917  267.9 26.66583       11.66997 0.99 
1 1 1 -15 1  8  o 161.7479 2.638232 487.9930  18.8  -156.7300      5.276463 0.89 
1 1 1 -15 1  9  f 124.1253 2.178092 493.3333  191.3 -43.04052      4.356183 0.00 
1 1 1 -15 1  10 f 125.7183 2.176628 320.3178  44.7  37.90809       4.353256 0.00 
1 1 1 -15 1  11 o 352.7560 3.599743 658.1976  49.3  -27.82651      7.199487 0.97 
1 1 1 -15 1  12 o 329.5492 3.425849 120.1452  232.9 48.83838       6.851699 0.92 
1 1 1 -15 1  13 o 359.6770 3.619101 637.5417  205.1 13.19333       7.238201 0.96 
1 1 1 -15 1  14 o 399.5788 3.988116 771.8240  89.4  75.38315       7.976233 0.97 
1 1 1 -15 1  15 o 499.6667 4.618813 873.4323  113.1 113.5513       9.237625 0.98 
1 1 1 -15 1  16 o 601.6890 6.513904 918.8486  339.4 20.16382       13.02781 0.99 
1 1 1 -15 1  17 o 158.5857 2.427252 252.3575  260.5 30.28145       4.854505 0.86 
1 1 1 -15 1  18 o 242.8052 3.004185 379.5161  299.0 -48.43022      6.008370 0.93 
1 1 1 -15 1  19 o 245.2669 3.523273 313.7879  187.5 -28.42415      7.046546 0.92 
1 1 1 -15 1  20 o 392.3304 3.882960 590.2619  238.6 -48.43744      7.765919 0.98 
1 1 1 -15 1  21 o 243.1850 3.052111 357.0273  288.1 10.63478       6.104223 0.95 
1 1 1 -15 1  22 o 168.2544 2.927468 167.4678  73.0  -24.25871      5.854936 0.90 
1 1 1 -15 1  23 o 157.0859 3.122504 258.3232  28.4  8.623322       6.245008 0.96 
1 1 1 -15 1  24 o 153.2733 3.015953 156.8910  359.7 -0.6338196     6.031907 0.93 
1 1 1 -15 1  25 o 181.0590 3.456055 328.3005  240.1 8.077301       6.912109 0.97 
1 1 1 -15 1  26 o 208.6919 3.793591 313.6338  62.1  -3.134949      7.587183 0.98 
1 1 1 -15 1  27 o 137.0998 4.724740 156.4787  285.2 3.981277       9.449479 0.95 
1 1 1 -15 1  28 o 103.9624 6.199833 144.4568  356.0 13.81361       12.39967 0.94 
1 1 1 -15 1  29 o 112.9677 5.145214 100.0826  144.6 -29.08678      10.29043 0.94 
1 1 1 -15 1  30 o 173.1255 4.390577 255.3069  38.0  16.86105       8.781154 0.98 
1 1 1 -15 1  31 o 125.1553 5.873686 157.8305  102.1 -12.76334      11.74737 0.96 
1 1 1 -15 1  32 o 130.4723 6.163249 109.6537  292.7 2.155853       12.32650 0.95 
1 1 1 -15 1  33 o 237.7903 6.056655 249.4412  332.6 20.46696       12.11331 0.99 
1 1 1 -15 1  34 o 74.47032 11.26730 88.48833  82.4  -9.911804      22.53461 0.92 
1 1 1 -15 1  35 o 69.28437 11.36544 124.6932  351.9 -47.57227      22.73087 0.95 
1 1 1 -15 1  36 o 31.25654 10.34994 45.55442  28.7  -9.253162      20.69989 0.65 
1 1 1 -15 1  37 o 36.69482 11.68863 76.53394  342.6 ?              ?        0.85 
1 1 1 -15 3  1  o 411.0822 3.582782 507.1823  136.2 -89.40100      7.165565 0.97 
1 1 1 -15 3  2  o 432.5413 3.613744 441.3516  282.4 82.00388       7.227488 0.97 
1 1 1 -15 3  3  o 208.1233 2.548209 350.8192  41.4  29.66866       5.096418 0.86 
1 1 1 -15 3  4  o 455.5969 4.131862 259.9982  171.3 -68.51196      8.263724 0.98 
1 1 1 -15 3  5  o 102.6519 2.471897 273.9049  359.6 -43.30665      4.943793 0.09 
1 1 1 -15 3  6  o 213.4347 2.643116 625.1942  237.7 -91.63739      5.286231 0.92 
1 1 1 -15 3  7  o 240.2984 2.837776 566.2904  228.3 75.10130       5.675551 0.93 
1 1 1 -15 3  8  o 361.0075 3.689432 664.0196  145.2 -77.97498      7.378864 0.98 
1 1 1 -15 3  9  o 441.9597 4.169453 844.6722  143.1 -17.12424      8.338906 0.97 
1 1 1 -15 3  10 o 335.2928 3.438242 656.2480  167.9 -72.71310      6.876484 0.95 
1 1 1 -15 3  11 o 303.0778 3.205627 453.2050  285.1 70.29758       6.411255 0.95 
1 1 1 -15 3  12 o 651.1570 5.652987 1247.019  235.7 42.63507       11.30597 0.99 
1 1 1 -15 3  13 o 474.6953 4.327194 519.4491  244.7 9.737427       8.654388 0.97 
1 1 1 -15 3  14 o 279.1036 2.939967 257.5615  349.1 -12.38983      5.879933 0.88 
1 1 1 -15 3  15 o 982.9905 8.165275 1301.747  199.9 44.35718       16.33055 0.99 
1 1 1 -15 3  16 o 561.3027 4.925639 659.1642  199.3 -51.41589      9.851278 0.98 
1 1 1 -15 3  17 o 356.3177 3.615014 587.1630  175.6 -47.76743      7.230028 0.97 
1 1 1 -15 3  18 o 299.9716 4.164251 390.5344  229.5 25.56186       8.328503 0.95 
1 1 1 -15 3  19 o 147.6963 2.537743 140.9144  297.7 14.93129       5.075486 0.75 
1 1 1 -15 3  20 o 214.8742 2.912533 306.6653  17.3  -4.385880      5.825065 0.93 
1 1 1 -15 3  21 o 148.8368 3.034413 369.8634  335.4 31.54149       6.068826 0.94 
1 1 1 -15 3  22 o 145.6114 2.981611 182.9254  114.4 -30.74158      5.963223 0.92 
1 1 1 -15 3  23 o 360.5455 3.837578 588.4716  1.7   -12.24524      7.675155 0.99 
1 1 1 -15 3  24 o 174.7390 3.202186 286.5786  302.9 36.33777       6.404372 0.97 
1 1 1 -15 3  25 o 102.1227 4.037228 153.5592  171.8 1.937469       8.074456 0.91 
1 1 1 -15 3  26 o 74.57159 6.065488 97.12582  161.9 1.787949       12.13098 0.84 
1 1 1 -15 3  27 o 47.98391 10.83189 86.17348  21.3  -7.218529      21.66378 0.71 
1 1 1 -15 3  28 o 90.30362 6.088912 106.3597  41.9  -7.653778      12.17782 0.92 
1 1 1 -15 3  29 o 80.01511 7.621128 112.8878  73.5  -8.519440      15.24226 0.92 
1 1 1 -15 3  30 o 129.1884 5.636253 154.5513  95.7  14.15347       11.27251 0.96 
1 1 1 -15 3  31 o 163.7484 4.696483 188.3672  274.2 7.664169       9.392966 0.97 
1 1 1 -15 3  32 o 49.93260 11.46037 109.6098  350.1 22.49716       22.92074 0.86 
1 1 1 -15 3  33 o 29.29441 9.746500 65.46458  111.6 -12.10643      19.49300 0.67 
1 1 1 -15 3  34 o 49.88708 12.71455 81.06155  254.2 -15.50397      25.42910 0.87 
1 1 1 -15 3  35 o 57.08942 13.34821 76.32146  26.5  -20.66173      26.69641 0.88 
1 1 1 -15 3  36 o 51.87428 12.24110 56.07922  112.1 ?              ?        0.84 
1 1 1 -15 5  1  o 288.3223 3.093842 404.6981  71.0  89.59853       6.187685 0.92 
1 1 1 -15 5  2  o 352.3846 3.427581 981.6228  239.7 -19.71439      6.855163 0.96 
1 1 1 -15 5  3  o 178.8888 2.092231 594.2675  102.2 39.61653       4.184463 0.90 
1 1 1 -15 5  4  o 241.6179 2.313613 686.3273  291.6 -26.85857      4.627225 0.94 
1 1 1 -15 5  5  o 251.2270 2.551985 423.6472  42.8  59.67188       5.103970 0.91 
1 1 1 -15 5  6  o 348.4582 3.228379 450.1843  334.5 10.21259       6.456759 0.96 
1 1 1 -15 5  7  f 492.0811 4.166605 615.6230  73.0  81.52148       8.333209 0.00 
1 1 1 -15 5  8  o 261.2267 2.852827 500.2194  27.9  54.75703       5.705653 0.94 
1 1 1 -15 5  9  o 560.7273 4.907614 1041.932  131.7 55.89032       9.815228 0.98 
1 1 1 -15 5  10 o 721.5786 6.083833 1094.082  207.5 7.088257       12.16767 0.99 
1 1 1 -15 5  11 f 413.4163 3.809645 450.7389  203.4 20.91440       7.619289 0.00 
1 1 1 -15 5  12 o 97.03489 3.777422 70.27907  309.6 -77.54402      7.554844 0.34 
1 1 1 -15 5  13 o 810.5760 6.797346 1058.412  320.5 -67.14868      13.59469 0.99 
1 1 1 -15 5  14 o 147.1637 2.608161 174.7332  126.9 38.36039       5.216322 0.49 
1 1 1 -15 5  15 o 468.4178 4.418042 827.5065  72.8  32.98477       8.836084 0.98 
1 1 1 -15 5  16 o 366.7415 3.664232 532.7247  16.0  -3.290436      7.328463 0.97 
1 1 1 -15 5  17 f 553.5034 5.006803 715.8477  359.8 -5.765869      10.01361 0.00 
1 1 1 -15 5  18 o 319.2278 3.470008 494.5242  340.0 -8.233887      6.940015 0.97 
1 1 1 -15 5  19 o 85.99654 3.660969 124.3267  357.1 -33.28296      7.321937 0.64 
1 1 1 -15 5  20 o 305.8689 3.287356 453.1375  241.4 -29.00003      6.574712 0.98 
1 1 1 -15 5  21 o 175.1337 3.033956 197.1933  351.8 -42.99725      6.067911 0.95 
1 1 1 -15 5  22 f 128.4471 3.187807 136.1726  333.2 -9.190819      6.375614 0.00 
1 1 1 -15 5  23 o 39.43037 7.378953 13.31553  207.2 -27.03805      14.75791 0.13 
1 1 1 -15 5  24 o 99.17424 6.098572 201.9128  10.9  ?              ?        0.94 
1 1 1 -15 5  25 o 94.05576 4.511715 83.64086  113.4 -7.403679      9.023430 0.86 
1 1 1 -15 5  26 o 32.32135 8.801708 74.36052  196.2 -11.42048      17.60342 0.54 
1 1 1 -15 5  27 o 47.70594 10.30522 150.1104  239.6 -9.398697      20.61045 0.89 
1 1 1 -15 5  28 o 105.8896 5.551858 96.14273  353.8 9.388290       11.10372 0.93 
1 1 1 -15 5  29 o 32.03757 9.243190 51.00275  216.7 -15.63452      18.48638 0.41 
1 1 1 -15 5  30 o 136.1699 5.176877 184.5108  184.6 -22.35077      10.35375 0.97 
1 1 1 -15 5  31 o 72.81059 8.520096 144.8362  145.5 42.29982       17.04019 0.94 
1 1 1 -15 5  32 o 44.36575 10.95333 37.48461  309.7 -10.22461      21.90667 0.60 
1 1 1 -15 5  33 o 50.34797 9.367419 88.27274  316.2 37.60742       18.73484 0.90 
1 1 1 -15 5  34 o 54.47298 10.37938 120.5887  254.4 -34.80074      20.75876 0.93 
1 1 1 -15 5  35 o 121.5800 6.625612 163.9079  185.5 3.819862       13.25122 0.98 
1 1 1 -15 7  1  o 288.6158 3.852193 407.1909  287.9 ?              ?        0.93 
1 1 1 -15 7  2  o 383.3018 3.568990 425.9855  256.2 37.46930       7.137979 0.97 
1 1 1 -15 7  3  o 459.1443 3.890528 626.2404  192.2 22.63107       7.781057 0.98 
1 1 1 -15 7  4  o 282.9860 2.810667 379.4800  141.7 34.60587       5.621334 0.95 
1 1 1 -15 7  5  o 165.6925 2.450767 228.2791  203.9 23.54816       4.901534 0.84 
1 1 1 -15 7  6  o 228.0538 2.404262 411.0477  192.7 -31.20175      4.808524 0.91 
1 1 1 -15 7  7  o 270.8996 2.832486 485.6422  113.3 19.27661       5.664972 0.96 
1 1 1 -15 7  8  o 364.7488 3.350890 666.4653  243.4 26.79086       6.701780 0.97 
1 1 1 -15 7  9  o 394.8064 3.559749 571.1375  219.6 36.26889       7.119498 0.98 
1 1 1 -15 7  10 o 196.9847 2.714823 489.4859  91.7  -52.00027      5.429645 0.92 
1 1 1 -15 7  11 o 282.6084 3.654803 520.5941  39.6  5.310455       7.309606 0.96 
1 1 1 -15 7  12 o 575.1919 5.029718 834.7456  330.5 -11.19330      10.05944 0.99 
1 1 1 -15 7  13 o 293.6198 3.023148 494.3050  201.2 10.93634       6.046295 0.96 
1 1 1 -15 7  14 o 224.7546 2.819355 222.2313  136.2 -45.54565      5.638710 0.89 
1 1 1 -15 7  15 o 228.0159 2.706860 297.2455  177.7 14.04340       5.413719 0.94 
1 1 1 -15 7  16 o 183.6645 2.769859 214.9624  44.3  -31.47792      5.539718 0.91 
1 1 1 -15 7  17 o 171.4075 3.024281 327.0204  139.4 -5.071350      6.048561 0.95 
1 1 1 -15 7  18 o 199.3916 3.166775 358.3239  336.1 28.15044       6.333550 0.97 
1 1 1 -15 7  19 o 173.8046 2.966967 252.7277  270.9 5.461044       5.933935 0.96 
1 1 1 -15 7  20 o 114.8740 3.890780 154.9094  197.6 4.035606       7.781560 0.91 
1 1 1 -15 7  21 o 72.13076 5.020594 80.25086  223.1 13.54727       10.04119 0.73 
1 1 1 -15 7  22 o 124.0998 4.003270 188.0360  335.3 41.00670       8.006539 0.95 
1 1 1 -15 7  23 o 145.7035 3.513081 185.6279  53.6  29.41060       7.026162 0.96 
1 1 1 -15 7  24 o 129.9066 3.846878 248.1079  123.1 -10.19490      7.693757 0.97 
1 1 1 -15 7  25 o 202.1343 3.775216 288.8463  209.7 -0.2925110E-01 7.550432 0.99 
1 1 1 -15 7  26 o 141.2823 4.177232 248.7335  257.9 -14.84552      8.354464 0.98 
1 1 1 -15 7  27 o 111.8649 6.599370 112.3999  5.6   ?              ?        0.94 
1 1 1 -15 7  28 o 54.14717 8.972113 124.8904  160.8 -1.074543      17.94423 0.87 
1 1 1 -15 7  29 o 105.5782 5.301806 172.1247  147.3 -2.566948      10.60361 0.96 
1 1 1 -15 7  30 o 49.19908 11.22649 27.36114  99.2  -14.00769      22.45298 0.49 
1 1 1 -15 7  31 o 76.13553 8.529167 130.5320  18.8  -23.22205      17.05833 0.95 
1 1 1 -15 7  32 o 52.73570 10.80792 4.896164  40.7  -7.851086      21.61584 0.15 
1 1 1 -15 7  33 o 56.32355 10.30987 70.20818  12.2  15.58141       20.61974 0.89 
1 1 1 -15 7  34 o 40.32699 11.02563 111.1886  123.9 ?              ?        0.91 
1 1 1 -15 9  1  o 133.8110 2.583429 144.8151  110.6 -10.29182      5.166858 0.68 
1 1 1 -15 9  2  o 527.6226 5.791776 876.7800  253.4 -19.89093      11.58355 0.99 
1 1 1 -15 9  3  o 348.5232 3.322142 505.5103  247.2 13.48953       6.644285 0.97 
1 1 1 -15 9  4  o 320.7549 3.461664 561.2217  274.9 47.38757       6.923328 0.97 
1 1 1 -15 9  5  o 170.0151 2.556760 146.5432  170.8 27.73943       5.113520 0.69 
1 1 1 -15 9  6  o 313.3831 3.177386 388.6956  46.7  25.33234       6.354772 0.96 
1 1 1 -15 9  7  o 485.2147 4.200279 756.2552  54.2  -26.16660      8.400558 0.99 
1 1 1 -15 9  8  o 331.4221 4.052412 471.4222  133.9 ?              ?        0.97 
1 1 1 -15 9  9  o 44.53127 7.080800 35.35107  150.1 -14.85711      14.16160 0.13 
1 1 1 -15 9  10 o 267.2232 3.510074 458.3138  298.3 -8.198212      7.020148 0.97 
1 1 1 -15 9  11 o 175.8954 3.802032 241.1101  40.3  -5.886200      7.604065 0.93 
1 1 1 -15 9  12 f 118.0181 4.104918 102.8153  175.5 13.88982       8.209835 0.00 
1 1 1 -15 9  13 o 336.8647 3.922039 471.5346  261.2 -5.372772      7.844077 0.99 
1 1 1 -15 9  14 o 167.6143 2.408830 245.8517  303.9 -3.144608      4.817659 0.96 
1 1 1 -15 9  15 o 183.9163 2.509842 361.5347  229.4 6.910858       5.019683 0.98 
1 1 1 -15 9  16 o 48.88686 5.495816 122.6851  246.2 24.03254       10.99163 0.71 
1 1 1 -15 9  17 o 62.70281 5.462510 162.4448  254.8 -13.15056      10.92502 0.82 
1 1 1 -15 9  18 o 124.1153 3.695452 151.1635  260.9 -25.10101      7.390904 0.93 
1 1 1 -15 9  19 o 174.1980 3.224157 289.8252  251.9 23.37093       6.448315 0.98 
1 1 1 -15 9  20 o 122.0072 4.498510 247.5119  167.1 0.3811646E-01  8.997021 0.97 
1 1 1 -15 9  21 o 85.18567 6.369206 156.2087  63.8  15.13766       12.73841 0.93 
1 1 1 -15 9  22 o 132.0565 4.745122 203.9382  57.8  -6.916687      9.490244 0.97 
1 1 1 -15 9  23 o 274.0990 3.671529 492.5603  145.9 13.19937       7.343059 1.00 
1 1 1 -15 9  24 o 70.03914 7.225283 108.6133  204.5 13.82254       14.45057 0.91 
1 1 1 -15 9  25 f 59.35021 8.460178 181.3445  299.6 4.778091       16.92036 0.00 
1 1 1 -15 9  26 o 42.27689 9.403053 136.3780  195.6 -23.47946      18.80611 0.85 
1 1 1 -15 9  27 o 48.30075 12.67935 40.12981  294.3 -46.18928      25.35871 0.55 
1 1 1 -15 9  28 o 74.61909 8.254103 146.9496  271.5 -6.263809      16.50821 0.95 
1 1 1 -15 9  29 o 62.95070 9.534089 91.75803  110.3 -0.5685120     19.06818 0.92 
1 1 1 -15 9  30 o 74.76449 8.727941 110.9099  169.0 -20.74294      17.45588 0.95 
1 1 1 -15 9  31 o 68.56835 15.64605 99.82846  191.0 ?              ?        0.92 
1 1 1 -15 9  32 o 38.67689 10.77328 48.33046  171.3 ?              ?        0.77 
1 1 1 -15 11 1  o 199.2858 3.163794 506.8719  158.5 16.85783       6.327589 0.99 
1 1 1 -15 11 2  o 85.88105 3.962257 138.4932  76.7  -4.151428      7.924515 0.85 
1 1 1 -15 11 3  o 87.93987 3.430580 199.9613  100.0 4.985779       6.861160 0.91 
1 1 1 -15 11 4  o 76.12645 4.592432 81.59185  270.3 -0.8127594E-01 9.184864 0.75 
1 1 1 -15 11 5  o 161.4984 2.769023 271.5103  133.7 52.02011       5.538046 0.97 
1 1 1 -15 11 6  o 193.3521 3.450092 341.8672  110.0 ?              ?        0.98 
1 1 1 -15 11 7  o 80.16562 4.041224 31.57839  355.6 22.15218       8.082449 0.34 
1 1 1 -15 11 8  f 110.6705 3.344259 247.8560  199.2 13.68449       6.688517 0.00 
1 1 1 -15 11 9  o 77.45514 6.649284 81.45805  270.7 -22.00359      13.29857 0.75 
1 1 1 -15 11 10 o 85.09361 5.692276 95.61839  35.6  -9.523285      11.38455 0.79 
1 1 1 -15 11 11 o 130.8294 4.242220 183.7693  91.3  -25.92249      8.484440 0.94 
1 1 1 -15 11 12 o 140.1897 4.722064 337.4402  144.5 24.58703       9.444127 0.97 
1 1 1 -15 11 13 o 104.4664 6.348948 146.0722  288.1 -26.63781      12.69790 0.92 
1 1 1 -15 11 14 o 197.2459 4.662595 372.4656  83.7  -40.67285      9.325190 0.99 
1 1 1 -15 11 15 f 134.7113 6.175888 280.6813  56.1  4.628647       12.35178 0.00 
1 1 1 -15 11 16 o 108.8765 6.852488 205.1476  85.9  4.971535       13.70498 0.96 
1 1 1 -15 11 17 o 63.13180 11.49562 63.64744  229.0 7.637890       22.99125 0.73 
1 1 1 -15 11 18 o 74.93732 10.19700 91.42651  309.2 -58.78896      20.39399 0.88 
1 1 1 -15 11 19 f 108.2871 8.222602 212.6885  19.8  -17.43879      16.44520 0.00 
1 1 1 -15 11 20 o 39.79057 11.95735 64.51123  299.9 -3.249542      23.91469 0.69 
1 1 1 -15 11 21 o 98.44332 8.764026 203.4758  260.7 ?              ?        0.96 
1 1 1 -15 11 22 o 66.83613 11.04549 180.2357  288.7 ?              ?        0.93 
1 1 1 -15 11 23 o 70.11671 6.795191 55.58120  326.7 -7.905121      13.59038 0.80 
1 1 1 -15 11 24 o 123.7501 5.321832 216.5289  76.4  -2.268547      10.64366 0.98 
1 1 1 -15 11 25 o 51.29888 11.48138 84.88740  41.7  9.574417       22.96277 0.86 
1 1 1 -15 11 26 o 77.98215 11.90322 129.4945  294.0 -16.14725      23.80644 0.95 
1 1 1 -15 11 27 o 41.24265 11.78802 21.02239  267.7 15.88624       23.57605 0.45 
1 1 1 -15 11 28 o 59.10093 12.37517 90.34307  50.2  -10.75642      24.75035 0.91 
1 1 1 -15 11 29 o 27.77158 9.377988 71.76942  5.1   6.136488       18.75598 0.80 
1 1 1 -15 11 30 o 78.38654 10.10158 143.9372  300.8 ?              ?        0.97 
1 1 1 -15 13 1  o 77.73419 5.666987 87.43577  88.0  1.617813       11.33397 0.87 
1 1 1 -15 13 2  o 129.9222 3.866553 257.7792  262.4 27.63431       7.733106 0.98 
1 1 1 -15 13 3  o 66.72025 7.011209 163.7289  272.5 -1.381355      14.02242 0.92 
1 1 1 -15 13 4  o 141.4778 3.122221 168.5844  85.3  19.44774       6.244441 0.97 
1 1 1 -15 13 5  o 119.4380 3.587644 207.2967  117.1 -20.27605      7.175287 0.97 
1 1 1 -15 13 6  o 183.9865 3.277405 322.0333  160.5 15.66075       6.554811 0.99 
1 1 1 -15 13 7  o 91.28197 4.942367 199.8891  135.7 -31.05191      9.884734 0.96 
1 1 1 -15 13 8  o 184.6349 3.164562 221.8357  18.1  42.32855       6.329123 0.98 
1 1 1 -15 13 9  o 150.5809 3.289455 186.2249  23.4  33.02295       6.578910 0.97 
1 1 1 -15 13 10 o 90.77217 9.275534 86.69780  284.7 -19.95568      18.55107 0.90 
1 1 1 -15 13 11 o 104.1240 6.987303 181.4782  233.3 8.592102       13.97461 0.96 
1 1 1 -15 13 12 o 170.2326 5.155930 354.8453  115.1 -17.67947      10.31186 0.99 
1 1 1 -15 13 13 o 162.6045 4.727612 275.1738  44.2  26.44536       9.455223 0.99 
1 1 1 -15 13 14 o 151.2444 6.569118 296.0097  298.6 10.92574       13.13824 0.99 
1 1 1 -15 13 15 o 217.9473 6.611219 415.7651  221.6 ?              ?        0.99 
1 1 1 -15 13 16 o 148.3725 6.591251 258.4830  196.0 -12.96141      13.18250 0.98 
1 1 1 -15 13 17 o 108.4268 8.763703 177.0167  70.7  -7.523224      17.52741 0.96 
1 1 1 -15 13 18 o 47.04897 20.14186 58.38754  108.7 ?              ?        0.57 
1 1 1 -15 13 19 o 71.64991 13.75318 140.2290  0.1   11.02936       27.50636 0.92 
1 1 1 -15 13 20 o 59.72578 22.82198 186.4225  338.0 ?              ?        0.91 
1 1 1 -15 13 21 o 82.79515 13.55830 111.6025  33.6  2.946640       27.11661 0.94 
1 1 1 -15 13 22 o 89.93405 13.02312 172.5294  55.9  -25.45848      26.04625 0.97 
1 1 1 -15 13 23 o 66.03108 23.10107 136.8409  308.9 ?              ?        0.91 
1 1 1 -15 13 24 o 71.89447 12.68702 175.8756  3.5   -42.98309      25.37404 0.96 
1 1 1 -15 13 25 o 54.87325 14.73208 99.84637  34.3  38.39941       29.46416 0.91 
1 1 1 -15 13 26 o 44.36371 12.93555 66.61334  16.6  ?              ?        0.85 
1 1 1 -15 13 27 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -15 15 1  o 145.0500 4.370992 222.7026  4.3   18.31172       8.741983 0.98 
1 1 1 -15 15 2  o 133.2938 4.633667 215.8758  349.8 2.195190       9.267335 0.98 
1 1 1 -15 15 3  o 108.6729 4.823414 190.7800  318.0 19.54872       9.646829 0.97 
1 1 1 -15 15 4  f 188.9306 3.731817 319.6428  54.7  15.60904       7.463633 0.00 
1 1 1 -15 15 5  o 165.6840 3.470668 255.9570  62.0  15.05881       6.941336 0.98 
1 1 1 -15 15 6  o 30.25343 9.108820 45.91484  162.4 20.74519       18.21764 0.44 
1 1 1 -15 15 7  o 41.43532 9.929976 114.9859  0.2   10.08582       19.85995 0.83 
1 1 1 -15 15 8  o 91.09156 6.697754 208.1996  351.7 -31.01938      13.39551 0.97 
1 1 1 -15 15 9  o 48.25208 9.755680 41.71832  311.9 11.66599       19.51136 0.60 
1 1 1 -15 15 10 o 91.09442 11.38951 191.1583  32.7  -72.04057      22.77901 0.96 
1 1 1 -15 15 11 o 37.13923 10.41012 60.08751  240.4 -1.281853      20.82024 0.65 
1 1 1 -15 15 12 o 61.40833 10.83333 139.0619  182.7 -21.47091      21.66666 0.93 
1 1 1 -15 15 13 o 60.34762 11.99422 62.78623  170.5 0.5152206      23.98844 0.83 
1 1 1 -15 15 14 o 34.32195 11.32014 17.98497  208.3 10.47522       22.64028 0.28 
1 1 1 -15 15 15 o 41.12838 12.60287 53.04942  49.1  7.939732       25.20574 0.72 
1 1 1 -15 15 16 o 55.56875 13.58047 87.42334  231.2 51.27824       27.16094 0.89 
1 1 1 -15 15 17 o 50.32932 13.84165 78.47425  238.8 36.46830       27.68329 0.87 
1 1 1 -15 15 18 o 71.10406 24.51475 47.40156  176.7 ?              ?        0.69 
1 1 1 -15 15 19 o 45.03747 20.60153 76.98650  303.5 ?              ?        0.76 
1 1 1 -15 15 20 o 36.98692 11.83082 53.10715  239.9 1.884548       23.66165 0.76 
1 1 1 -15 15 21 o 42.10472 19.93505 78.41045  100.9 ?              ?        0.77 
1 1 1 -15 15 22 o 46.66989 13.53454 114.6884  90.9  ?              ?        0.92 
1 1 1 -15 17 1  o 145.3931 5.462862 272.4896  144.6 0.5518341      10.92572 0.99 
1 1 1 -15 17 2  o 129.9616 5.409058 225.6437  147.3 19.46452       10.81812 0.99 
1 1 1 -15 17 3  o 90.03777 7.246360 142.2603  55.7  31.49286       14.49272 0.98 
1 1 1 -15 17 4  o 49.49960 12.94024 96.78700  69.3  17.97055       25.88048 0.91 
1 1 1 -15 17 5  o 40.37777 8.862953 38.26597  101.2 -14.70536      17.72591 0.75 
1 1 1 -15 17 6  o 41.85738 9.427478 73.89729  200.4 -17.94209      18.85496 0.88 
1 1 1 -15 17 7  o 76.14522 8.221716 99.59971  105.3 -15.89283      16.44343 0.96 
1 1 1 -15 17 8  o 27.97747 8.261404 82.99064  122.6 -11.37726      16.52281 0.85 
1 1 1 -15 17 9  o 46.54939 10.50568 32.43184  150.3 20.31770       21.01135 0.71 
1 1 1 -15 17 10 o 49.07877 9.924886 81.62246  56.8  -8.742599      19.84977 0.91 
1 1 1 -15 17 11 o 59.42947 11.45839 171.6505  303.6 -20.10538      22.91678 0.96 
1 1 1 -15 17 12 o 70.02071 12.97839 45.14915  254.1 43.96521       25.95677 0.85 
1 1 1 -15 17 13 o 94.44733 13.49133 168.0830  85.6  -45.21371      26.98267 0.97 
1 1 1 -15 17 14 o 34.39837 11.79475 22.53555  55.3  ?              ?        0.47 
1 1 1 -15 17 15 o 40.25443 11.63421 99.68279  251.2 ?              ?        0.91 
1 1 1 -14 0  1  o 253.3733 4.637203 341.3251  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  2  o 144.1078 3.832683 406.2226  0.0   -0.000000      0.000000 0.99 
1 1 1 -14 0  3  o 700.5242 9.628264 1168.938  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  4  o 561.9437 7.885809 2048.607  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  5  o 236.5997 4.665545 161.8592  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  6  o 258.8947 4.572454 135.7598  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  7  o 222.6772 4.277440 526.1843  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  8  o 398.5888 5.804605 697.5354  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  9  o 284.8835 4.717307 9.090839  180.0 -0.000000      0.000000 0.92 
1 1 1 -14 0  10 o 105.2102 3.900511 571.3454  0.0   -0.000000      0.000000 0.73 
1 1 1 -14 0  11 o 480.0996 6.635225 675.0369  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  12 o 552.8920 7.403041 865.8505  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  13 o 19.30849 9.755937 205.6166  360.0 -0.000000      0.000000 0.04 
1 1 1 -14 0  14 x ?        ?        549.1556  0.0   ?              ?        0.00 
1 1 1 -14 0  15 o 320.6265 4.884916 668.0610  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  16 o 618.9183 8.021997 883.0228  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  17 o 269.5572 4.556421 86.57178  180.0 -0.000000      0.000000 0.77 
1 1 1 -14 0  18 o 399.6778 5.833331 779.2394  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  19 o 539.4879 6.960027 925.1223  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  20 o 120.4166 4.594108 128.0143  180.0 -0.000000      0.000000 0.51 
1 1 1 -14 0  21 o 289.8345 4.790248 266.4442  360.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  22 o 287.5217 4.673919 544.3427  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  23 o 248.2699 4.732824 525.4799  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  24 o 125.7474 4.825270 200.4583  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  25 o 280.1975 5.050871 341.9620  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  26 o 51.95615 20.96969 199.0850  0.0   -0.000000      0.000000 0.96 
1 1 1 -14 0  27 o 68.33790 9.818645 68.89856  0.0   -0.000000      0.000000 0.82 
1 1 1 -14 0  28 o 63.30636 11.45165 61.15996  180.0 -0.000000      0.000000 0.78 
1 1 1 -14 0  29 o 37.40255 16.80210 108.7058  360.0 -0.000000      0.000000 0.88 
1 1 1 -14 0  30 o 29.50686 17.36735 49.53463  0.0   -0.000000      0.000000 0.41 
1 1 1 -14 0  31 o 92.41826 11.14511 103.3928  180.0 -0.000000      0.000000 0.99 
1 1 1 -14 0  32 o 85.15575 11.50257 123.5759  0.0   -0.000000      0.000000 1.00 
1 1 1 -14 0  33 o 137.1173 8.566548 163.9646  360.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  34 o 17.97331 12.92124 13.45886  180.0 -0.000000      0.000000 0.13 
1 1 1 -14 0  35 o 33.65818 19.85793 2.678644  180.0 -0.000000      0.000000 0.04 
1 1 1 -14 0  36 o 123.9501 12.35024 123.5201  180.0 -0.000000      0.000000 1.00 
1 1 1 -14 0  37 o 20.82346 14.99713 6.742413  360.0 ?              ?        0.10 
1 1 1 -14 2  1  o 164.2563 2.178631 813.0790  24.1  20.78806       4.357261 0.89 
1 1 1 -14 2  2  o 438.3654 4.205085 1564.712  254.5 27.27707       8.410171 0.97 
1 1 1 -14 2  3  o 325.5700 3.862991 904.5206  125.4 47.79468       7.725983 0.97 
1 1 1 -14 2  4  o 308.0759 3.561006 658.3263  120.8 18.55130       7.122012 0.96 
1 1 1 -14 2  5  o 403.6876 4.245054 1125.911  287.6 -12.39124      8.490108 0.98 
1 1 1 -14 2  6  o 179.8035 2.468359 504.9994  324.7 62.00940       4.936718 0.90 
1 1 1 -14 2  7  o 411.4030 4.126853 906.6369  202.8 52.86737       8.253706 0.98 
1 1 1 -14 2  8  o 314.8384 3.391813 842.5580  74.4  -58.19861      6.783625 0.97 
1 1 1 -14 2  9  o 291.5277 3.179013 595.1594  112.2 59.63223       6.358026 0.95 
1 1 1 -14 2  10 o 183.6462 3.284170 15.97232  206.6 -28.75839      6.568341 0.88 
1 1 1 -14 2  11 o 114.6186 2.286155 139.3669  202.4 58.25414       4.572311 0.13 
1 1 1 -14 2  12 o 312.0575 3.267211 756.2009  261.2 43.50015       6.534422 0.96 
1 1 1 -14 2  13 o 811.9299 6.929129 1341.332  289.3 6.782837       13.85826 0.99 
1 1 1 -14 2  14 o 496.9971 4.549652 762.5500  144.8 -4.118652      9.099303 0.98 
1 1 1 -14 2  15 o 630.1547 5.573328 859.4481  181.3 22.34296       11.14666 0.99 
1 1 1 -14 2  16 o 272.9550 3.040201 500.2874  167.2 -28.20700      6.080403 0.94 
1 1 1 -14 2  17 o 678.4858 5.956085 719.2457  95.3  -54.80774      11.91217 0.99 
1 1 1 -14 2  18 o 134.7562 3.317383 71.73299  163.8 83.99831       6.634765 0.21 
1 1 1 -14 2  19 o 767.9691 6.686245 909.1873  219.9 -21.81726      13.37249 0.99 
1 1 1 -14 2  20 o 278.5964 4.009940 453.2722  213.0 46.07233       8.019879 0.96 
1 1 1 -14 2  21 o 230.6469 4.319054 253.7807  257.9 ?              ?        0.94 
1 1 1 -14 2  22 o 271.6125 3.252987 495.2180  217.2 -15.09705      6.505974 0.98 
1 1 1 -14 2  23 o 155.6857 3.249945 268.0962  345.8 -30.84595      6.499889 0.96 
1 1 1 -14 2  24 o 133.8476 4.321778 93.33287  326.4 -57.96188      8.643557 0.86 
1 1 1 -14 2  25 o 226.3162 3.545367 314.7975  281.9 38.06255       7.090733 0.98 
1 1 1 -14 2  26 o 149.2339 3.595407 165.1915  156.2 -6.141052      7.190814 0.95 
1 1 1 -14 2  27 o 143.9179 4.724020 144.6046  97.3  5.835785       9.448040 0.95 
1 1 1 -14 2  28 o 194.9657 3.778186 199.6371  70.6  -31.31902      7.556371 0.98 
1 1 1 -14 2  29 o 101.9326 5.764430 79.32484  133.3 -39.49050      11.52886 0.92 
1 1 1 -14 2  30 o 114.7878 6.297529 183.9971  152.5 11.64694       12.59506 0.96 
1 1 1 -14 2  31 o 123.4104 9.008996 144.0843  170.7 ?              ?        0.95 
1 1 1 -14 2  32 o 45.43140 12.21271 38.90235  14.6  -2.871254      24.42542 0.49 
1 1 1 -14 2  33 o 39.65774 11.33176 46.38759  355.5 16.63697       22.66352 0.61 
1 1 1 -14 2  34 o 96.65489 9.015814 137.5660  194.4 -8.913467      18.03163 0.97 
1 1 1 -14 2  35 o 77.40839 10.39405 111.5673  273.0 20.01713       20.78810 0.95 
1 1 1 -14 2  36 o 36.16735 10.80510 65.07436  55.2  23.89993       21.61020 0.80 
1 1 1 -14 4  1  o 108.8295 1.888192 279.6480  214.3 -49.18359      3.776384 0.30 
1 1 1 -14 4  2  o 163.4926 1.977458 283.2110  139.3 -21.36952      3.954917 0.86 
1 1 1 -14 4  3  o 60.23798 2.264127 223.2272  239.0 21.40779       4.528254 0.61 
1 1 1 -14 4  4  o 529.8341 4.485968 1016.182  125.5 0.1940918E-01  8.971935 0.99 
1 1 1 -14 4  5  o 348.4070 4.901539 291.6599  109.0 ?              ?        0.92 
1 1 1 -14 4  6  o 255.3715 2.788709 387.5869  103.0 42.03911       5.577417 0.94 
1 1 1 -14 4  7  o 566.8477 5.086337 854.1133  354.7 62.33063       10.17267 0.98 
1 1 1 -14 4  8  f 243.2847 2.867635 644.4758  199.8 -17.71185      5.735270 0.00 
1 1 1 -14 4  9  o 272.4487 2.899463 426.1780  48.0  69.08763       5.798927 0.87 
1 1 1 -14 4  10 o 315.6320 3.385033 530.7135  226.5 26.17325       6.770066 0.94 
1 1 1 -14 4  11 o 158.2361 2.236047 292.7805  208.2 7.018005       4.472094 0.77 
1 1 1 -14 4  12 o 624.8855 6.514551 794.7253  242.8 -48.31586      13.02910 0.99 
1 1 1 -14 4  13 o 288.3605 3.103773 775.4937  279.8 -42.71106      6.207546 0.96 
1 1 1 -14 4  14 o 253.8018 2.774696 268.2390  222.7 14.07697       5.549391 0.91 
1 1 1 -14 4  15 o 768.0167 7.699962 1103.427  154.2 -15.49316      15.39992 0.99 
1 1 1 -14 4  16 o 159.6245 2.546627 221.0842  57.6  36.98190       5.093255 0.79 
1 1 1 -14 4  17 o 327.0016 3.491691 501.0791  246.5 -4.926880      6.983383 0.96 
1 1 1 -14 4  18 o 327.5948 3.474977 465.0885  283.3 2.172058       6.949954 0.96 
1 1 1 -14 4  19 o 111.1898 3.739609 217.7902  53.6  8.999229       7.479218 0.81 
1 1 1 -14 4  20 o 111.5562 3.324876 196.6549  14.6  -7.876419      6.649751 0.84 
1 1 1 -14 4  21 o 46.57105 6.666654 137.6944  288.3 -37.41778      13.33331 0.61 
1 1 1 -14 4  22 o 108.8112 3.809335 147.9739  321.6 -19.14869      7.618670 0.87 
1 1 1 -14 4  23 o 146.0398 4.415753 193.7169  295.2 1.141266       8.831506 0.94 
1 1 1 -14 4  24 o 106.4788 4.507712 193.6729  278.4 21.06538       9.015424 0.93 
1 1 1 -14 4  25 o 95.58678 4.891044 92.38503  91.7  4.177055       9.782088 0.86 
1 1 1 -14 4  26 o 58.14188 8.770035 53.89074  147.8 11.15739       17.54007 0.61 
1 1 1 -14 4  27 o 164.3372 3.791221 228.8326  358.6 -9.073730      7.582442 0.98 
1 1 1 -14 4  28 o 167.9727 4.080876 216.9895  357.7 10.60800       8.161753 0.98 
1 1 1 -14 4  29 o 104.6010 5.446848 166.6283  186.0 -12.27790      10.89370 0.96 
1 1 1 -14 4  30 o 37.36881 10.20374 90.06808  131.9 -25.85157      20.40749 0.68 
1 1 1 -14 4  31 o 151.7604 5.059346 157.6597  337.9 -0.5775909     10.11869 0.97 
1 1 1 -14 4  32 o 145.3412 5.297275 190.3758  92.6  22.13910       10.59455 0.98 
1 1 1 -14 4  33 o 51.81525 11.61503 99.42077  139.7 -14.87974      23.23006 0.90 
1 1 1 -14 4  34 o 82.75703 9.078340 104.4321  346.7 27.77329       18.15668 0.95 
1 1 1 -14 4  35 o 85.49654 10.04516 87.59637  256.1 7.635414       20.09031 0.94 
1 1 1 -14 4  36 o 76.84705 11.92001 116.9187  228.4 ?              ?        0.96 
1 1 1 -14 6  1  o 502.3123 4.419394 570.7794  306.2 10.88623       8.838789 0.98 
1 1 1 -14 6  2  o 583.6851 4.947366 835.3871  317.0 29.41254       9.894732 0.99 
1 1 1 -14 6  3  o 300.4960 2.921167 547.1501  188.4 -20.28720      5.842334 0.95 
1 1 1 -14 6  4  o 190.6631 2.249797 320.3312  245.6 12.11861       4.499594 0.86 
1 1 1 -14 6  5  o 147.7258 2.256620 157.6279  284.6 0.8419495      4.513240 0.71 
1 1 1 -14 6  6  o 330.1012 3.055575 642.5239  69.2  -9.041443      6.111150 0.96 
1 1 1 -14 6  7  o 695.7793 5.487098 1065.173  11.6  50.73633       10.97420 0.99 
1 1 1 -14 6  8  o 513.7678 4.198360 831.5712  302.8 -57.56750      8.396720 0.98 
1 1 1 -14 6  9  o 109.0009 2.299806 291.6242  127.6 24.55550       4.599612 0.74 
1 1 1 -14 6  10 o 840.6853 6.963122 1015.952  248.8 39.28168       13.92624 0.99 
1 1 1 -14 6  11 o 247.6164 2.997519 266.4814  198.2 0.2124939      5.995038 0.90 
1 1 1 -14 6  12 o 338.5722 3.286471 495.7675  119.3 55.04233       6.572942 0.96 
1 1 1 -14 6  13 o 233.3483 2.755213 420.4027  59.7  39.53276       5.510426 0.93 
1 1 1 -14 6  14 o 205.5119 2.774191 250.2198  158.7 -17.54597      5.548381 0.86 
1 1 1 -14 6  15 o 196.9436 2.735742 243.9111  357.6 -22.45001      5.471485 0.87 
1 1 1 -14 6  16 o 345.6712 3.662752 569.7277  17.8  -45.07452      7.325503 0.97 
1 1 1 -14 6  17 o 378.0475 3.923210 561.6614  11.6  14.23309       7.846420 0.98 
1 1 1 -14 6  18 o 242.7969 3.005421 443.4799  5.7   12.87787       6.010842 0.97 
1 1 1 -14 6  19 o 148.4648 3.174838 184.7632  232.7 12.60606       6.349676 0.91 
1 1 1 -14 6  20 o 129.9610 3.315408 150.9272  196.2 3.760483       6.630816 0.91 
1 1 1 -14 6  21 o 177.6621 3.059556 207.5639  81.1  -20.71494      6.119113 0.95 
1 1 1 -14 6  22 o 84.87573 4.247470 123.5451  137.2 9.335297       8.494941 0.86 
1 1 1 -14 6  23 o 102.7443 3.601230 139.1709  338.6 -30.68490      7.202459 0.91 
1 1 1 -14 6  24 o 154.4106 3.457945 206.0428  94.9  5.148392       6.915890 0.97 
1 1 1 -14 6  25 o 177.1178 3.495610 234.6622  106.9 12.15515       6.991220 0.98 
1 1 1 -14 6  26 o 40.50253 8.481603 102.2039  138.6 -16.10476      16.96321 0.79 
1 1 1 -14 6  27 o 67.08896 7.049984 129.3561  287.0 -27.68289      14.09997 0.93 
1 1 1 -14 6  28 o 60.76323 8.511626 33.03462  71.2  10.59666       17.02325 0.51 
1 1 1 -14 6  29 o 119.4922 4.560790 124.5021  182.3 -11.03857      9.121579 0.95 
1 1 1 -14 6  30 o 41.06960 9.968768 72.22669  324.7 -16.79532      19.93754 0.71 
1 1 1 -14 6  31 o 41.30500 10.19608 30.59682  40.7  19.64182       20.39217 0.49 
1 1 1 -14 6  32 o 93.78972 7.003619 146.3685  133.4 11.18584       14.00724 0.97 
1 1 1 -14 6  33 o 45.91283 10.85181 97.83781  70.7  25.57030       21.70362 0.90 
1 1 1 -14 6  34 o 43.52099 11.33776 44.27868  308.2 -14.70333      22.67551 0.74 
1 1 1 -14 6  35 o 44.69262 11.66938 40.57685  122.1 ?              ?        0.76 
1 1 1 -14 8  1  o 525.8916 4.853970 758.3026  36.9  27.79327       9.707939 0.98 
1 1 1 -14 8  2  o 618.6873 5.051569 873.6143  85.6  75.59381       10.10314 0.99 
1 1 1 -14 8  3  o 185.2712 2.569641 289.9028  225.5 -15.51631      5.139283 0.88 
1 1 1 -14 8  4  o 202.8864 2.321767 85.26205  50.9  -18.89662      4.643535 0.59 
1 1 1 -14 8  5  f 417.9117 3.598210 554.8072  103.3 -16.32925      7.196419 0.00 
1 1 1 -14 8  6  o 388.8506 3.484747 663.2442  334.8 -19.08194      6.969494 0.97 
1 1 1 -14 8  7  o 364.0409 3.909754 684.8712  12.1  -31.04083      7.819508 0.98 
1 1 1 -14 8  8  f 367.9513 4.186542 552.7357  91.8  7.974976       8.373084 0.00 
1 1 1 -14 8  9  o 393.0320 4.349469 623.3102  150.9 -31.38104      8.698938 0.98 
1 1 1 -14 8  10 o 133.8494 3.847725 234.9326  115.8 -34.88189      7.695450 0.80 
1 1 1 -14 8  11 o 205.3851 2.427760 409.5736  70.8  -20.19530      4.855520 0.93 
1 1 1 -14 8  12 o 73.56863 3.093073 282.8019  149.8 20.64668       6.186145 0.69 
1 1 1 -14 8  13 o 323.6239 2.953134 596.9664  255.1 14.28705       5.906267 0.98 
1 1 1 -14 8  14 o 402.4504 3.748328 728.7396  6.4   36.84503       7.496656 0.99 
1 1 1 -14 8  15 o 183.7669 2.706839 454.9556  129.4 -75.41316      5.413679 0.97 
1 1 1 -14 8  16 o 114.3622 3.199471 205.1162  160.7 -18.90253      6.398942 0.91 
1 1 1 -14 8  17 o 146.3626 2.946619 170.6033  79.8  11.48311       5.893238 0.93 
1 1 1 -14 8  18 o 135.3215 3.443443 287.3795  29.6  41.78367       6.886886 0.96 
1 1 1 -14 8  19 o 137.1668 3.570321 189.6043  309.4 20.39899       7.140642 0.94 
1 1 1 -14 8  20 o 120.0205 3.670126 234.3306  209.7 6.801666       7.340252 0.95 
1 1 1 -14 8  21 f 144.9056 3.686931 259.5984  254.0 28.16386       7.373862 0.00 
1 1 1 -14 8  22 o 270.2935 4.178463 433.5218  263.0 11.42944       8.356926 0.99 
1 1 1 -14 8  23 o 152.9278 3.693636 198.7242  145.2 -13.61838      7.387271 0.97 
1 1 1 -14 8  24 o 200.7695 3.561863 337.9509  178.9 -18.98032      7.123725 0.99 
1 1 1 -14 8  25 o 104.8986 5.577527 136.0960  281.6 27.14713       11.15505 0.96 
1 1 1 -14 8  26 o 75.41196 6.541211 113.4866  138.5 -23.17497      13.08242 0.90 
1 1 1 -14 8  27 o 56.70959 8.254280 116.7512  117.9 -56.70446      16.50856 0.87 
1 1 1 -14 8  28 o 83.97659 6.569286 143.4474  294.0 41.90608       13.13857 0.94 
1 1 1 -14 8  29 o 30.54151 13.80278 48.59701  150.5 ?              ?        0.50 
1 1 1 -14 8  30 o 101.6281 6.145194 160.7087  29.8  10.50731       12.29039 0.97 
1 1 1 -14 8  31 o 82.35098 7.287580 114.5704  16.4  -7.857819      14.57516 0.96 
1 1 1 -14 8  32 o 65.78360 9.226365 104.6263  201.4 20.17645       18.45273 0.94 
1 1 1 -14 8  33 o 33.70844 10.67558 35.19404  209.9 ?              ?        0.62 
1 1 1 -14 10 1  o 412.5008 5.397612 599.4576  97.3  3.643677       10.79522 0.99 
1 1 1 -14 10 2  o 240.5978 3.005883 422.5489  47.8  7.999817       6.011767 0.97 
1 1 1 -14 10 3  o 455.5253 4.007130 865.7183  148.1 -9.223206      8.014260 0.99 
1 1 1 -14 10 4  o 268.5747 3.543535 371.2924  148.5 ?              ?        0.97 
1 1 1 -14 10 5  o 326.3866 4.239102 469.1053  161.2 -5.670105      8.478205 0.98 
1 1 1 -14 10 6  o 60.60406 4.879028 169.5292  147.5 -8.000854      9.758056 0.70 
1 1 1 -14 10 7  o 212.0664 3.292441 353.4218  86.5  -20.60408      6.584882 0.96 
1 1 1 -14 10 8  o 213.1792 2.825208 393.0741  201.6 18.59576       5.650417 0.97 
1 1 1 -14 10 9  o 126.5557 3.978984 115.5452  260.8 25.80830       7.957969 0.84 
1 1 1 -14 10 10 o 189.3662 3.465035 268.9431  287.7 -21.13287      6.930070 0.96 
1 1 1 -14 10 11 o 219.0464 3.998117 339.7867  307.3 -15.26183      7.996234 0.98 
1 1 1 -14 10 12 o 178.2275 3.741071 297.1980  302.5 -3.279297      7.482142 0.97 
1 1 1 -14 10 13 o 199.0747 3.940203 408.8436  283.8 -23.42505      7.880407 0.98 
1 1 1 -14 10 14 o 142.3181 5.337846 274.3960  73.8  -30.25159      10.67569 0.96 
1 1 1 -14 10 15 o 138.1144 5.468424 210.2368  167.1 -22.03324      10.93685 0.95 
1 1 1 -14 10 16 o 166.2334 5.232642 296.1579  247.4 -7.728195      10.46528 0.98 
1 1 1 -14 10 17 o 92.12138 9.957649 179.5915  289.2 -34.89370      19.91530 0.93 
1 1 1 -14 10 18 o 107.7343 8.858939 214.1451  13.5  -49.68563      17.71788 0.96 
1 1 1 -14 10 19 o 206.8265 2.933893 371.9795  319.2 -7.998917      5.867787 0.99 
1 1 1 -14 10 20 o 192.8133 3.326160 417.8328  269.2 -10.06754      6.652320 0.99 
1 1 1 -14 10 21 o 49.46504 9.767486 108.6403  310.6 -2.259228      19.53497 0.86 
1 1 1 -14 10 22 o 175.7008 4.210529 300.0526  350.0 -26.27483      8.421058 0.99 
1 1 1 -14 10 23 f 83.08092 6.434557 118.7855  278.9 15.63010       12.86911 0.00 
1 1 1 -14 10 24 o 170.5599 5.308634 297.7428  36.9  -28.75804      10.61727 0.99 
1 1 1 -14 10 25 o 67.72351 9.324400 110.5082  77.5  18.38625       18.64880 0.90 
1 1 1 -14 10 26 o 44.64135 10.67490 1.439157  228.4 -11.92422      21.34979 0.03 
1 1 1 -14 10 27 o 153.0581 4.592527 246.9462  6.9   -6.189758      9.185055 0.99 
1 1 1 -14 10 28 o 136.4363 5.417148 220.7616  24.7  -1.864761      10.83430 0.99 
1 1 1 -14 10 29 o 93.75737 6.755711 136.5221  52.0  0.9540482      13.51142 0.97 
1 1 1 -14 10 30 o 36.80457 10.71411 41.68307  70.1  -12.42285      21.42822 0.69 
1 1 1 -14 10 31 o 40.72705 11.12067 72.55499  280.2 ?              ?        0.87 
1 1 1 -14 12 1  o 128.8951 3.390411 232.2748  14.6  -23.45875      6.780822 0.95 
1 1 1 -14 12 2  o 129.6516 3.364365 236.9888  108.4 20.35325       6.728730 0.96 
1 1 1 -14 12 3  o 212.7331 3.354345 352.8773  280.7 -12.08516      6.708690 0.98 
1 1 1 -14 12 4  o 170.0971 3.439314 288.0702  269.0 0.9413300      6.878628 0.97 
1 1 1 -14 12 5  o 296.0576 3.245035 567.4127  117.7 18.47571       6.490069 0.99 
1 1 1 -14 12 6  o 227.4383 3.024042 413.0992  108.6 27.36049       6.048084 0.99 
1 1 1 -14 12 7  o 90.94738 4.407221 160.1788  165.6 -18.33607      8.814442 0.91 
1 1 1 -14 12 8  o 145.5074 3.085788 270.2451  6.5   19.79091       6.171576 0.97 
1 1 1 -14 12 9  o 186.0575 4.212073 300.6189  24.4  10.98462       8.424146 0.98 
1 1 1 -14 12 10 o 93.07066 6.329895 210.0775  65.5  -7.774796      12.65979 0.95 
1 1 1 -14 12 11 o 214.5798 4.424307 345.7595  179.5 -16.99838      8.848615 0.99 
1 1 1 -14 12 12 o 75.88236 9.129871 172.0172  237.6 -37.74466      18.25974 0.93 
1 1 1 -14 12 13 o 101.0788 8.824425 178.4508  89.0  -17.69920      17.64885 0.95 
1 1 1 -14 12 14 f 83.80580 8.314175 185.1773  120.1 10.75335       16.62835 0.00 
1 1 1 -14 12 15 o 123.0603 6.654495 244.9876  207.4 -6.309662      13.30899 0.98 
1 1 1 -14 12 16 o 71.06241 11.20405 120.5885  110.6 -19.53936      22.40810 0.92 
1 1 1 -14 12 17 o 104.1628 9.432010 224.0291  339.7 -15.84184      18.86402 0.98 
1 1 1 -14 12 18 o 143.2475 7.548435 243.7080  298.1 6.022202       15.09687 0.98 
1 1 1 -14 12 19 f 122.3220 9.105766 240.7693  29.8  -17.39781      18.21153 0.00 
1 1 1 -14 12 20 o 95.24480 9.634289 130.2051  60.9  19.40041       19.26858 0.94 
1 1 1 -14 12 21 o 58.54103 22.66965 78.72855  18.8  ?              ?        0.72 
1 1 1 -14 12 22 o 61.25952 14.31949 38.34065  34.3  42.56274       28.63899 0.63 
1 1 1 -14 12 23 o 171.5706 8.709176 308.5924  168.4 -49.66046      17.41835 0.99 
1 1 1 -14 12 24 o 49.85358 21.80702 125.2501  194.2 ?              ?        0.86 
1 1 1 -14 12 25 o 51.98586 13.51323 57.61599  45.4  -12.46774      27.02646 0.83 
1 1 1 -14 12 26 o 69.67915 12.99323 98.06148  25.1  ?              ?        0.93 
1 1 1 -14 12 27 o 23.49966 11.57706 18.45653  67.2  ?              ?        0.26 
1 1 1 -14 12 28 o 77.27943 10.44572 122.6871  48.1  ?              ?        0.96 
1 1 1 -14 14 1  o 110.5482 5.750278 216.7902  44.7  0.8124313      11.50056 0.98 
1 1 1 -14 14 2  o 185.8677 3.845290 232.0421  72.6  16.48300       7.690581 0.99 
1 1 1 -14 14 3  o 126.5950 3.948880 172.2924  116.5 7.503204       7.897759 0.97 
1 1 1 -14 14 4  o 29.75175 8.286280 41.33335  44.1  10.61639       16.57256 0.46 
1 1 1 -14 14 5  o 69.20235 6.679039 138.5809  332.3 -10.06966      13.35808 0.94 
1 1 1 -14 14 6  o 106.5318 4.176158 219.2230  136.7 2.165474       8.352317 0.98 
1 1 1 -14 14 7  o 282.2047 3.363470 442.3038  102.2 1.095947       6.726941 1.00 
1 1 1 -14 14 8  o 90.70013 5.272849 98.04554  140.1 2.717148       10.54570 0.94 
1 1 1 -14 14 9  o 177.1940 3.039458 377.5739  223.3 24.80737       6.078915 0.99 
1 1 1 -14 14 10 o 111.4285 9.837266 176.4237  168.5 -29.58268      19.67453 0.97 
1 1 1 -14 14 11 o 269.0899 4.825295 451.0098  159.7 -28.95007      9.650590 0.99 
1 1 1 -14 14 12 o 177.6431 5.212570 342.4072  164.2 -19.98221      10.42514 0.99 
1 1 1 -14 14 13 o 132.3833 7.381405 263.8884  307.7 -2.747513      14.76281 0.98 
1 1 1 -14 14 14 o 184.5026 6.978096 332.8220  330.9 -5.999222      13.95619 0.99 
1 1 1 -14 14 15 f 67.49881 12.86223 258.2923  358.7 -5.768333      25.72446 0.00 
1 1 1 -14 14 16 o 78.71638 12.88600 135.7220  87.0  -11.63605      25.77200 0.93 
1 1 1 -14 14 17 f 70.14276 14.03434 187.5058  155.0 18.81798       28.06867 0.00 
1 1 1 -14 14 18 o 50.45602 13.81086 70.65643  31.4  11.86058       27.62172 0.81 
1 1 1 -14 14 19 o 48.84857 17.22050 41.41181  113.6 ?              ?        0.62 
1 1 1 -14 14 20 o 107.7565 10.18050 145.9007  38.4  35.18941       20.36100 0.97 
1 1 1 -14 14 21 o 119.3730 11.54934 252.0072  63.1  -22.40145      23.09869 0.99 
1 1 1 -14 14 22 o 55.82933 23.54349 85.16717  123.4 ?              ?        0.80 
1 1 1 -14 14 23 o 37.33768 12.16081 51.25162  225.4 -2.133568      24.32162 0.75 
1 1 1 -14 14 24 o 58.81163 15.54144 85.16979  159.2 ?              ?        0.90 
1 1 1 -14 14 25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -14 16 1  o 60.72093 9.766528 87.65238  272.1 -25.97722      19.53306 0.89 
1 1 1 -14 16 2  o 53.58856 10.15626 113.9809  11.3  -10.82355      20.31252 0.91 
1 1 1 -14 16 3  f 91.07314 10.80245 134.3548  273.4 -30.70449      21.60490 0.00 
1 1 1 -14 16 4  o 35.40664 9.170961 72.04602  327.2 27.58175       18.34192 0.76 
1 1 1 -14 16 5  o 111.7260 5.171446 211.8584  60.1  21.69561       10.34289 0.98 
1 1 1 -14 16 6  o 128.3866 4.453307 206.4713  118.4 -2.025070      8.906614 0.98 
1 1 1 -14 16 7  o 37.67021 8.842602 66.85178  330.3 -13.24479      17.68520 0.78 
1 1 1 -14 16 8  o 174.5725 3.615419 315.6280  325.4 4.029663       7.230837 0.99 
1 1 1 -14 16 9  o 93.96104 5.908028 146.7096  337.3 25.84575       11.81606 0.97 
1 1 1 -14 16 10 o 93.64296 6.167450 170.4785  12.4  -22.10841      12.33490 0.98 
1 1 1 -14 16 11 o 69.00427 11.62132 92.54996  0.6   -24.38937      23.24265 0.93 
1 1 1 -14 16 12 o 73.96584 12.81138 105.3660  93.6  6.538490       25.62277 0.94 
1 1 1 -14 16 13 o 95.98692 12.39432 175.7621  78.4  -13.37846      24.78865 0.98 
1 1 1 -14 16 14 o 50.64658 14.62302 52.09902  229.5 24.85279       29.24605 0.79 
1 1 1 -14 16 15 o 74.85791 13.93283 125.3826  183.7 -6.665443      27.86565 0.95 
1 1 1 -14 16 16 o 30.93808 10.59958 104.9097  142.2 6.297462       21.19915 0.88 
1 1 1 -14 16 17 o 75.40724 23.96220 118.7187  125.0 ?              ?        0.90 
1 1 1 -14 16 18 o 37.85686 12.44404 90.91222  182.5 7.852184       24.88809 0.88 
1 1 1 -14 16 19 o 41.27229 19.86204 94.28851  141.4 ?              ?        0.81 
1 1 1 -14 18 1  f 52.93095 12.19190 111.8591  80.6  -3.372292      24.38380 0.00 
1 1 1 -14 18 2  o 43.01660 10.48260 102.7636  39.3  -16.23741      20.96519 0.92 
1 1 1 -14 18 3  o 41.99721 10.96604 64.87209  53.5  -6.225471      21.93208 0.86 
1 1 1 -14 18 4  o 31.92900 9.899351 35.81791  188.5 20.82051       19.79870 0.66 
1 1 1 -14 18 5  o 54.16648 9.795403 140.7366  37.8  ?              ?        0.96 
1 1 1 -14 18 6  o 111.4968 6.257066 251.4906  29.1  ?              ?        0.99 
1 1 1 -14 18 7  o 36.64386 9.658510 80.19254  21.6  ?              ?        0.89 
1 1 1 -14 18 8  o 24.92285 8.247906 22.79082  154.0 ?              ?        0.47 
1 1 1 -14 18 9  o 38.94121 9.909141 84.70068  358.6 ?              ?        0.90 
1 1 1 -13 1  1  o 263.3083 3.003927 1188.703  237.8 -67.58272      6.007853 0.90 
1 1 1 -13 1  2  o 559.7018 5.747419 1295.234  200.9 -19.97290      11.49484 0.99 
1 1 1 -13 1  3  o 444.7399 4.701319 635.1617  247.3 15.88278       9.402637 0.98 
1 1 1 -13 1  4  o 497.5993 5.043584 1304.564  24.1  3.472382       10.08717 0.98 
1 1 1 -13 1  5  o 186.3637 2.716537 745.0316  333.0 3.816772       5.433074 0.83 
1 1 1 -13 1  6  o 325.1272 3.648159 663.2338  144.7 -125.5732      7.296319 0.95 
1 1 1 -13 1  7  f 256.3498 3.026756 253.1219  134.6 23.95781       6.053513 0.00 
1 1 1 -13 1  8  o 53.95808 2.192630 334.1714  67.4  -17.47078      4.385261 0.28 
1 1 1 -13 1  9  x ?        ?        60.50739  260.2 ?              ?        0.00 
1 1 1 -13 1  10 o 246.6397 2.973548 424.1106  121.7 -53.64708      5.947095 0.92 
1 1 1 -13 1  11 o 199.7909 2.646209 393.0105  325.1 -15.71030      5.292418 0.88 
1 1 1 -13 1  12 o 476.9926 4.658178 844.4632  260.6 60.74677       9.316357 0.98 
1 1 1 -13 1  13 o 306.2297 3.395672 257.9229  329.4 27.21445       6.791345 0.94 
1 1 1 -13 1  14 o 470.6802 4.612370 446.1601  63.1  -86.78220      9.224741 0.97 
1 1 1 -13 1  15 o 234.1194 4.065037 401.2461  330.7 ?              ?        0.92 
1 1 1 -13 1  16 o 155.2260 3.894433 252.7176  137.0 -31.79765      7.788866 0.74 
1 1 1 -13 1  17 o 221.3819 4.017686 182.8598  124.0 ?              ?        0.81 
1 1 1 -13 1  18 o 816.8524 9.984903 1169.042  126.6 ?              ?        0.99 
1 1 1 -13 1  19 f 191.5603 3.841065 203.0564  189.2 -20.53349      7.682129 0.00 
1 1 1 -13 1  20 o 430.2004 4.166583 670.5641  321.8 -13.98196      8.333165 0.98 
1 1 1 -13 1  21 o 225.6631 2.982852 421.7992  313.9 -12.01324      5.965704 0.96 
1 1 1 -13 1  22 o 210.8937 3.102792 348.7294  267.8 4.434845       6.205585 0.96 
1 1 1 -13 1  23 o 132.6486 4.678050 88.77878  331.3 10.51815       9.356100 0.85 
1 1 1 -13 1  24 o 129.4180 3.458910 129.8556  9.6   -18.38733      6.917821 0.90 
1 1 1 -13 1  25 o 86.30219 5.358030 113.7584  243.2 -27.61010      10.71606 0.83 
1 1 1 -13 1  26 o 252.5959 3.482302 321.1585  188.5 -24.59772      6.964604 0.99 
1 1 1 -13 1  27 o 97.26566 5.302438 131.7632  46.6  0.2527008      10.60488 0.92 
1 1 1 -13 1  28 o 68.72469 9.013852 114.5029  175.2 32.24706       18.02770 0.87 
1 1 1 -13 1  29 o 225.1640 4.342685 258.8667  253.1 9.126343       8.685369 0.99 
1 1 1 -13 1  30 o 292.7872 5.166656 358.4009  186.4 24.48892       10.33331 0.99 
1 1 1 -13 1  31 o 149.6695 5.690875 163.4526  149.8 35.44064       11.38175 0.96 
1 1 1 -13 1  32 o 58.65545 11.60812 43.80501  101.6 2.112320       23.21624 0.63 
1 1 1 -13 1  33 o 43.64413 12.37823 25.85524  248.9 -17.30380      24.75645 0.41 
1 1 1 -13 1  34 o 31.91664 10.47129 37.32775  123.1 6.132143       20.94258 0.54 
1 1 1 -13 1  35 f 47.67414 12.17865 40.71829  78.8  15.33061       24.35731 0.00 
1 1 1 -13 1  36 f 54.89481 13.04909 102.1330  277.6 -35.40118      26.09817 0.00 
1 1 1 -13 3  1  o 309.1801 2.871919 637.9556  112.4 45.48138       5.743837 0.96 
1 1 1 -13 3  2  o 282.3517 2.708218 388.6080  318.0 -46.84235      5.416436 0.96 
1 1 1 -13 3  3  o 487.7096 4.273558 1045.193  306.7 -57.71304      8.547116 0.98 
1 1 1 -13 3  4  o 123.7491 1.951814 933.4559  8.0   -50.23286      3.903627 0.82 
1 1 1 -13 3  5  o 229.0485 2.726220 267.2867  92.3  124.0220       5.452440 0.93 
1 1 1 -13 3  6  o 279.0078 3.101373 265.9356  300.5 45.69290       6.202747 0.91 
1 1 1 -13 3  7  o 554.3683 5.064780 913.1464  215.8 -21.35150      10.12956 0.98 
1 1 1 -13 3  8  o 365.6371 3.505788 689.7021  146.4 31.95786       7.011577 0.97 
1 1 1 -13 3  9  o 326.1847 3.364626 574.2504  306.3 -0.1525879E-02 6.729253 0.98 
1 1 1 -13 3  10 o 286.0837 2.956319 313.0284  1.4   -12.98419      5.912638 0.92 
1 1 1 -13 3  11 o 197.1161 2.407926 646.5087  65.3  13.48051       4.815852 0.92 
1 1 1 -13 3  12 f 198.5162 2.493170 522.9478  120.3 40.48723       4.986340 0.00 
1 1 1 -13 3  13 o 240.2622 2.713145 448.0106  52.9  42.74170       5.426291 0.89 
1 1 1 -13 3  14 o 205.6973 2.552531 186.0811  355.8 8.385147       5.105062 0.85 
1 1 1 -13 3  15 o 231.2295 2.701308 327.6530  209.0 -32.64340      5.402617 0.91 
1 1 1 -13 3  16 o 130.4407 3.623492 156.9101  253.4 0.3998413      7.246984 0.60 
1 1 1 -13 3  17 o 273.5730 3.065563 621.6984  52.5  27.32312       6.131126 0.95 
1 1 1 -13 3  18 o 336.2741 4.572594 523.9987  76.4  -25.61502      9.145188 0.97 
1 1 1 -13 3  19 o 163.7624 3.564831 170.2685  274.0 -16.94405      7.129662 0.77 
1 1 1 -13 3  20 o 72.95672 5.263003 106.1736  17.4  -28.63387      10.52601 0.43 
1 1 1 -13 3  21 o 404.2753 4.145394 560.8014  163.9 -15.03290      8.290789 0.99 
1 1 1 -13 3  22 f 245.0399 3.066603 441.0256  191.8 24.89421       6.133205 0.00 
1 1 1 -13 3  23 o 158.8550 3.028213 220.5018  154.9 -7.034943      6.056426 0.95 
1 1 1 -13 3  24 o 68.09991 6.341279 84.23712  164.3 17.54954       12.68256 0.56 
1 1 1 -13 3  25 o 114.4904 4.226818 104.8409  8.8   16.88771       8.453636 0.88 
1 1 1 -13 3  26 o 168.3372 3.828650 226.3916  232.9 7.272369       7.657301 0.97 
1 1 1 -13 3  27 o 50.25445 8.832742 57.62820  67.8  21.95492       17.66548 0.59 
1 1 1 -13 3  28 o 186.5412 4.337259 220.1213  10.1  11.14459       8.674518 0.98 
1 1 1 -13 3  29 o 48.42709 10.67106 108.7951  170.1 5.820026       21.34212 0.85 
1 1 1 -13 3  30 o 75.16969 7.987761 149.6585  153.3 -24.04208      15.97552 0.91 
1 1 1 -13 3  31 o 75.81854 8.985810 100.4756  320.8 32.77634       17.97162 0.88 
1 1 1 -13 3  32 o 72.22004 9.715804 98.66640  101.5 3.409470       19.43161 0.90 
1 1 1 -13 3  33 o 150.8712 8.247081 237.4877  159.3 -4.538589      16.49416 0.99 
1 1 1 -13 3  34 o 132.1310 6.813005 196.0132  175.2 -23.97988      13.62601 0.98 
1 1 1 -13 3  35 o 149.7573 6.050295 184.1926  206.4 -15.69810      12.10059 0.99 
1 1 1 -13 3  36 o 48.88361 11.37962 58.49052  102.6 ?              ?        0.85 
1 1 1 -13 5  1  o 348.5787 3.534647 747.9286  252.7 60.04117       7.069293 0.97 
1 1 1 -13 5  2  o 87.64845 2.129975 449.1923  108.8 0.6023407      4.259950 0.69 
1 1 1 -13 5  3  o 350.7292 3.170018 353.8630  248.7 -66.74466      6.340036 0.97 
1 1 1 -13 5  4  o 145.8683 1.780236 249.4032  244.0 40.11040       3.560472 0.73 
1 1 1 -13 5  5  o 368.7103 3.190886 807.8331  297.5 -6.158051      6.381771 0.97 
1 1 1 -13 5  6  o 433.0129 3.598444 878.6989  165.4 -80.54456      7.196888 0.98 
1 1 1 -13 5  7  o 240.5867 2.485876 214.5399  339.5 50.60667       4.971751 0.89 
1 1 1 -13 5  8  o 401.1015 3.752992 961.3568  204.8 -28.72507      7.505984 0.98 
1 1 1 -13 5  9  o 342.3425 3.288245 470.1387  320.2 8.307617       6.576489 0.94 
1 1 1 -13 5  10 o 156.0430 3.077994 106.0454  315.6 ?              ?        0.81 
1 1 1 -13 5  11 o 211.5023 3.185340 394.6418  126.6 -54.68097      6.370681 0.92 
1 1 1 -13 5  12 o 530.1951 4.669210 665.4496  238.7 9.675110       9.338420 0.98 
1 1 1 -13 5  13 o 362.3884 3.564572 635.9086  186.4 -51.86795      7.129143 0.97 
1 1 1 -13 5  14 o 211.7673 3.360907 355.9389  200.7 -13.01196      6.721813 0.91 
1 1 1 -13 5  15 o 64.00200 3.982525 197.1102  276.1 29.31432       7.965050 0.50 
1 1 1 -13 5  16 o 494.9576 5.551484 437.8968  92.3  9.532318       11.10297 0.97 
1 1 1 -13 5  17 o 634.4661 5.565084 970.2168  232.5 23.38678       11.13017 0.99 
1 1 1 -13 5  18 o 310.1114 3.356970 342.6196  182.1 -4.935120      6.713941 0.96 
1 1 1 -13 5  19 o 366.8260 3.902769 524.4960  127.4 -9.205536      7.805538 0.98 
1 1 1 -13 5  20 o 253.5232 3.051340 350.9268  116.5 0.2104950      6.102680 0.97 
1 1 1 -13 5  21 o 286.2800 3.363061 385.2578  31.0  -31.32840      6.726122 0.99 
1 1 1 -13 5  22 f 172.1675 2.974590 269.1090  315.7 -19.77512      5.949180 0.00 
1 1 1 -13 5  23 o 304.2499 3.980846 412.4038  258.7 -8.081482      7.961692 0.99 
1 1 1 -13 5  24 o 297.8225 4.146141 481.0935  137.8 38.00552       8.292282 0.99 
1 1 1 -13 5  25 o 200.2745 3.534933 355.3083  96.4  3.046799       7.069867 0.99 
1 1 1 -13 5  26 o 150.8299 4.092433 192.4685  204.2 26.06691       8.184866 0.97 
1 1 1 -13 5  27 o 32.40191 9.810613 35.57793  347.1 13.85988       19.62123 0.36 
1 1 1 -13 5  28 o 118.2841 4.475041 228.6672  65.0  -10.42547      8.950083 0.98 
1 1 1 -13 5  29 o 93.75170 6.388227 86.78386  213.3 -12.73622      12.77645 0.88 
1 1 1 -13 5  30 o 68.74089 8.884021 96.67026  94.4  1.992004       17.76804 0.87 
1 1 1 -13 5  31 o 106.9265 5.973155 131.3349  146.9 25.94405       11.94631 0.95 
1 1 1 -13 5  32 o 223.4495 4.826557 266.2492  88.8  7.840820       9.653113 0.99 
1 1 1 -13 5  33 o 90.86828 7.297000 181.8047  27.3  -13.36884      14.59400 0.98 
1 1 1 -13 5  34 o 152.7370 5.865611 165.5194  350.1 -15.88632      11.73122 0.98 
1 1 1 -13 5  35 o 45.17009 11.92936 59.26611  274.8 ?              ?        0.83 
1 1 1 -13 7  1  o 477.9530 4.395579 719.7964  111.0 -16.96439      8.791159 0.98 
1 1 1 -13 7  2  o 287.8708 2.922013 612.8511  63.1  53.75140       5.844026 0.96 
1 1 1 -13 7  3  o 766.2216 6.048029 1237.941  286.0 -5.512939      12.09606 0.99 
1 1 1 -13 7  4  o 338.6939 3.121006 631.8302  199.9 45.93622       6.242013 0.96 
1 1 1 -13 7  5  o 212.3371 2.348650 463.2549  201.2 19.62964       4.697300 0.93 
1 1 1 -13 7  6  o 402.4697 3.447125 643.0565  290.5 -6.373138      6.894251 0.98 
1 1 1 -13 7  7  o 243.2212 3.227546 704.1162  299.4 -13.83401      6.455093 0.96 
1 1 1 -13 7  8  o 215.9144 2.657947 637.8967  76.7  46.24435       5.315895 0.95 
1 1 1 -13 7  9  o 350.9854 3.140856 411.9237  131.9 1.948578       6.281713 0.96 
1 1 1 -13 7  10 o 584.9302 4.575264 834.6198  273.4 -9.754883      9.150529 0.99 
1 1 1 -13 7  11 o 210.6711 2.410813 205.9877  354.9 -5.416077      4.821626 0.80 
1 1 1 -13 7  12 o 279.2357 2.850573 448.3896  83.4  49.41844       5.701146 0.95 
1 1 1 -13 7  13 o 343.5664 3.314258 554.9438  329.6 -14.54413      6.628516 0.97 
1 1 1 -13 7  14 o 271.2473 2.875236 449.4239  311.7 18.82074       5.750473 0.96 
1 1 1 -13 7  15 o 243.3608 2.891335 250.3244  152.2 10.88055       5.782670 0.92 
1 1 1 -13 7  16 o 76.47015 4.378360 23.59605  65.1  0.9849319      8.756721 0.19 
1 1 1 -13 7  17 o 258.7361 3.149254 418.2029  353.4 15.93213       6.298508 0.97 
1 1 1 -13 7  18 o 101.1655 3.773816 129.3279  78.5  44.53265       7.547632 0.83 
1 1 1 -13 7  19 o 241.0839 3.211685 440.9413  241.9 -40.18083      6.423370 0.99 
1 1 1 -13 7  20 o 130.7096 3.705132 172.1202  258.5 6.664078       7.410264 0.93 
1 1 1 -13 7  21 o 144.8239 3.236212 228.9465  202.8 3.094009       6.472424 0.96 
1 1 1 -13 7  22 o 157.7921 2.992008 261.3859  157.2 -5.453781      5.984016 0.97 
1 1 1 -13 7  23 o 95.04469 4.986880 228.3605  48.6  18.51563       9.973761 0.95 
1 1 1 -13 7  24 o 78.40755 5.276627 161.1929  39.7  -22.20508      10.55325 0.93 
1 1 1 -13 7  25 o 56.17724 8.260468 125.6640  319.3 20.44865       16.52094 0.89 
1 1 1 -13 7  26 o 46.38375 9.267402 117.4462  218.6 2.271793       18.53480 0.87 
1 1 1 -13 7  27 o 54.12170 8.680049 46.57336  130.2 -40.82846      17.36010 0.61 
1 1 1 -13 7  28 o 157.8571 4.103129 223.0962  343.5 -6.387085      8.206258 0.98 
1 1 1 -13 7  29 o 168.2045 4.412213 227.7781  239.8 -41.12059      8.824427 0.98 
1 1 1 -13 7  30 o 116.1795 6.071187 94.19694  326.0 16.36607       12.14237 0.95 
1 1 1 -13 7  31 f 33.72455 10.22291 31.82446  216.9 -14.97537      20.44583 0.00 
1 1 1 -13 7  32 o 77.49300 8.084489 137.3728  234.1 27.36424       16.16898 0.96 
1 1 1 -13 7  33 o 50.78293 12.39964 99.83102  269.6 -6.270382      24.79927 0.91 
1 1 1 -13 7  34 o 71.87355 10.50742 101.4914  306.6 ?              ?        0.95 
1 1 1 -13 9  1  o 185.7084 2.540715 382.4463  125.7 -0.5228882     5.081430 0.91 
1 1 1 -13 9  2  o 405.3751 5.066818 714.2805  75.4  75.08548       10.13364 0.98 
1 1 1 -13 9  3  o 368.7221 3.441008 554.9236  123.3 31.02209       6.882017 0.97 
1 1 1 -13 9  4  o 111.1332 3.075822 168.3736  212.5 -4.651611      6.151644 0.63 
1 1 1 -13 9  5  o 345.3205 3.623624 643.5314  207.5 14.34601       7.247248 0.97 
1 1 1 -13 9  6  o 399.3623 4.565674 605.1002  183.9 ?              ?        0.98 
1 1 1 -13 9  7  o 394.6859 3.554399 388.1535  307.0 -6.899292      7.108798 0.97 
1 1 1 -13 9  8  o 428.7953 4.628827 764.8972  12.1  -86.02716      9.257654 0.99 
1 1 1 -13 9  9  f 374.1489 4.299131 537.2172  47.1  -94.34357      8.598262 0.00 
1 1 1 -13 9  10 o 67.74287 6.661136 170.8163  328.8 -17.45812      13.32227 0.60 
1 1 1 -13 9  11 o 65.72880 6.312376 94.86370  56.4  -13.60646      12.62475 0.47 
1 1 1 -13 9  12 o 115.1140 4.388131 103.5874  70.9  9.498642       8.776261 0.77 
1 1 1 -13 9  13 o 69.83762 7.266595 236.9758  10.5  -2.909805      14.53319 0.84 
1 1 1 -13 9  14 o 249.9387 3.719045 363.4555  4.1   -37.87680      7.438091 0.98 
1 1 1 -13 9  15 o 244.1755 2.766751 299.2098  54.4  -32.21904      5.533503 0.98 
1 1 1 -13 9  16 o 186.8329 2.604822 321.0869  322.8 25.31531       5.209643 0.98 
1 1 1 -13 9  17 o 93.30138 3.582122 171.2654  3.5   -1.559845      7.164244 0.90 
1 1 1 -13 9  18 o 199.1297 2.958298 340.9822  59.2  -0.1015167     5.916596 0.98 
1 1 1 -13 9  19 o 280.2451 3.411850 423.8594  2.6   -24.41846      6.823700 0.99 
1 1 1 -13 9  20 o 276.3500 3.957002 386.3941  289.7 8.791046       7.914004 0.99 
1 1 1 -13 9  21 o 130.7096 4.287309 160.5761  335.1 3.110733       8.574618 0.96 
1 1 1 -13 9  22 o 256.7937 4.036384 424.8626  320.8 -25.37074      8.072767 0.99 
1 1 1 -13 9  23 o 171.0036 3.967932 288.3832  229.7 19.58830       7.935864 0.99 
1 1 1 -13 9  24 o 114.4471 5.244370 163.7778  205.7 8.972191       10.48874 0.96 
1 1 1 -13 9  25 o 131.8143 3.893532 192.4432  25.6  2.703262       7.787064 0.97 
1 1 1 -13 9  26 o 54.21490 9.583296 154.9599  78.2  -2.148457      19.16659 0.90 
1 1 1 -13 9  27 o 124.5337 5.005972 217.1910  113.4 4.732361       10.01194 0.98 
1 1 1 -13 9  28 f 74.82747 7.739553 118.5673  51.6  -13.79864      15.47911 0.00 
1 1 1 -13 9  29 o 113.4520 5.968496 175.3956  315.6 -3.299828      11.93699 0.98 
1 1 1 -13 9  30 o 79.18697 8.315606 141.0486  5.8   -13.21550      16.63121 0.97 
1 1 1 -13 9  31 o 49.12626 17.80978 35.65892  118.6 ?              ?        0.60 
1 1 1 -13 9  32 o 53.60013 10.52568 88.78526  280.9 ?              ?        0.92 
1 1 1 -13 11 1  o 167.3181 2.743960 362.0093  57.1  4.246902       5.487919 0.97 
1 1 1 -13 11 2  o 42.75613 6.407929 105.9437  88.2  32.27874       12.81586 0.53 
1 1 1 -13 11 3  f 199.5195 3.081036 397.9496  236.4 32.81924       6.162073 0.00 
1 1 1 -13 11 4  o 235.7698 3.239100 450.3434  350.4 36.86087       6.478200 0.99 
1 1 1 -13 11 5  o 73.35364 4.926314 202.3792  229.9 -34.85902      9.852628 0.90 
1 1 1 -13 11 6  o 131.1969 2.796407 131.4991  133.6 -31.76024      5.592814 0.92 
1 1 1 -13 11 7  o 157.8096 2.769365 337.1369  123.6 -40.60863      5.538729 0.97 
1 1 1 -13 11 8  o 136.0763 3.393280 376.7772  274.5 25.80333       6.786559 0.97 
1 1 1 -13 11 9  o 60.18805 7.917618 63.12561  16.6  -31.97610      15.83524 0.56 
1 1 1 -13 11 10 o 48.87312 8.446266 151.2899  350.9 -10.03247      16.89253 0.76 
1 1 1 -13 11 11 o 80.73317 7.713408 208.1456  201.8 -42.90577      15.42682 0.91 
1 1 1 -13 11 12 o 149.4007 4.640833 296.1346  278.7 -29.30539      9.281667 0.97 
1 1 1 -13 11 13 o 121.3232 6.335995 277.0708  348.6 -21.64130      12.67199 0.96 
1 1 1 -13 11 14 o 104.8135 6.895410 118.2647  64.2  0.1039047      13.79082 0.91 
1 1 1 -13 11 15 o 147.7026 5.168691 178.7697  320.3 15.65952       10.33738 0.97 
1 1 1 -13 11 16 o 175.8844 5.200078 323.3711  1.5   34.95969       10.40016 0.98 
1 1 1 -13 11 17 o 92.83452 9.564198 164.9607  128.3 4.957207       19.12840 0.94 
1 1 1 -13 11 18 o 96.92677 7.794266 177.0322  130.3 -4.623047      15.58853 0.96 
1 1 1 -13 11 19 o 140.3729 6.852586 199.7086  26.8  -8.504120      13.70517 0.98 
1 1 1 -13 11 20 o 90.18307 11.85340 221.2288  44.2  -8.483513      23.70680 0.97 
1 1 1 -13 11 21 o 232.0128 6.785464 380.6012  100.0 ?              ?        0.99 
1 1 1 -13 11 22 x ?        ?        28.69518  189.3 ?              ?        0.00 
1 1 1 -13 11 23 o 70.19794 11.45131 144.9574  257.1 -33.95279      22.90262 0.92 
1 1 1 -13 11 24 o 60.63000 11.12440 64.75142  355.4 ?              ?        0.81 
1 1 1 -13 11 25 o 58.28878 10.06873 63.73089  347.4 -28.11565      20.13746 0.84 
1 1 1 -13 11 26 o 38.58393 10.56629 63.94400  93.9  25.05552       21.13258 0.79 
1 1 1 -13 11 27 o 43.41088 11.42085 29.37577  111.9 -10.91087      22.84169 0.60 
1 1 1 -13 11 28 o 45.50290 11.96710 75.67446  268.7 -7.547058      23.93421 0.86 
1 1 1 -13 11 29 o 52.01696 12.07900 96.35835  203.4 4.281059       24.15800 0.92 
1 1 1 -13 11 30 o 40.95804 11.60646 93.56381  140.1 ?              ?        0.90 
1 1 1 -13 13 1  f 126.8339 3.758650 302.0294  3.9   -21.40372      7.517300 0.00 
1 1 1 -13 13 2  o 99.80962 4.707994 236.7351  94.0  24.35891       9.415987 0.96 
1 1 1 -13 13 3  o 54.81311 8.208195 63.77228  207.5 25.57851       16.41639 0.70 
1 1 1 -13 13 4  o 114.5385 4.005724 184.1454  256.0 8.535187       8.011449 0.96 
1 1 1 -13 13 5  o 84.89861 4.759943 137.5444  137.8 37.13584       9.519886 0.93 
1 1 1 -13 13 6  o 83.86404 4.326873 82.46458  230.0 14.32717       8.653746 0.87 
1 1 1 -13 13 7  o 121.6562 3.450042 243.1871  216.9 36.97867       6.900085 0.97 
1 1 1 -13 13 8  o 37.88528 7.789955 58.81857  275.3 32.39880       15.57991 0.56 
1 1 1 -13 13 9  o 141.3971 3.571347 200.5265  7.7   -40.72939      7.142695 0.97 
1 1 1 -13 13 10 o 65.02393 10.13791 159.0248  289.8 -2.410332      20.27582 0.92 
1 1 1 -13 13 11 o 272.6987 4.305973 514.1323  211.8 -12.62302      8.611946 1.00 
1 1 1 -13 13 12 o 90.40536 8.578332 189.2393  208.0 0.9703751      17.15666 0.96 
1 1 1 -13 13 13 f 54.63786 13.70255 74.32063  53.4  28.83078       27.40511 0.00 
1 1 1 -13 13 14 o 175.1219 5.820938 349.3519  69.1  -4.810913      11.64188 0.99 
1 1 1 -13 13 15 o 135.2458 7.628731 231.7123  317.6 ?              ?        0.98 
1 1 1 -13 13 16 f 52.10307 13.25668 97.94740  180.3 12.58904       26.51336 0.00 
1 1 1 -13 13 17 o 189.4045 6.005051 330.0329  167.3 -10.52109      12.01010 0.99 
1 1 1 -13 13 18 o 58.39625 21.83883 47.34023  314.1 ?              ?        0.54 
1 1 1 -13 13 19 o 217.5460 6.597817 393.0327  126.9 -7.103851      13.19563 0.99 
1 1 1 -13 13 20 o 131.4553 15.35911 263.0165  197.8 ?              ?        0.98 
1 1 1 -13 13 21 f 59.80591 13.83418 169.4628  292.5 2.241238       27.66836 0.00 
1 1 1 -13 13 22 o 55.56408 14.59603 124.4741  184.4 16.28392       29.19206 0.92 
1 1 1 -13 13 23 o 71.44041 25.43507 221.1292  170.5 ?              ?        0.94 
1 1 1 -13 13 24 o 153.4205 9.548781 291.2682  185.9 -55.29504      19.09756 0.99 
1 1 1 -13 13 25 o 39.88525 12.12328 117.1016  201.9 -10.00569      24.24655 0.91 
1 1 1 -13 13 26 o 40.82690 13.12056 17.46222  158.7 ?              ?        0.40 
1 1 1 -13 15 1  o 145.2075 4.082442 238.2554  231.9 0.1031342      8.164884 0.98 
1 1 1 -13 15 2  o 167.1932 3.998870 294.4854  288.5 -2.502121      7.997740 0.99 
1 1 1 -13 15 3  o 169.1248 3.752203 275.3114  284.5 37.68562       7.504406 0.99 
1 1 1 -13 15 4  o 76.78586 7.233167 122.6965  197.8 12.41816       14.46633 0.92 
1 1 1 -13 15 5  o 37.52429 9.205218 7.114358  61.5  -2.264599      18.41044 0.09 
1 1 1 -13 15 6  o 42.19977 9.512344 31.45036  222.9 7.741070       19.02469 0.41 
1 1 1 -13 15 7  o 52.49335 8.053033 60.78690  34.6  36.55989       16.10607 0.74 
1 1 1 -13 15 8  o 108.1177 4.280112 183.6402  292.4 44.00346       8.560225 0.97 
1 1 1 -13 15 9  o 69.34966 6.609196 176.1541  242.6 18.97569       13.21839 0.95 
1 1 1 -13 15 10 o 69.36349 9.962324 94.82349  85.1  31.52892       19.92465 0.89 
1 1 1 -13 15 11 o 110.0137 7.641642 176.4485  37.0  29.01255       15.28328 0.97 
1 1 1 -13 15 12 o 45.35777 12.30932 64.18810  302.4 23.79655       24.61864 0.73 
1 1 1 -13 15 13 o 101.8804 10.08288 187.3207  225.8 21.56506       20.16577 0.97 
1 1 1 -13 15 14 o 131.2792 8.041434 233.2336  216.1 -13.29063      16.08287 0.98 
1 1 1 -13 15 15 o 44.03845 12.30007 61.95498  184.1 -11.46496      24.60014 0.78 
1 1 1 -13 15 16 o 42.87343 13.11818 72.66518  340.0 14.93494       26.23636 0.82 
1 1 1 -13 15 17 o 46.52285 21.13859 40.78769  219.8 ?              ?        0.55 
1 1 1 -13 15 18 o 45.73713 21.76495 125.6692  168.6 ?              ?        0.86 
1 1 1 -13 15 19 o 96.99018 22.89878 185.4741  151.9 ?              ?        0.95 
1 1 1 -13 15 20 o 43.69427 12.40787 90.62811  184.0 -9.994678      24.81574 0.89 
1 1 1 -13 15 21 o 31.72603 15.86927 48.35771  302.3 ?              ?        0.60 
1 1 1 -13 15 22 o 38.98589 17.02730 83.15453  341.2 ?              ?        0.82 
1 1 1 -13 17 1  o 38.61790 10.79525 78.05952  171.1 -1.123604      21.59050 0.87 
1 1 1 -13 17 2  o 49.04034 9.983039 90.58291  276.9 38.14819       19.96608 0.92 
1 1 1 -13 17 3  o 91.39842 7.265532 218.6557  303.9 -3.040619      14.53106 0.98 
1 1 1 -13 17 4  o 95.89442 7.293452 167.0258  7.9   6.370476       14.58690 0.98 
1 1 1 -13 17 5  o 39.27169 10.33724 46.09754  153.7 25.31752       20.67449 0.77 
1 1 1 -13 17 6  o 35.83836 10.10095 85.37949  186.7 13.29359       20.20190 0.87 
1 1 1 -13 17 7  o 129.8757 5.115009 247.7068  69.7  1.368958       10.23002 0.99 
1 1 1 -13 17 8  o 71.88641 8.477899 199.9281  61.8  -4.531120      16.95580 0.98 
1 1 1 -13 17 9  o 46.74475 10.14139 75.13734  310.4 6.269997       20.28278 0.89 
1 1 1 -13 17 10 o 78.01538 7.537412 179.3317  258.8 -19.05477      15.07482 0.98 
1 1 1 -13 17 11 o 65.11998 11.05951 191.0727  290.8 -30.21396      22.11903 0.97 
1 1 1 -13 17 12 o 61.55208 10.85682 136.0403  320.0 -34.68130      21.71363 0.96 
1 1 1 -13 17 13 o 41.96933 13.46404 69.14215  121.6 16.20261       26.92808 0.84 
1 1 1 -13 17 14 o 35.31033 11.65770 36.37412  252.6 ?              ?        0.66 
1 1 1 -13 17 15 o 38.25474 18.39222 87.89668  319.0 ?              ?        0.80 
1 1 1 -12 0  1  f 156.4371 3.586134 338.4250  180.0 -0.000000      0.000000 0.00 
1 1 1 -12 0  2  o 375.1898 6.357417 746.2048  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  3  x ?        ?        603.4464  0.0   ?              ?        0.00 
1 1 1 -12 0  4  o 765.4346 10.32286 711.9384  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  5  o 274.0154 4.612183 181.1969  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  6  o 739.6946 9.563029 1468.111  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  7  o 218.4970 4.155502 404.0941  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  8  o 249.1574 3.964729 60.51823  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  9  o 407.7567 5.695704 478.1132  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  10 o 327.1324 4.978183 782.2257  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  11 o 643.2268 8.327481 613.8446  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  12 o 91.25851 3.225123 257.1970  0.0   -0.000000      0.000000 0.24 
1 1 1 -12 0  13 o 324.4620 4.909417 867.4427  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  14 o 214.3430 4.153102 218.0829  0.0   -0.000000      0.000000 0.99 
1 1 1 -12 0  15 o 45.69223 6.671631 183.7591  0.0   -0.000000      0.000000 0.14 
1 1 1 -12 0  16 o 607.6581 8.038992 773.3022  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  17 x ?        ?        950.3500  180.0 ?              ?        0.00 
1 1 1 -12 0  18 o 776.3971 9.557578 972.9264  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  19 o 81.56208 5.391583 186.3147  180.0 -0.000000      0.000000 0.48 
1 1 1 -12 0  20 o 98.58459 5.632148 17.32306  180.0 -0.000000      0.000000 0.09 
1 1 1 -12 0  21 o 142.6676 4.373109 206.5939  180.0 -0.000000      0.000000 0.92 
1 1 1 -12 0  22 o 97.79954 5.771383 48.42036  180.0 -0.000000      0.000000 0.46 
1 1 1 -12 0  23 o 40.92956 14.04684 20.51967  180.0 -0.000000      0.000000 0.14 
1 1 1 -12 0  24 o 117.4621 5.017390 99.32456  180.0 -0.000000      0.000000 0.94 
1 1 1 -12 0  25 o 209.9524 4.622665 97.92337  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  26 o 270.1694 5.073932 471.2005  180.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  27 o 212.2155 5.414494 229.6888  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  28 o 20.87462 14.29455 30.03763  0.0   -0.000000      0.000000 0.17 
1 1 1 -12 0  29 o 137.0927 8.568134 167.6528  360.0 -0.000000      0.000000 1.00 
1 1 1 -12 0  30 o 23.41805 15.65008 24.65172  180.0 -0.000000      0.000000 0.17 
1 1 1 -12 0  31 o 99.25945 11.84168 149.4885  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  32 o 97.01833 12.54253 85.06741  180.0 -0.000000      0.000000 0.99 
1 1 1 -12 0  33 f 102.6793 11.87805 96.94212  180.0 -0.000000      0.000000 0.00 
1 1 1 -12 0  34 f 159.7089 8.856427 237.4142  0.0   -0.000000      0.000000 0.00 
1 1 1 -12 0  35 o 172.2799 8.720910 216.6617  0.0   -0.000000      0.000000 1.00 
1 1 1 -12 0  36 o 72.49320 22.83361 67.73235  180.0 -0.000000      0.000000 0.98 
1 1 1 -12 2  1  o 593.8430 4.725171 1121.706  231.6 -47.43079      9.450342 0.98 
1 1 1 -12 2  2  o 372.2794 3.875577 736.9225  72.9  81.29272       7.751154 0.96 
1 1 1 -12 2  3  o 467.7813 4.848596 929.5521  200.2 131.1533       9.697192 0.98 
1 1 1 -12 2  4  o 716.0630 6.539163 1092.517  230.4 3.238342       13.07833 0.99 
1 1 1 -12 2  5  o 603.8521 5.656867 935.3243  276.3 -68.41461      11.31373 0.99 
1 1 1 -12 2  6  o 533.6376 5.139901 1082.782  133.2 133.3572       10.27980 0.99 
1 1 1 -12 2  7  o 253.9944 2.872461 284.3701  169.4 0.7173157E-01  5.744922 0.73 
1 1 1 -12 2  8  o 325.6551 3.372191 680.8501  106.9 -7.436127      6.744382 0.95 
1 1 1 -12 2  9  o 386.7610 3.796869 741.3341  345.2 12.10254       7.593738 0.98 
1 1 1 -12 2  10 o 337.5241 3.464447 849.0077  355.0 23.87180       6.928894 0.97 
1 1 1 -12 2  11 o 186.8369 2.320383 258.8041  290.8 16.64952       4.640767 0.92 
1 1 1 -12 2  12 o 350.1848 3.568677 831.0266  332.1 -66.46283      7.137355 0.96 
1 1 1 -12 2  13 o 220.5310 2.605726 316.5930  139.4 27.01057       5.211452 0.87 
1 1 1 -12 2  14 o 73.83704 3.196167 108.3308  28.3  45.77161       6.392334 0.36 
1 1 1 -12 2  15 o 263.5555 3.564997 536.6744  21.8  -13.45285      7.129994 0.94 
1 1 1 -12 2  16 o 437.6331 4.189931 723.4883  66.0  -1.432129      8.379863 0.98 
1 1 1 -12 2  17 o 369.3947 3.791503 464.9864  350.6 -4.611725      7.583005 0.96 
1 1 1 -12 2  18 o 485.0845 5.490954 569.0460  91.8  -22.28778      10.98191 0.98 
1 1 1 -12 2  19 o 539.2313 4.943309 717.7349  305.8 -37.29272      9.886619 0.98 
1 1 1 -12 2  20 o 486.3649 4.506214 740.3567  307.0 -15.50836      9.012428 0.99 
1 1 1 -12 2  21 o 109.5022 3.702386 111.4986  168.1 30.19596       7.404771 0.68 
1 1 1 -12 2  22 o 391.1701 3.941486 534.2912  286.4 -55.82349      7.882973 0.99 
1 1 1 -12 2  23 o 217.1050 3.374667 334.6581  254.3 -40.59471      6.749334 0.98 
1 1 1 -12 2  24 o 255.4373 3.937455 330.8015  44.1  -9.107239      7.874909 0.98 
1 1 1 -12 2  25 o 296.1158 3.601916 434.1212  24.1  43.58923       7.203832 0.99 
1 1 1 -12 2  26 o 318.2743 4.429286 374.0175  239.9 -34.59973      8.858573 0.99 
1 1 1 -12 2  27 o 120.9692 5.814629 124.9385  150.9 -38.28620      11.62926 0.93 
1 1 1 -12 2  28 o 146.8329 4.216967 138.5026  108.9 42.05608       8.433933 0.96 
1 1 1 -12 2  29 o 68.14318 8.424213 52.66354  47.7  36.96687       16.84843 0.80 
1 1 1 -12 2  30 o 36.92094 10.15798 79.91589  152.8 -13.40978      20.31596 0.63 
1 1 1 -12 2  31 o 50.85138 9.042605 77.97884  119.2 -44.08595      18.08521 0.75 
1 1 1 -12 2  32 o 134.6319 6.073154 83.62950  83.7  18.78156       12.14631 0.94 
1 1 1 -12 2  33 o 65.91269 11.18879 67.01376  111.6 42.52162       22.37758 0.86 
1 1 1 -12 2  34 o 76.33715 9.882497 77.09560  149.0 21.62856       19.76499 0.92 
1 1 1 -12 2  35 f 34.46383 10.99911 32.70689  201.1 10.54794       21.99821 0.00 
1 1 1 -12 2  36 o 119.7251 8.039118 150.2376  299.9 ?              ?        0.98 
1 1 1 -12 4  1  o 264.9926 2.866564 415.0291  307.0 -6.105743      5.733129 0.94 
1 1 1 -12 4  2  o 110.3822 1.680968 695.5301  224.8 41.24726       3.361936 0.72 
1 1 1 -12 4  3  o 424.2245 3.432170 656.5595  219.1 5.915161       6.864340 0.98 
1 1 1 -12 4  4  o 477.1692 4.033533 964.3001  277.5 -1.570984      8.067065 0.98 
1 1 1 -12 4  5  o 337.5098 3.105465 134.4185  353.3 0.5599365      6.210929 0.95 
1 1 1 -12 4  6  o 573.7729 5.094136 897.2010  169.0 71.58826       10.18827 0.99 
1 1 1 -12 4  7  o 186.4587 2.295808 497.0854  280.8 53.20639       4.591617 0.92 
1 1 1 -12 4  8  o 350.2015 3.409971 802.4409  304.7 28.63785       6.819942 0.97 
1 1 1 -12 4  9  o 298.3658 2.971370 409.2493  254.9 13.93417       5.942741 0.95 
1 1 1 -12 4  10 o 490.4292 4.376012 765.4861  74.8  39.06378       8.752025 0.98 
1 1 1 -12 4  11 o 389.8793 3.756132 631.7291  82.3  31.62076       7.512264 0.97 
1 1 1 -12 4  12 o 598.8510 5.173758 1102.313  193.1 49.11279       10.34752 0.99 
1 1 1 -12 4  13 o 363.9651 3.421112 363.3533  355.6 -10.25714      6.842225 0.95 
1 1 1 -12 4  14 o 530.1651 4.689681 845.2755  328.6 31.80469       9.379362 0.98 
1 1 1 -12 4  15 o 132.2512 3.531337 75.61256  270.2 39.28836       7.062675 0.38 
1 1 1 -12 4  16 o 375.6456 3.749371 421.0226  86.5  17.38095       7.498742 0.96 
1 1 1 -12 4  17 o 140.7143 2.513391 226.1740  107.4 24.65242       5.026781 0.79 
1 1 1 -12 4  18 o 407.2647 3.969052 703.5349  117.1 -5.263306      7.938103 0.98 
1 1 1 -12 4  19 o 248.0851 3.846231 269.5746  113.6 -28.97990      7.692462 0.93 
1 1 1 -12 4  20 o 112.3173 3.324254 40.16716  22.1  -15.24150      6.648509 0.38 
1 1 1 -12 4  21 o 186.0990 2.963938 198.2183  206.7 3.183578       5.927875 0.94 
1 1 1 -12 4  22 o 185.7229 3.114420 258.4470  61.0  -77.64220      6.228840 0.97 
1 1 1 -12 4  23 o 253.4434 4.485857 373.3796  31.3  -5.386353      8.971713 0.98 
1 1 1 -12 4  24 o 163.6830 3.592603 223.2178  125.5 1.243576       7.185205 0.96 
1 1 1 -12 4  25 f 95.03896 4.939410 104.0534  144.3 -0.9561157E-01 9.878819 0.00 
1 1 1 -12 4  26 o 66.81718 7.375351 56.06530  238.7 11.12785       14.75070 0.68 
1 1 1 -12 4  27 o 293.2159 4.493328 424.8123  228.7 17.34622       8.986655 0.99 
1 1 1 -12 4  28 o 120.5905 4.755360 163.3283  282.3 4.097900       9.510720 0.97 
1 1 1 -12 4  29 o 135.9774 4.880674 217.4827  170.8 32.02880       9.761348 0.97 
1 1 1 -12 4  30 o 116.8645 5.823147 131.4784  153.1 -3.143433      11.64629 0.94 
1 1 1 -12 4  31 o 80.70227 8.512372 137.3173  45.5  -12.79034      17.02474 0.93 
1 1 1 -12 4  32 o 91.31123 8.163360 43.29379  149.6 8.286301       16.32672 0.84 
1 1 1 -12 4  33 o 180.1472 5.763632 245.2888  181.0 18.73431       11.52726 0.99 
1 1 1 -12 4  34 o 144.8963 6.401464 163.3746  87.9  -6.964386      12.80293 0.98 
1 1 1 -12 4  35 o 51.65501 11.56239 58.88357  100.8 25.85434       23.12479 0.84 
1 1 1 -12 4  36 o 97.51643 10.16260 128.2852  79.5  ?              ?        0.97 
1 1 1 -12 6  1  o 239.0342 3.758197 440.0199  305.7 ?              ?        0.95 
1 1 1 -12 6  2  o 505.6132 4.236559 966.4357  139.8 -54.44775      8.473119 0.98 
1 1 1 -12 6  3  o 138.2330 2.243793 444.7046  259.4 -25.40613      4.487586 0.84 
1 1 1 -12 6  4  o 397.7928 3.553086 731.5013  199.9 61.65060       7.106172 0.97 
1 1 1 -12 6  5  o 320.7493 2.999249 331.9892  116.5 22.23141       5.998498 0.94 
1 1 1 -12 6  6  o 388.6944 3.380404 517.3063  250.7 77.09866       6.760809 0.97 
1 1 1 -12 6  7  o 892.0706 6.754156 1480.951  217.8 17.38000       13.50831 0.99 
1 1 1 -12 6  8  o 286.3237 3.147052 148.1766  207.4 -45.54300      6.294104 0.89 
1 1 1 -12 6  9  o 318.3773 3.774106 403.2462  222.3 33.40543       7.548212 0.95 
1 1 1 -12 6  10 o 245.7258 2.597171 418.7761  202.3 12.84187       5.194342 0.93 
1 1 1 -12 6  11 o 308.0549 3.011634 410.3986  216.8 7.988007       6.023267 0.94 
1 1 1 -12 6  12 f 658.2660 5.587247 773.5615  15.6  41.37677       11.17449 0.00 
1 1 1 -12 6  13 o 310.8025 3.865252 355.0030  92.8  -32.88208      7.730505 0.94 
1 1 1 -12 6  14 o 145.0402 2.595479 171.1631  132.2 -13.44185      5.190959 0.74 
1 1 1 -12 6  15 o 106.7910 3.070283 50.22507  25.8  52.69660       6.140566 0.10 
1 1 1 -12 6  16 o 218.9779 2.915165 367.6606  170.8 20.95978       5.830330 0.93 
1 1 1 -12 6  17 o 481.1994 4.510665 661.4266  217.8 49.57910       9.021330 0.99 
1 1 1 -12 6  18 o 332.5729 3.610022 563.1171  177.6 -38.28986      7.220043 0.98 
1 1 1 -12 6  19 o 154.5040 2.998988 197.1541  229.5 -19.72931      5.997975 0.92 
1 1 1 -12 6  20 o 130.6205 2.972248 141.8917  253.8 -28.39705      5.944497 0.92 
1 1 1 -12 6  21 o 74.40535 4.575538 51.57280  66.1  7.101982       9.151075 0.59 
1 1 1 -12 6  22 o 137.8951 3.514710 180.8916  39.8  21.17007       7.029419 0.94 
1 1 1 -12 6  23 o 272.7410 3.403256 382.5437  256.4 4.956238       6.806511 0.99 
1 1 1 -12 6  24 o 210.9891 3.156990 288.1179  197.3 -18.06255      6.313981 0.98 
1 1 1 -12 6  25 o 81.59279 5.780774 77.46465  85.0  -12.92846      11.56155 0.84 
1 1 1 -12 6  26 o 122.2575 4.468556 144.7392  281.1 -0.6307373     8.937112 0.96 
1 1 1 -12 6  27 o 184.2380 4.047511 236.4595  49.1  6.271942       8.095021 0.99 
1 1 1 -12 6  28 o 78.09525 6.404922 84.19076  304.7 6.269188       12.80984 0.86 
1 1 1 -12 6  29 o 158.6040 4.218489 231.1684  201.2 -26.24748      8.436978 0.98 
1 1 1 -12 6  30 o 198.0105 3.786150 285.0771  53.1  9.061539       7.572299 0.99 
1 1 1 -12 6  31 o 138.1448 4.854192 240.6250  1.7   17.25513       9.708384 0.99 
1 1 1 -12 6  32 o 54.64444 12.04693 88.70582  16.9  1.817062       24.09385 0.90 
1 1 1 -12 6  33 o 44.54625 11.61078 21.58588  345.1 -26.75946      23.22155 0.47 
1 1 1 -12 6  34 o 126.1497 6.733202 173.1012  330.1 -20.78601      13.46640 0.98 
1 1 1 -12 6  35 x ?        ?        81.39914  295.7 ?              ?        0.00 
1 1 1 -12 8  1  o 488.1199 4.516336 524.8127  292.8 73.14774       9.032673 0.98 
1 1 1 -12 8  2  o 962.2444 9.889115 1408.801  39.1  24.10254       19.77823 1.00 
1 1 1 -12 8  3  o 643.2086 5.210721 1064.014  62.5  62.21570       10.42144 0.99 
1 1 1 -12 8  4  o 178.7895 2.387602 200.1227  78.4  3.020065       4.775204 0.84 
1 1 1 -12 8  5  o 278.3501 2.926002 466.8768  273.9 24.53656       5.852003 0.95 
1 1 1 -12 8  6  o 159.2108 2.501225 310.0953  289.3 10.93541       5.002450 0.89 
1 1 1 -12 8  7  o 739.1577 5.676219 1084.262  300.9 -14.52765      11.35244 0.99 
1 1 1 -12 8  8  o 316.3383 3.737617 490.5607  309.9 -63.15253      7.475233 0.96 
1 1 1 -12 8  9  f 281.5936 3.685023 308.8568  61.3  62.42326       7.370045 0.00 
1 1 1 -12 8  10 o 323.0751 3.716622 517.6806  196.4 ?              ?        0.96 
1 1 1 -12 8  11 o 71.27829 5.710457 103.4961  333.6 12.44167       11.42091 0.42 
1 1 1 -12 8  12 o 53.10681 3.498836 79.16407  116.9 -4.712044      6.997672 0.24 
1 1 1 -12 8  13 o 90.11087 2.583226 230.9492  198.7 11.13247       5.166453 0.76 
1 1 1 -12 8  14 o 231.0201 2.717757 198.4676  188.9 -43.94116      5.435515 0.93 
1 1 1 -12 8  15 f 88.06463 3.655929 204.4363  44.3  47.80212       7.311859 0.00 
1 1 1 -12 8  16 o 133.5395 2.952773 232.6547  69.0  1.163742       5.905546 0.93 
1 1 1 -12 8  17 f 202.5800 2.762172 401.0072  88.9  -45.75403      5.524344 0.00 
1 1 1 -12 8  18 o 89.38924 4.210398 187.7775  154.9 46.30331       8.420796 0.91 
1 1 1 -12 8  19 f 383.2971 3.969339 613.3564  317.1 -47.68164      7.938679 0.00 
1 1 1 -12 8  20 o 345.8761 3.767346 606.9048  348.5 -45.24249      7.534692 0.99 
1 1 1 -12 8  21 o 194.4886 3.697050 318.9963  77.9  25.08539       7.394100 0.98 
1 1 1 -12 8  22 o 114.4402 4.011781 187.9801  186.4 12.44346       8.023562 0.96 
1 1 1 -12 8  23 o 177.8813 3.593734 286.7432  211.1 12.04192       7.187468 0.98 
1 1 1 -12 8  24 o 91.60352 5.911064 158.1084  186.3 29.84512       11.82213 0.95 
1 1 1 -12 8  25 o 235.7188 3.733943 359.4873  333.3 -30.72411      7.467886 0.99 
1 1 1 -12 8  26 o 118.7664 4.477725 205.8986  330.7 -12.74223      8.955450 0.97 
1 1 1 -12 8  27 o 60.53149 8.807897 94.96245  121.4 24.32432       17.61579 0.85 
1 1 1 -12 8  28 o 57.04622 9.519571 114.9958  122.4 11.85085       19.03914 0.89 
1 1 1 -12 8  29 o 114.2470 9.498023 194.5802  230.3 ?              ?        0.98 
1 1 1 -12 8  30 o 29.48257 9.252481 21.68662  110.2 2.908840       18.50496 0.34 
1 1 1 -12 8  31 o 34.90805 10.72179 60.70513  290.4 -9.888149      21.44359 0.76 
1 1 1 -12 8  32 o 113.2437 7.019924 182.1916  289.0 6.291588       14.03985 0.98 
1 1 1 -12 8  33 o 111.3062 7.597016 181.7687  235.3 ?              ?        0.98 
1 1 1 -12 10 1  o 637.9073 6.843670 1018.435  253.8 20.81366       13.68734 0.99 
1 1 1 -12 10 2  o 322.1793 3.475903 563.4360  240.9 45.88876       6.951806 0.98 
1 1 1 -12 10 3  f 392.9299 4.087292 432.4023  317.9 -27.10437      8.174583 0.00 
1 1 1 -12 10 4  o 414.7287 4.141467 718.2648  357.5 0.3602295      8.282934 0.99 
1 1 1 -12 10 5  f 349.0764 4.306874 501.3928  149.1 18.54938       8.613748 0.00 
1 1 1 -12 10 6  o 375.3345 5.521480 666.8430  112.5 ?              ?        0.99 
1 1 1 -12 10 7  f 43.06149 6.764657 239.0183  28.5  -26.94002      13.52931 0.00 
1 1 1 -12 10 8  o 125.3580 2.799373 271.7769  59.7  21.51559       5.598747 0.92 
1 1 1 -12 10 9  f 299.1287 4.126736 469.3822  333.2 -48.67273      8.253472 0.00 
1 1 1 -12 10 10 o 237.6995 4.000935 443.6764  310.9 -38.98651      8.001870 0.98 
1 1 1 -12 10 11 o 283.7152 3.977734 503.8105  138.0 -45.92899      7.955467 0.99 
1 1 1 -12 10 12 o 142.3136 4.527207 300.5186  156.8 -67.00665      9.054414 0.96 
1 1 1 -12 10 13 o 79.35078 8.323149 142.5696  40.5  -22.24071      16.64630 0.86 
1 1 1 -12 10 14 o 38.18857 11.19514 72.10390  58.1  -3.688950      22.39027 0.45 
1 1 1 -12 10 15 o 193.6429 4.672630 337.2882  56.2  -14.37471      9.345260 0.98 
1 1 1 -12 10 16 o 222.4569 4.689942 495.8265  352.6 39.96024       9.379885 0.99 
1 1 1 -12 10 17 f 54.59149 11.42155 87.30724  157.9 -6.103867      22.84311 0.00 
1 1 1 -12 10 18 o 156.1192 5.613022 224.0258  121.6 -25.81065      11.22604 0.97 
1 1 1 -12 10 19 o 275.5095 5.371925 524.7477  97.7  -37.27411      10.74385 0.99 
1 1 1 -12 10 20 o 209.4143 3.069727 350.9029  172.6 -16.93091      6.139454 0.99 
1 1 1 -12 10 21 o 120.1901 4.175552 208.5066  163.6 -2.829887      8.351104 0.98 
1 1 1 -12 10 22 o 95.47601 5.440535 154.9209  283.5 34.66502       10.88107 0.96 
1 1 1 -12 10 23 o 209.4375 4.003530 331.5856  252.9 -5.300797      8.007060 0.99 
1 1 1 -12 10 24 o 78.70745 6.752231 117.4407  215.5 14.45558       13.50446 0.91 
1 1 1 -12 10 25 o 65.11381 8.823721 84.29906  128.5 -4.473827      17.64744 0.86 
1 1 1 -12 10 26 f 97.07635 6.473612 142.4866  185.6 -19.54780      12.94722 0.00 
1 1 1 -12 10 27 o 187.6262 4.290892 304.5295  202.8 -7.046082      8.581783 0.99 
1 1 1 -12 10 28 o 84.87845 7.882057 120.5691  266.6 9.848679       15.76411 0.96 
1 1 1 -12 10 29 o 47.35650 10.36264 35.19181  290.9 3.725361       20.72529 0.70 
1 1 1 -12 10 30 o 44.01994 10.73597 84.37571  100.9 2.860394       21.47194 0.89 
1 1 1 -12 10 31 o 28.94407 9.295078 58.04812  227.7 ?              ?        0.77 
1 1 1 -12 12 1  o 112.2986 5.884766 276.4391  222.8 28.92612       11.76953 0.95 
1 1 1 -12 12 2  o 59.85860 5.926431 130.6220  188.6 -18.63155      11.85286 0.78 
1 1 1 -12 12 3  o 114.4288 3.612950 142.2571  315.0 35.14875       7.225900 0.91 
1 1 1 -12 12 4  o 139.5717 3.537261 239.3693  346.1 -5.429474      7.074522 0.96 
1 1 1 -12 12 5  o 117.2101 3.168693 238.5753  216.6 14.97926       6.337385 0.95 
1 1 1 -12 12 6  o 293.0969 3.189004 591.5103  156.7 -16.10144      6.378008 0.99 
1 1 1 -12 12 7  f 111.3061 3.404409 125.4748  118.8 -9.960609      6.808818 0.00 
1 1 1 -12 12 8  o 172.2552 3.054103 295.2341  311.8 -9.394379      6.108205 0.98 
1 1 1 -12 12 9  o 135.6857 3.000435 235.8202  26.8  -22.46012      6.000870 0.97 
1 1 1 -12 12 10 o 48.46030 9.060882 130.6653  345.7 -18.09539      18.12176 0.81 
1 1 1 -12 12 11 o 93.59085 8.734621 240.9130  211.1 -36.15031      17.46924 0.96 
1 1 1 -12 12 12 o 49.63064 10.85527 117.3495  46.0  37.04745       21.71054 0.82 
1 1 1 -12 12 13 o 86.18415 9.776474 178.7127  60.0  -44.42420      19.55295 0.94 
1 1 1 -12 12 14 o 177.1849 4.995162 267.0567  108.8 -25.98782      9.990323 0.98 
1 1 1 -12 12 15 o 68.30930 10.79976 125.1900  271.8 -20.71928      21.59952 0.90 
1 1 1 -12 12 16 o 130.8382 6.461523 308.6430  14.6  -5.218094      12.92305 0.98 
1 1 1 -12 12 17 o 175.0920 6.071163 277.9506  99.2  -23.85249      12.14233 0.99 
1 1 1 -12 12 18 o 123.1999 9.424523 220.8053  279.5 -23.30912      18.84905 0.98 
1 1 1 -12 12 19 o 89.11258 11.30480 141.8097  254.4 -12.99888      22.60960 0.93 
1 1 1 -12 12 20 o 143.5944 7.441679 260.5269  199.6 13.73795       14.88336 0.98 
1 1 1 -12 12 21 o 90.57131 20.07384 161.1638  326.9 ?              ?        0.93 
1 1 1 -12 12 22 o 108.3966 10.46158 198.4404  336.8 -8.523384      20.92316 0.97 
1 1 1 -12 12 23 o 93.98094 11.40283 84.78142  332.2 58.81229       22.80567 0.93 
1 1 1 -12 12 24 o 161.3715 8.256619 239.6768  182.6 -37.10381      16.51324 0.99 
1 1 1 -12 12 25 o 73.56248 18.79177 106.4197  264.9 ?              ?        0.92 
1 1 1 -12 12 26 f 69.23882 17.96284 73.05983  339.7 ?              ?        0.00 
1 1 1 -12 12 27 o 42.90017 18.21044 88.21927  314.5 ?              ?        0.83 
1 1 1 -12 12 28 o 67.88448 10.48360 129.4224  271.6 ?              ?        0.96 
1 1 1 -12 14 1  o 103.7607 4.703424 195.4834  280.6 -9.765579      9.406848 0.97 
1 1 1 -12 14 2  o 195.8134 4.077775 322.0620  279.5 17.53082       8.155551 0.99 
1 1 1 -12 14 3  o 208.4027 3.644250 300.1814  324.1 18.13492       7.288500 0.99 
1 1 1 -12 14 4  o 46.28782 9.392146 130.2195  311.5 8.571804       18.78429 0.88 
1 1 1 -12 14 5  o 183.6745 3.114994 331.2057  213.8 17.04512       6.229988 0.99 
1 1 1 -12 14 6  o 235.6532 3.310572 409.2343  314.2 -4.736542      6.621143 0.99 
1 1 1 -12 14 7  o 235.8345 3.108376 377.1285  14.4  3.705917       6.216753 0.99 
1 1 1 -12 14 8  o 46.54501 8.187575 74.56583  116.9 -1.819664      16.37515 0.83 
1 1 1 -12 14 9  o 185.6712 3.182976 304.2013  40.8  -17.89194      6.365952 0.99 
1 1 1 -12 14 10 o 300.9688 4.956280 572.2753  352.2 -15.37210      9.912560 1.00 
1 1 1 -12 14 11 o 66.60279 9.881388 109.5976  256.3 -39.97765      19.76278 0.90 
1 1 1 -12 14 12 o 92.38420 9.972183 196.8541  167.9 43.99933       19.94437 0.96 
1 1 1 -12 14 13 o 114.3266 7.422548 215.8224  203.4 10.36804       14.84510 0.97 
1 1 1 -12 14 14 o 47.01745 20.05049 47.41185  227.3 ?              ?        0.48 
1 1 1 -12 14 15 o 103.6040 12.32755 216.5963  18.4  -32.97087      24.65510 0.97 
1 1 1 -12 14 16 o 68.26910 14.06424 98.01131  165.8 13.97644       28.12848 0.88 
1 1 1 -12 14 17 o 45.82140 19.91477 84.86845  235.7 ?              ?        0.74 
1 1 1 -12 14 18 o 56.71312 13.54032 106.9287  224.5 -11.52111      27.08063 0.90 
1 1 1 -12 14 19 o 174.4201 7.379534 277.5453  179.0 -32.11830      14.75907 0.99 
1 1 1 -12 14 20 o 44.96199 13.38394 86.66479  162.5 0.6230125      26.76787 0.87 
1 1 1 -12 14 21 o 53.77484 14.46756 61.47427  175.3 19.44104       28.93512 0.84 
1 1 1 -12 14 22 o 50.22055 13.63317 106.4796  333.7 -14.69438      27.26633 0.91 
1 1 1 -12 14 23 o 44.34219 13.91133 56.33214  320.7 5.870735       27.82265 0.79 
1 1 1 -12 14 24 o 43.19486 14.01266 71.64758  279.0 ?              ?        0.85 
1 1 1 -12 16 1  o 54.77614 9.713282 96.28380  146.2 -13.56516      19.42656 0.89 
1 1 1 -12 16 2  o 41.69680 9.851816 15.95617  201.9 -10.92940      19.70363 0.28 
1 1 1 -12 16 3  o 36.99738 10.17383 24.51443  233.8 9.111706       20.34766 0.37 
1 1 1 -12 16 4  o 35.01782 9.461906 82.08846  198.2 -6.814926      18.92381 0.78 
1 1 1 -12 16 5  o 45.32735 9.385129 96.77627  177.1 10.27417       18.77026 0.87 
1 1 1 -12 16 6  o 82.13213 6.978296 148.0491  149.9 -7.532295      13.95659 0.96 
1 1 1 -12 16 7  o 113.5178 4.882633 215.5096  152.4 -0.8893661     9.765265 0.98 
1 1 1 -12 16 8  o 107.2864 5.260322 205.9997  167.3 -24.97424      10.52064 0.98 
1 1 1 -12 16 9  o 59.36922 8.495603 130.7744  243.3 1.817055       16.99121 0.94 
1 1 1 -12 16 10 o 23.46155 7.717714 60.68055  129.1 7.290051       15.43543 0.66 
1 1 1 -12 16 11 o 36.97766 9.322537 41.94299  140.1 -5.242619      18.64507 0.68 
1 1 1 -12 16 12 o 93.12684 11.59311 154.3509  260.7 8.606979       23.18623 0.97 
1 1 1 -12 16 13 o 32.68737 11.13111 67.19960  315.3 7.317894       22.26223 0.80 
1 1 1 -12 16 14 o 45.30600 13.44405 132.5082  324.9 5.506809       26.88810 0.92 
1 1 1 -12 16 15 o 145.1430 16.85213 317.6378  331.4 ?              ?        0.99 
1 1 1 -12 16 16 o 51.28420 14.02675 48.38852  25.5  29.87235       28.05351 0.78 
1 1 1 -12 16 17 o 84.59818 23.47511 120.1600  246.2 ?              ?        0.91 
1 1 1 -12 16 18 o 67.56921 14.32792 185.7952  329.6 -14.42572      28.65585 0.96 
1 1 1 -12 16 19 o 42.64060 20.37753 144.1263  351.1 ?              ?        0.88 
1 1 1 -12 18 1  o 112.8601 7.118638 184.3286  223.6 -29.38242      14.23728 0.99 
1 1 1 -12 18 2  f 53.69001 11.23304 136.7835  192.6 -13.75155      22.46608 0.00 
1 1 1 -12 18 3  f 40.31297 11.40140 61.34676  102.0 10.88406       22.80280 0.00 
1 1 1 -12 18 4  o 34.47633 10.46813 27.83636  164.8 -9.065262      20.93626 0.57 
1 1 1 -12 18 5  o 95.51150 6.913172 205.3325  244.8 13.47392       13.82634 0.99 
1 1 1 -12 18 6  o 42.90783 11.09350 123.0141  223.1 8.800392       22.18701 0.93 
1 1 1 -12 18 7  o 45.99076 10.04136 116.1901  179.8 ?              ?        0.94 
1 1 1 -12 18 8  o 30.70168 8.972011 89.86811  165.7 ?              ?        0.89 
1 1 1 -12 18 9  o 58.21670 9.493951 134.3833  133.4 ?              ?        0.96 
1 1 1 -12 18 10 x ?        ?        78.65562  70.1  ?              ?        0.00 
1 1 1 -11 1  1  o 602.4557 5.416553 1016.706  142.1 -32.71124      10.83311 0.99 
1 1 1 -11 1  2  o 477.1247 5.028366 1502.284  245.7 -108.6670      10.05673 0.98 
1 1 1 -11 1  3  o 469.9872 4.931543 574.6788  280.0 76.95309       9.863087 0.99 
1 1 1 -11 1  4  o 550.1640 5.304539 1488.611  188.4 71.55408       10.60908 0.99 
1 1 1 -11 1  5  o 54.64379 2.188042 291.6837  21.3  6.672947       4.376084 0.27 
1 1 1 -11 1  6  o 594.2767 5.650581 1029.622  127.5 131.2826       11.30116 0.99 
1 1 1 -11 1  7  o 130.2768 2.097332 404.6653  262.1 81.02477       4.194665 0.66 
1 1 1 -11 1  8  o 351.9547 3.741240 964.7394  266.8 -33.76196      7.482480 0.97 
1 1 1 -11 1  9  o 576.4993 5.276812 692.1124  344.0 -88.03198      10.55362 0.99 
1 1 1 -11 1  10 o 257.0137 3.031706 378.2370  344.9 -24.50905      6.063411 0.88 
1 1 1 -11 1  11 o 287.9427 3.197778 568.9724  154.2 72.52428       6.395556 0.92 
1 1 1 -11 1  12 o 232.0265 2.911094 429.1285  33.5  -20.36980      5.822188 0.91 
1 1 1 -11 1  13 o 307.5950 3.391618 356.1699  129.9 73.74582       6.783235 0.96 
1 1 1 -11 1  14 o 232.7162 2.799886 350.9486  287.4 -62.07513      5.599771 0.93 
1 1 1 -11 1  15 o 647.6586 5.942836 988.2543  122.0 14.31799       11.88567 0.99 
1 1 1 -11 1  16 o 365.1862 3.803195 329.4898  156.6 34.14343       7.606390 0.95 
1 1 1 -11 1  17 o 306.9460 3.358671 376.8200  141.2 21.86224       6.717343 0.93 
1 1 1 -11 1  18 o 213.6164 2.858449 240.7429  206.8 44.90179       5.716897 0.88 
1 1 1 -11 1  19 o 102.1191 4.534934 191.3450  301.6 20.67430       9.069867 0.55 
1 1 1 -11 1  20 o 190.4781 2.856269 186.1371  130.5 -2.981537      5.712538 0.83 
1 1 1 -11 1  21 o 408.8998 4.176249 553.6470  153.9 6.609711       8.352498 0.98 
1 1 1 -11 1  22 o 141.5070 3.159542 162.8760  260.6 -19.73981      6.319084 0.87 
1 1 1 -11 1  23 o 130.1755 4.812893 134.8732  29.6  10.19665       9.625787 0.90 
1 1 1 -11 1  24 o 184.7559 3.386191 117.4905  108.0 -13.72092      6.772381 0.92 
1 1 1 -11 1  25 o 256.1251 3.437758 304.2896  59.3  -2.523438      6.875517 0.98 
1 1 1 -11 1  26 o 71.78256 7.232551 154.8015  250.2 40.94114       14.46510 0.89 
1 1 1 -11 1  27 o 99.01871 4.982157 151.8100  110.3 -29.50500      9.964314 0.93 
1 1 1 -11 1  28 o 73.22119 9.209212 108.3342  90.4  -16.37041      18.41842 0.88 
1 1 1 -11 1  29 o 99.73006 6.626711 197.2156  317.5 -18.64751      13.25342 0.97 
1 1 1 -11 1  30 o 251.4709 5.049260 337.4651  321.6 -29.61473      10.09852 0.99 
1 1 1 -11 1  31 o 95.29871 8.389432 135.3630  338.3 14.52457       16.77886 0.93 
1 1 1 -11 1  32 o 74.61638 11.41981 60.34495  222.2 -17.59750      22.83961 0.81 
1 1 1 -11 1  33 o 72.76706 11.03267 66.46400  315.9 16.73811       22.06534 0.87 
1 1 1 -11 1  34 o 77.19235 12.59843 103.2646  59.4  10.35757       25.19686 0.94 
1 1 1 -11 1  35 o 40.16203 11.68183 24.26268  39.9  10.14370       23.36367 0.46 
1 1 1 -11 1  36 o 56.99017 12.36241 87.51017  267.4 -26.22122      24.72483 0.91 
1 1 1 -11 3  1  o 789.7831 5.799971 861.8610  275.0 -35.78369      11.59994 0.99 
1 1 1 -11 3  2  o 149.8304 2.148815 708.1110  140.2 27.77956       4.297630 0.91 
1 1 1 -11 3  3  o 401.5680 3.737561 550.1946  253.6 94.51044       7.475121 0.98 
1 1 1 -11 3  4  o 579.7965 4.753122 1275.823  252.6 -19.24213      9.506244 0.99 
1 1 1 -11 3  5  o 145.4355 2.164530 297.2087  193.3 -4.098679      4.329060 0.75 
1 1 1 -11 3  6  o 422.7110 4.024984 291.0181  78.7  3.455048       8.049968 0.98 
1 1 1 -11 3  7  o 300.3169 3.057727 496.4143  339.4 14.68915       6.115454 0.95 
1 1 1 -11 3  8  o 248.7764 2.774657 587.2231  323.6 35.50220       5.549315 0.94 
1 1 1 -11 3  9  o 134.3467 2.037014 149.6726  50.7  6.282715       4.074028 0.68 
1 1 1 -11 3  10 o 398.6591 3.750491 807.4744  331.7 64.56567       7.500983 0.97 
1 1 1 -11 3  11 o 368.6963 3.617236 736.3150  79.0  -3.096283      7.234471 0.96 
1 1 1 -11 3  12 o 341.2116 3.382184 851.1405  113.4 11.09784       6.764369 0.96 
1 1 1 -11 3  13 o 76.09361 2.512807 96.40167  326.7 17.76595       5.025613 0.23 
1 1 1 -11 3  14 o 302.3998 3.088243 321.5506  358.6 10.08112       6.176486 0.93 
1 1 1 -11 3  15 o 185.9698 3.201757 307.9779  81.2  -26.05882      6.403515 0.79 
1 1 1 -11 3  16 o 465.6233 4.285831 593.1237  16.8  33.35812       8.571662 0.98 
1 1 1 -11 3  17 o 339.6581 3.571788 424.8365  297.0 -22.28531      7.143576 0.95 
1 1 1 -11 3  18 o 94.63467 4.242196 188.1616  152.0 -1.520660      8.484391 0.49 
1 1 1 -11 3  19 o 274.1897 3.475075 249.5504  215.7 -1.620361      6.950150 0.93 
1 1 1 -11 3  20 o 511.6255 4.742530 850.5534  302.2 34.24677       9.485060 0.99 
1 1 1 -11 3  21 o 429.7287 4.180368 612.3723  286.2 -4.991577      8.360737 0.99 
1 1 1 -11 3  22 o 384.9778 3.928277 612.3139  343.2 -25.72781      7.856555 0.99 
1 1 1 -11 3  23 o 209.9316 3.041888 295.8109  343.3 2.596832       6.083776 0.97 
1 1 1 -11 3  24 o 372.1942 3.931334 557.2456  104.0 -8.503662      7.862669 0.99 
1 1 1 -11 3  25 o 56.19691 7.378155 55.55193  42.3  15.13071       14.75631 0.52 
1 1 1 -11 3  26 o 158.3673 3.898797 227.6815  307.4 -10.53606      7.797593 0.97 
1 1 1 -11 3  27 o 209.6104 3.345163 304.2532  219.6 -6.933517      6.690326 0.99 
1 1 1 -11 3  28 o 115.0378 6.135288 167.7267  202.4 53.07223       12.27058 0.96 
1 1 1 -11 3  29 o 198.3899 4.382248 245.5111  62.9  11.09619       8.764497 0.99 
1 1 1 -11 3  30 o 49.38027 10.69740 46.97114  88.1  2.489071       21.39479 0.52 
1 1 1 -11 3  31 o 143.8808 5.341005 142.6556  68.2  3.635651       10.68201 0.96 
1 1 1 -11 3  32 o 193.4034 4.957215 191.7862  49.9  13.17746       9.914431 0.98 
1 1 1 -11 3  33 f 156.0571 8.430588 113.2671  16.9  -2.667358      16.86118 0.00 
1 1 1 -11 3  34 o 166.3058 6.170763 179.9133  347.2 -36.96709      12.34153 0.99 
1 1 1 -11 3  35 o 41.46852 11.67811 37.89084  64.6  -7.106564      23.35621 0.65 
1 1 1 -11 3  36 o 50.31725 12.69022 37.21337  58.6  ?              ?        0.74 
1 1 1 -11 5  1  o 301.9313 2.852755 860.6297  27.5  -49.03143      5.705511 0.97 
1 1 1 -11 5  2  o 351.8342 3.159355 390.8920  80.2  -77.86285      6.318710 0.97 
1 1 1 -11 5  3  f 213.4229 2.338370 493.7795  239.9 -19.67279      4.676741 0.00 
1 1 1 -11 5  4  o 334.1492 2.742311 733.8561  261.6 -78.56406      5.484621 0.97 
1 1 1 -11 5  5  f 433.5092 3.626788 1187.584  151.5 -13.97321      7.253575 0.00 
1 1 1 -11 5  6  o 234.2488 2.300963 739.3109  199.5 9.321915       4.601926 0.94 
1 1 1 -11 5  7  o 289.4088 2.657467 820.9546  130.4 10.36096       5.314933 0.96 
1 1 1 -11 5  8  o 62.78131 4.317146 180.6295  138.6 -72.95707      8.634293 0.23 
1 1 1 -11 5  9  o 600.3518 5.091368 1026.191  220.8 12.27094       10.18274 0.99 
1 1 1 -11 5  10 o 776.4235 6.371201 1134.135  78.4  6.513611       12.74240 0.99 
1 1 1 -11 5  11 f 48.30067 3.812489 282.2681  304.9 4.594196       7.624979 0.00 
1 1 1 -11 5  12 o 773.6453 8.103450 1138.652  308.9 71.23981       16.20690 0.99 
1 1 1 -11 5  13 o 297.2876 3.162523 533.0164  322.7 -53.17398      6.325046 0.95 
1 1 1 -11 5  14 o 292.2449 3.801179 544.6034  218.2 15.65781       7.602359 0.95 
1 1 1 -11 5  15 o 195.8284 2.610876 484.3595  273.8 28.68999       5.221751 0.91 
1 1 1 -11 5  16 o 462.1542 5.115553 715.3873  26.8  42.60416       10.23111 0.98 
1 1 1 -11 5  17 o 234.3780 3.035008 347.3529  171.3 48.03804       6.070015 0.93 
1 1 1 -11 5  18 o 108.8177 3.200404 225.9126  153.3 -29.47614      6.400809 0.83 
1 1 1 -11 5  19 o 85.82265 4.041385 214.1056  323.4 29.47501       8.082770 0.75 
1 1 1 -11 5  20 f 165.5045 3.044151 212.3352  34.8  37.49834       6.088302 0.00 
1 1 1 -11 5  21 o 168.7633 3.216307 303.7880  3.0   33.79341       6.432615 0.97 
1 1 1 -11 5  22 o 220.5270 3.123663 311.6265  48.1  0.9654236E-01  6.247327 0.98 
1 1 1 -11 5  23 o 295.1768 3.377712 372.3064  357.4 -7.497406      6.755425 0.99 
1 1 1 -11 5  24 o 103.0340 4.860820 242.7176  322.0 65.21076       9.721640 0.95 
1 1 1 -11 5  25 o 175.3499 3.685061 205.4308  48.4  -19.91537      7.370123 0.97 
1 1 1 -11 5  26 o 268.3712 4.274369 412.2784  303.1 -13.20859      8.548738 0.99 
1 1 1 -11 5  27 f 151.0382 4.562129 255.4048  294.8 6.699356       9.124257 0.00 
1 1 1 -11 5  28 f 59.71743 8.527672 71.77923  74.0  -39.75322      17.05534 0.00 
1 1 1 -11 5  29 f 122.3763 5.344938 178.1750  108.2 -5.465050      10.68988 0.00 
1 1 1 -11 5  30 o 130.7813 5.241943 145.2131  353.0 -0.3643646     10.48389 0.96 
1 1 1 -11 5  31 o 39.89564 15.39184 42.72231  294.9 ?              ?        0.50 
1 1 1 -11 5  32 o 79.59885 8.237708 76.50623  202.8 5.472710       16.47542 0.92 
1 1 1 -11 5  33 f 89.01466 8.866926 154.9160  160.7 7.684814       17.73385 0.00 
1 1 1 -11 5  34 o 43.27893 12.30009 20.97538  52.6  4.982307       24.60017 0.44 
1 1 1 -11 5  35 o 40.00648 11.91162 52.08137  267.1 ?              ?        0.77 
1 1 1 -11 7  1  o 704.5192 6.204534 930.8665  1.2   -22.91687      12.40907 0.99 
1 1 1 -11 7  2  f 314.7969 3.214531 161.8977  207.3 -44.71179      6.429063 0.00 
1 1 1 -11 7  3  o 800.9570 6.231505 1188.387  175.6 49.27307       12.46301 0.99 
1 1 1 -11 7  4  o 498.9160 4.121546 701.6492  228.3 -8.888275      8.243092 0.98 
1 1 1 -11 7  5  o 367.0579 3.332299 600.0601  57.7  -10.10983      6.664598 0.97 
1 1 1 -11 7  6  o 366.5667 3.215988 552.2945  283.8 56.85590       6.431977 0.96 
1 1 1 -11 7  7  o 545.7405 5.696668 753.8706  265.7 73.18356       11.39334 0.99 
1 1 1 -11 7  8  o 198.2922 3.106394 455.8773  147.0 -9.688049      6.212788 0.93 
1 1 1 -11 7  9  o 139.3573 3.096061 326.4291  196.9 -25.17441      6.192121 0.87 
1 1 1 -11 7  10 o 125.3821 2.097009 251.3747  243.1 28.71710       4.194018 0.83 
1 1 1 -11 7  11 o 363.3907 3.087283 523.1251  203.7 17.06506       6.174565 0.96 
1 1 1 -11 7  12 o 368.5719 3.404242 734.5851  95.0  -38.68549      6.808483 0.98 
1 1 1 -11 7  13 o 575.9852 4.881178 831.4695  54.8  -81.04736      9.762356 0.99 
1 1 1 -11 7  14 f 135.7567 2.719717 154.2329  250.1 -10.10161      5.439433 0.00 
1 1 1 -11 7  15 o 255.2574 2.951463 398.3481  264.8 -34.20306      5.902925 0.95 
1 1 1 -11 7  16 o 173.9339 2.820039 363.1823  195.1 48.20836       5.640078 0.94 
1 1 1 -11 7  17 o 285.5323 3.156660 456.4315  159.5 31.37399       6.313319 0.98 
1 1 1 -11 7  18 o 135.2408 3.042082 314.2765  158.1 -13.83467      6.084164 0.95 
1 1 1 -11 7  19 o 187.2526 2.882408 289.6023  42.3  4.265808       5.764816 0.97 
1 1 1 -11 7  20 o 150.2137 3.015420 282.8523  285.0 -10.51997      6.030840 0.96 
1 1 1 -11 7  21 o 73.39711 5.354328 84.97946  6.6   32.44457       10.70866 0.75 
1 1 1 -11 7  22 o 153.4253 3.622589 216.9757  97.9  13.98581       7.245178 0.97 
1 1 1 -11 7  23 o 83.84270 5.040771 161.9963  83.4  -16.40598      10.08154 0.93 
1 1 1 -11 7  24 o 46.48112 8.792270 77.02698  108.6 -3.721764      17.58454 0.69 
1 1 1 -11 7  25 o 172.5017 3.322581 234.5031  305.7 -31.30321      6.645161 0.98 
1 1 1 -11 7  26 o 120.2511 4.261724 126.6266  227.4 -18.55440      8.523447 0.96 
1 1 1 -11 7  27 o 89.96643 9.095477 97.36065  160.9 ?              ?        0.90 
1 1 1 -11 7  28 o 86.34531 7.328931 135.0639  31.6  44.10829       14.65786 0.93 
1 1 1 -11 7  29 o 28.27689 8.968065 39.10970  122.0 -3.200474      17.93613 0.37 
1 1 1 -11 7  30 o 110.8636 6.695209 168.0147  94.5  13.10769       13.39042 0.97 
1 1 1 -11 7  31 o 39.73926 10.56930 108.2410  8.9   9.052555       21.13860 0.89 
1 1 1 -11 7  32 o 75.48212 9.144837 98.65668  336.5 -15.66216      18.28967 0.94 
1 1 1 -11 7  33 o 43.72670 11.80098 68.43199  143.7 15.72334       23.60196 0.84 
1 1 1 -11 7  34 o 99.83478 7.850974 158.7443  358.0 ?              ?        0.98 
1 1 1 -11 9  1  o 563.9001 5.021738 875.0862  131.4 -38.71069      10.04348 0.99 
1 1 1 -11 9  2  o 215.9064 2.854634 430.1469  68.3  7.611206       5.709269 0.94 
1 1 1 -11 9  3  o 482.2466 4.503212 818.5413  36.1  63.59509       9.006425 0.99 
1 1 1 -11 9  4  o 627.4502 5.589250 976.7041  36.2  71.23999       11.17850 0.99 
1 1 1 -11 9  5  o 225.7373 2.589647 401.5375  72.6  68.85378       5.179295 0.93 
1 1 1 -11 9  6  o 232.0111 3.220243 435.1746  136.7 ?              ?        0.95 
1 1 1 -11 9  7  o 152.6624 2.705068 404.6128  280.1 -13.92351      5.410137 0.91 
1 1 1 -11 9  8  o 109.9789 4.583214 198.0020  285.7 -30.09664      9.166428 0.76 
1 1 1 -11 9  9  o 93.34090 5.150413 259.8564  279.4 -45.06274      10.30083 0.79 
1 1 1 -11 9  10 o 66.51375 7.316237 63.03757  207.1 -37.11280      14.63247 0.27 
1 1 1 -11 9  11 o 199.6508 3.781105 357.0050  72.9  29.48387       7.562210 0.95 
1 1 1 -11 9  12 o 92.93672 6.368513 170.4041  72.6  -27.75420      12.73703 0.76 
1 1 1 -11 9  13 o 152.4284 4.851498 295.0686  138.8 -28.94237      9.702996 0.94 
1 1 1 -11 9  14 o 305.0186 4.860533 502.2245  163.5 1.514038       9.721066 0.99 
1 1 1 -11 9  15 o 133.9975 4.973183 174.8083  110.8 47.16253       9.946366 0.93 
1 1 1 -11 9  16 o 58.87349 10.58059 111.5138  18.3  9.115265       21.16117 0.70 
1 1 1 -11 9  17 o 256.7081 2.857289 381.6453  161.5 -24.91426      5.714579 0.99 
1 1 1 -11 9  18 o 190.2255 3.228612 304.2957  168.9 24.12939       6.457223 0.98 
1 1 1 -11 9  19 o 164.4470 3.401089 250.4651  91.3  2.187729       6.802178 0.97 
1 1 1 -11 9  20 o 236.3328 3.314492 412.3844  186.4 -38.25485      6.628983 0.99 
1 1 1 -11 9  21 o 179.8169 3.467031 295.0429  205.6 0.2578735E-01  6.934063 0.98 
1 1 1 -11 9  22 o 163.0712 3.780808 239.0038  0.7   -12.37604      7.561615 0.98 
1 1 1 -11 9  23 o 42.35070 8.822942 50.53440  129.9 9.118706       17.64588 0.65 
1 1 1 -11 9  24 o 132.2263 3.913176 221.9397  155.0 -3.616364      7.826352 0.98 
1 1 1 -11 9  25 o 98.97897 5.022707 126.8765  216.9 9.975716       10.04541 0.93 
1 1 1 -11 9  26 o 81.71805 5.730978 127.2930  266.4 -5.788536      11.46196 0.93 
1 1 1 -11 9  27 o 81.78062 6.599130 124.6228  165.3 -20.95388      13.19826 0.94 
1 1 1 -11 9  28 o 40.94817 9.588443 84.57967  173.2 8.809757       19.17689 0.83 
1 1 1 -11 9  29 o 104.7705 5.971934 139.5390  163.5 1.565491       11.94387 0.97 
1 1 1 -11 9  30 o 35.67561 9.990679 63.19506  227.4 7.479685       19.98136 0.79 
1 1 1 -11 9  31 f 24.98628 8.422876 50.42122  214.3 2.607109       16.84575 0.00 
1 1 1 -11 9  32 o 79.17275 7.344351 118.8706  177.4 ?              ?        0.97 
1 1 1 -11 11 1  f 244.1592 3.164857 380.4483  279.2 -23.13019      6.329715 0.00 
1 1 1 -11 11 2  o 250.1375 3.100935 504.3323  241.0 65.48769       6.201870 0.99 
1 1 1 -11 11 3  o 178.2823 2.912333 408.0192  316.5 -9.026886      5.824667 0.97 
1 1 1 -11 11 4  o 113.0659 4.378829 192.7334  311.9 -21.30723      8.757658 0.92 
1 1 1 -11 11 5  f 196.1151 2.716224 371.7841  334.9 -14.06216      5.432449 0.00 
1 1 1 -11 11 6  o 148.0474 3.172927 262.9317  97.3  -22.19212      6.345854 0.96 
1 1 1 -11 11 7  o 101.5869 3.106995 193.0276  217.4 5.117676       6.213990 0.92 
1 1 1 -11 11 8  o 245.0034 3.434624 402.4747  179.1 -8.671310      6.869249 0.99 
1 1 1 -11 11 9  o 127.1348 4.454396 288.8100  98.9  -44.53496      8.908792 0.96 
1 1 1 -11 11 10 o 110.4454 5.456160 71.12912  77.3  -56.94741      10.91232 0.80 
1 1 1 -11 11 11 o 234.0937 3.965870 504.5570  150.1 -6.357132      7.931739 0.99 
1 1 1 -11 11 12 o 173.6426 4.636842 273.2253  61.5  -20.31595      9.273684 0.97 
1 1 1 -11 11 13 o 78.10567 10.21957 179.3393  68.4  -25.76695      20.43914 0.90 
1 1 1 -11 11 14 o 215.9219 5.171374 407.2149  194.6 32.26427       10.34275 0.99 
1 1 1 -11 11 15 o 192.3900 5.013494 381.9070  232.1 3.007278       10.02699 0.99 
1 1 1 -11 11 16 o 180.6718 5.918143 299.1247  328.1 -5.190262      11.83629 0.98 
1 1 1 -11 11 17 o 107.7064 8.006659 193.8016  33.0  -14.70788      16.01332 0.96 
1 1 1 -11 11 18 o 224.4742 5.111141 413.6250  201.5 -5.719345      10.22228 0.99 
1 1 1 -11 11 19 o 85.00960 10.96563 170.7316  221.3 -34.14706      21.93126 0.95 
1 1 1 -11 11 20 o 147.4125 7.171826 279.9182  15.9  4.289490       14.34365 0.99 
1 1 1 -11 11 21 o 135.8657 8.248575 256.3372  55.3  ?              ?        0.98 
1 1 1 -11 11 22 o 114.4174 10.41672 202.6737  166.7 ?              ?        0.96 
1 1 1 -11 11 23 o 77.03914 11.48575 121.5997  249.9 -23.07602      22.97149 0.91 
1 1 1 -11 11 24 o 73.55927 5.974563 110.5701  211.7 -21.30614      11.94913 0.93 
1 1 1 -11 11 25 o 42.51417 9.812346 39.94851  309.6 -11.12217      19.62469 0.63 
1 1 1 -11 11 26 f 33.01323 10.07672 50.72770  70.5  0.9291458      20.15345 0.00 
1 1 1 -11 11 27 o 46.21001 10.85416 20.32348  43.5  15.70473       21.70831 0.50 
1 1 1 -11 11 28 o 43.60788 9.785652 94.17376  350.8 30.23244       19.57130 0.90 
1 1 1 -11 11 29 o 57.62231 11.20883 99.90623  66.4  -1.642673      22.41767 0.93 
1 1 1 -11 11 30 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -11 13 1  o 97.89201 4.051141 212.8466  326.6 4.621780       8.102283 0.96 
1 1 1 -11 13 2  f 158.4158 3.280023 280.6853  201.3 8.738876       6.560045 0.00 
1 1 1 -11 13 3  o 175.3036 3.194531 338.3344  257.4 -0.5175629     6.389063 0.99 
1 1 1 -11 13 4  o 120.2631 4.202830 237.2654  45.1  -35.16099      8.405660 0.97 
1 1 1 -11 13 5  o 100.5668 4.387732 227.3719  73.4  -21.56272      8.775464 0.96 
1 1 1 -11 13 6  o 80.03511 4.445199 224.3524  55.5  -8.977272      8.890397 0.95 
1 1 1 -11 13 7  o 133.0141 3.199714 315.6296  67.1  19.23004       6.399427 0.98 
1 1 1 -11 13 8  o 47.66609 7.300130 152.5782  39.0  -17.08484      14.60026 0.88 
1 1 1 -11 13 9  o 97.65421 3.579015 175.7243  0.1   25.16987       7.158031 0.95 
1 1 1 -11 13 10 o 103.4321 5.397795 143.3528  317.9 40.91987       10.79559 0.95 
1 1 1 -11 13 11 o 119.6322 6.859919 258.7689  50.9  -15.33798      13.71984 0.98 
1 1 1 -11 13 12 f 118.9982 6.794462 214.7644  2.7   -5.281830      13.58892 0.00 
1 1 1 -11 13 13 o 200.1714 5.449642 309.9278  277.1 -0.4859314     10.89928 0.99 
1 1 1 -11 13 14 o 76.35355 13.11380 66.89089  97.5  2.157021       26.22760 0.87 
1 1 1 -11 13 15 o 195.6790 6.954491 314.9869  56.4  ?              ?        0.99 
1 1 1 -11 13 16 o 117.4321 7.825620 276.3075  106.7 -3.143478      15.65124 0.98 
1 1 1 -11 13 17 o 51.05977 13.43598 78.11238  236.6 12.32888       26.87197 0.75 
1 1 1 -11 13 18 o 35.65370 11.42015 47.58430  320.1 1.975025       22.84030 0.49 
1 1 1 -11 13 19 o 59.86012 11.06011 138.9489  64.0  -35.97584      22.12021 0.91 
1 1 1 -11 13 20 o 153.5021 11.41484 230.3024  335.8 ?              ?        0.98 
1 1 1 -11 13 21 o 66.64490 11.92470 145.2091  304.7 -40.40044      23.84940 0.94 
1 1 1 -11 13 22 o 185.0819 7.553384 322.5398  315.4 -4.770309      15.10677 0.99 
1 1 1 -11 13 23 o 137.1031 10.98449 225.1308  337.6 -48.52075      21.96898 0.99 
1 1 1 -11 13 24 o 42.49716 12.83788 99.74799  3.5   -14.39737      25.67576 0.89 
1 1 1 -11 13 25 o 60.23999 13.99922 140.8135  37.7  -12.26769      27.99843 0.94 
1 1 1 -11 13 26 o 47.61649 14.86432 97.91201  111.6 ?              ?        0.90 
1 1 1 -11 15 1  o 44.66622 12.59829 135.6013  81.5  ?              ?        0.86 
1 1 1 -11 15 2  o 157.5721 4.119540 278.4666  124.4 29.33934       8.239079 0.99 
1 1 1 -11 15 3  o 131.4521 4.526288 257.2739  102.4 28.25524       9.052576 0.98 
1 1 1 -11 15 4  o 43.22212 9.521694 83.44854  44.4  -16.51312      19.04339 0.77 
1 1 1 -11 15 5  f 32.67643 9.397878 73.20023  183.1 4.196619       18.79576 0.00 
1 1 1 -11 15 6  o 108.9726 4.352338 148.5061  174.3 9.474838       8.704676 0.96 
1 1 1 -11 15 7  o 93.14375 4.724815 153.9028  148.5 4.271317       9.449631 0.95 
1 1 1 -11 15 8  o 58.52293 7.392871 91.14555  189.5 15.72140       14.78574 0.86 
1 1 1 -11 15 9  o 62.78120 7.070259 124.4242  15.4  -10.33693      14.14052 0.91 
1 1 1 -11 15 10 o 116.9696 8.621188 174.5672  0.2   -12.98103      17.24238 0.97 
1 1 1 -11 15 11 o 97.80330 7.278246 195.1689  63.2  2.089027       14.55649 0.97 
1 1 1 -11 15 12 o 60.28407 12.97937 135.6078  45.5  -13.09676      25.95873 0.91 
1 1 1 -11 15 13 o 117.3655 9.586658 199.0295  355.4 -14.77077      19.17332 0.98 
1 1 1 -11 15 14 f 72.79898 14.09743 49.99464  6.6   16.30869       28.19487 0.00 
1 1 1 -11 15 15 o 134.2084 9.377583 201.4984  246.1 -27.89207      18.75517 0.98 
1 1 1 -11 15 16 o 38.38284 12.70232 40.18378  147.7 17.21118       25.40464 0.62 
1 1 1 -11 15 17 o 41.43225 19.11113 147.1177  7.3   ?              ?        0.89 
1 1 1 -11 15 18 o 106.6320 23.24949 219.1333  330.6 ?              ?        0.97 
1 1 1 -11 15 19 o 39.32248 18.79989 109.4350  21.4  ?              ?        0.84 
1 1 1 -11 15 20 f 65.10145 14.42554 151.7822  95.5  -16.31043      28.85108 0.00 
1 1 1 -11 15 21 o 46.85799 14.04751 24.36144  328.2 10.43364       28.09503 0.54 
1 1 1 -11 15 22 o 37.67958 16.55713 64.28254  23.9  ?              ?        0.75 
1 1 1 -11 17 1  f 48.74631 10.49806 51.58871  145.5 14.65376       20.99611 0.00 
1 1 1 -11 17 2  o 101.4800 6.560272 201.0827  106.3 5.082451       13.12054 0.98 
1 1 1 -11 17 3  o 44.85087 12.32468 83.29717  195.8 5.397789       24.64936 0.88 
1 1 1 -11 17 4  f 55.25280 10.80631 95.69814  239.3 8.641701       21.61263 0.00 
1 1 1 -11 17 5  o 86.58405 7.915728 168.0638  238.5 -11.88022      15.83146 0.98 
1 1 1 -11 17 6  o 77.66317 7.349992 199.0363  246.9 17.08266       14.69998 0.98 
1 1 1 -11 17 7  o 115.8243 4.735704 269.3066  219.7 21.53104       9.471409 0.99 
1 1 1 -11 17 8  o 36.46523 9.717746 68.01807  105.8 5.712711       19.43549 0.84 
1 1 1 -11 17 9  o 91.16933 5.741055 153.0439  89.5  4.564125       11.48211 0.98 
1 1 1 -11 17 10 o 75.77811 6.123621 108.2543  146.4 1.199028       12.24724 0.96 
1 1 1 -11 17 11 o 75.67732 12.52082 161.3376  210.6 -2.669411      25.04164 0.96 
1 1 1 -11 17 12 o 66.04666 14.17443 154.1209  158.7 -18.90604      28.34887 0.95 
1 1 1 -11 17 13 o 45.39461 12.59189 94.57705  119.3 -15.78431      25.18378 0.90 
1 1 1 -11 17 14 o 62.74277 15.98163 70.15740  115.9 ?              ?        0.88 
1 1 1 -11 17 15 o 39.12864 18.90540 27.16500  8.6   ?              ?        0.40 
1 1 1 -11 17 16 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -10 0  1  o 923.0970 11.80773 3094.888  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  2  o 150.5746 3.726470 137.0694  0.0   -0.000000      0.000000 0.89 
1 1 1 -10 0  3  o 112.0139 3.102044 298.0186  180.0 -0.000000      0.000000 0.97 
1 1 1 -10 0  4  o 686.2355 9.193182 1788.029  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  5  o 451.2997 6.348944 834.1451  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  6  o 736.5187 9.616419 1588.864  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  7  o 217.6726 3.638947 289.2760  360.0 -0.000000      0.000000 0.63 
1 1 1 -10 0  8  o 80.40881 2.995670 151.8949  0.0   -0.000000      0.000000 0.56 
1 1 1 -10 0  9  o 400.3488 5.845784 279.9610  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  10 o 525.0121 7.169199 669.8182  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  11 o 680.7727 8.861570 1687.781  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  12 o 178.5533 3.739695 191.6132  180.0 -0.000000      0.000000 0.71 
1 1 1 -10 0  13 o 233.6190 4.305442 445.4977  0.0   -0.000000      0.000000 0.95 
1 1 1 -10 0  14 o 154.2543 3.637123 440.7779  0.0   -0.000000      0.000000 0.96 
1 1 1 -10 0  15 o 111.5279 3.195822 680.9323  360.0 -0.000000      0.000000 0.98 
1 1 1 -10 0  16 o 687.3011 8.855005 849.3602  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  17 o 258.1085 4.379244 438.2972  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  18 x ?        ?        1148.905  0.0   ?              ?        0.00 
1 1 1 -10 0  19 o 503.7111 6.871751 627.8027  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  20 o 94.05566 4.562041 328.8187  180.0 -0.000000      0.000000 0.87 
1 1 1 -10 0  21 o 325.7634 5.026493 348.4490  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  22 o 93.72359 5.738537 52.19178  0.0   -0.000000      0.000000 0.35 
1 1 1 -10 0  23 o 483.8737 6.546576 557.8641  360.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  24 o 260.7530 4.676507 263.3436  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  25 o 106.4556 6.141873 27.97332  180.0 -0.000000      0.000000 0.57 
1 1 1 -10 0  26 o 156.1310 5.196693 221.1598  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  27 o 293.7856 5.726875 398.1944  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  28 o 16.81925 11.84700 74.34874  180.0 -0.000000      0.000000 0.34 
1 1 1 -10 0  29 o 42.40763 18.71006 41.08368  180.0 -0.000000      0.000000 0.54 
1 1 1 -10 0  30 o 257.0647 5.958309 304.4131  0.0   -0.000000      0.000000 1.00 
1 1 1 -10 0  31 o 129.0128 7.498583 76.45189  360.0 -0.000000      0.000000 0.99 
1 1 1 -10 0  32 o 144.1991 7.255775 135.8023  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  33 o 80.90629 14.81496 57.26911  0.0   -0.000000      0.000000 0.97 
1 1 1 -10 0  34 o 87.60260 15.59710 81.77135  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  35 o 74.03750 17.44233 94.01982  180.0 -0.000000      0.000000 1.00 
1 1 1 -10 0  36 o 50.58632 23.99797 8.774076  0.0   ?              ?        0.20 
1 1 1 -10 2  1  o 559.3669 4.480487 507.4755  323.4 7.418213       8.960974 0.99 
1 1 1 -10 2  2  o 368.4862 3.692068 790.3015  304.6 -29.23474      7.384136 0.96 
1 1 1 -10 2  3  o 367.8853 3.924214 841.3566  153.6 67.45413       7.848427 0.98 
1 1 1 -10 2  4  o 125.0385 3.058741 529.2180  200.9 ?              ?        0.81 
1 1 1 -10 2  5  o 465.0016 4.443208 650.3207  56.0  -5.068115      8.886416 0.98 
1 1 1 -10 2  6  o 500.8918 4.762635 391.6044  340.2 41.55194       9.525270 0.98 
1 1 1 -10 2  7  o 437.7638 4.187576 707.9261  71.1  -22.15085      8.375152 0.98 
1 1 1 -10 2  8  o 255.5902 4.071551 940.5984  52.8  ?              ?        0.94 
1 1 1 -10 2  9  o 314.7054 3.296563 417.7146  103.2 -15.49414      6.593126 0.95 
1 1 1 -10 2  10 o 31.85258 3.707253 273.7808  68.2  -30.95573      7.414506 0.01 
1 1 1 -10 2  11 o 122.2246 2.088968 335.1992  83.4  -11.78800      4.177935 0.81 
1 1 1 -10 2  12 f 356.2972 3.702399 327.7636  234.8 35.81778       7.404798 0.00 
1 1 1 -10 2  13 o 548.5681 5.041585 813.1911  130.8 38.02142       10.08317 0.98 
1 1 1 -10 2  14 o 272.1553 3.008632 448.0916  41.5  -97.44365      6.017264 0.92 
1 1 1 -10 2  15 f 683.7791 7.258954 854.0914  126.0 -29.60663      14.51791 0.00 
1 1 1 -10 2  16 o 358.1775 3.491473 424.9346  134.9 -36.37991      6.982947 0.95 
1 1 1 -10 2  17 o 648.2206 5.831437 883.6004  136.4 -5.916870      11.66287 0.99 
1 1 1 -10 2  18 o 570.0403 6.172999 779.7593  227.2 -32.70001      12.34600 0.99 
1 1 1 -10 2  19 o 538.6317 4.822247 811.3766  130.5 14.69965       9.644493 0.99 
1 1 1 -10 2  20 o 206.8232 3.019933 240.9052  65.4  -66.07230      6.039865 0.89 
1 1 1 -10 2  21 o 139.8232 3.104410 140.9841  143.0 49.25158       6.208819 0.82 
1 1 1 -10 2  22 o 241.5899 3.122450 315.9366  116.7 -27.81512      6.244900 0.97 
1 1 1 -10 2  23 o 183.4425 3.185391 277.8543  117.1 -16.23175      6.370782 0.97 
1 1 1 -10 2  24 o 123.2402 4.723814 236.5677  210.7 27.36348       9.447627 0.94 
1 1 1 -10 2  25 o 168.9858 3.309255 174.0567  134.7 15.23503       6.618510 0.95 
1 1 1 -10 2  26 o 231.7996 3.404406 328.6709  39.4  -10.83221      6.808811 0.99 
1 1 1 -10 2  27 o 189.9357 3.490521 227.5765  299.5 19.32437       6.981042 0.98 
1 1 1 -10 2  28 o 346.1658 4.035942 449.0741  211.6 20.74466       8.071884 1.00 
1 1 1 -10 2  29 o 28.25399 9.091787 19.84895  138.3 13.36873       18.18357 0.20 
1 1 1 -10 2  30 o 173.3977 4.929581 203.5325  33.7  -22.24437      9.859161 0.97 
1 1 1 -10 2  31 o 131.7159 6.607450 140.1468  202.9 25.11265       13.21490 0.96 
1 1 1 -10 2  32 o 42.95621 11.41840 62.24259  338.7 11.86018       22.83679 0.68 
1 1 1 -10 2  33 o 199.3067 5.109526 217.7743  32.0  -20.25272      10.21905 0.99 
1 1 1 -10 2  34 o 109.9038 7.809328 128.2684  5.0   19.95947       15.61866 0.97 
1 1 1 -10 2  35 o 67.77951 12.66371 75.92552  37.7  -5.119530      25.32741 0.90 
1 1 1 -10 2  36 o 27.57221 9.637983 23.58831  208.1 ?              ?        0.40 
1 1 1 -10 4  1  o 689.8300 5.755542 758.1243  22.6  -22.24603      11.51108 0.99 
1 1 1 -10 4  2  o 422.0423 3.878885 814.6465  121.3 54.50989       7.757770 0.98 
1 1 1 -10 4  3  o 155.9700 1.733910 234.0427  128.7 -7.126907      3.467821 0.84 
1 1 1 -10 4  4  o 91.12313 1.897967 585.9014  312.3 -2.732208      3.795934 0.81 
1 1 1 -10 4  5  o 107.2737 1.842154 514.2661  270.4 19.63714       3.684308 0.74 
1 1 1 -10 4  6  o 295.3316 2.966125 820.5103  335.8 37.18439       5.932250 0.95 
1 1 1 -10 4  7  o 211.1304 2.444724 319.3249  4.9   -66.63565      4.889448 0.89 
1 1 1 -10 4  8  o 447.2521 4.042856 501.5146  62.9  4.508789       8.085711 0.97 
1 1 1 -10 4  9  o 362.4704 3.484583 712.0336  274.1 31.54517       6.969167 0.97 
1 1 1 -10 4  10 o 345.9551 3.410959 677.4398  26.9  43.72498       6.821918 0.97 
1 1 1 -10 4  11 o 450.8695 4.033556 581.4821  141.1 7.956665       8.067111 0.97 
1 1 1 -10 4  12 o 442.6937 4.096274 429.5164  34.6  41.83072       8.192548 0.97 
1 1 1 -10 4  13 o 721.7115 6.073966 1121.689  306.7 4.127258       12.14793 0.99 
1 1 1 -10 4  14 o 41.35755 4.636162 72.65706  13.2  -12.30708      9.272324 0.15 
1 1 1 -10 4  15 o 370.1472 4.596487 678.9760  297.7 21.13467       9.192973 0.97 
1 1 1 -10 4  16 o 235.8769 2.924504 273.2660  255.5 -116.1158      5.849007 0.90 
1 1 1 -10 4  17 o 438.3864 4.189356 637.3141  109.7 -2.762207      8.378713 0.98 
1 1 1 -10 4  18 o 449.5409 4.254777 751.7448  61.9  6.283600       8.509555 0.98 
1 1 1 -10 4  19 o 129.4781 3.104779 166.4914  107.4 22.74141       6.209559 0.71 
1 1 1 -10 4  20 o 262.7112 3.007989 356.8251  231.4 -75.26442      6.015977 0.96 
1 1 1 -10 4  21 o 392.5787 3.845001 545.9138  264.8 -0.9146423     7.690002 0.99 
1 1 1 -10 4  22 o 64.10569 5.990788 91.13148  203.6 -72.84972      11.98158 0.67 
1 1 1 -10 4  23 o 211.7270 4.430123 285.6213  356.7 37.15591       8.860247 0.97 
1 1 1 -10 4  24 o 63.92497 6.723279 46.83497  358.6 28.14412       13.44656 0.51 
1 1 1 -10 4  25 o 263.2192 3.535760 330.2401  19.0  -10.16574      7.071521 0.99 
1 1 1 -10 4  26 o 183.2737 4.540396 261.3069  11.8  62.32956       9.080791 0.98 
1 1 1 -10 4  27 o 95.40945 6.514012 96.68364  64.8  30.85707       13.02802 0.91 
1 1 1 -10 4  28 f 43.02549 9.740187 29.64836  178.4 -29.40572      19.48037 0.00 
1 1 1 -10 4  29 o 94.07140 6.736876 148.2497  357.2 18.83667       13.47375 0.94 
1 1 1 -10 4  30 o 117.8301 5.339699 81.66260  325.8 1.347054       10.67940 0.91 
1 1 1 -10 4  31 o 61.86773 10.93689 80.87129  182.5 6.264030       21.87378 0.83 
1 1 1 -10 4  32 o 149.6705 5.454262 209.3366  292.2 16.17432       10.90852 0.98 
1 1 1 -10 4  33 o 110.9396 7.510208 132.5292  322.1 7.970787       15.02042 0.97 
1 1 1 -10 4  34 o 50.07799 12.91624 85.98412  262.7 -0.7001915     25.83248 0.88 
1 1 1 -10 4  35 o 30.70579 9.972409 69.01993  284.3 0.5568981      19.94482 0.78 
1 1 1 -10 6  1  o 175.3508 3.297037 95.60659  108.4 ?              ?        0.85 
1 1 1 -10 6  2  o 265.8041 2.863524 134.5054  309.6 10.42453       5.727048 0.80 
1 1 1 -10 6  3  o 364.4014 3.304644 620.4067  86.8  49.01242       6.609289 0.97 
1 1 1 -10 6  4  o 542.5698 4.428758 612.3463  72.5  14.37268       8.857516 0.98 
1 1 1 -10 6  5  o 428.8495 3.707180 881.1163  54.2  35.96344       7.414360 0.98 
1 1 1 -10 6  6  o 298.9421 3.602235 401.4793  219.4 24.53406       7.204471 0.96 
1 1 1 -10 6  7  o 346.7156 3.083180 379.3055  166.8 23.82248       6.166360 0.95 
1 1 1 -10 6  8  o 164.0696 2.113907 380.4383  230.9 17.98935       4.227814 0.81 
1 1 1 -10 6  9  o 918.1545 8.509288 1569.664  317.2 -24.88055      17.01858 0.99 
1 1 1 -10 6  10 o 433.7426 3.865400 421.8752  355.0 -25.39783      7.730800 0.97 
1 1 1 -10 6  11 o 407.7628 3.610367 473.0767  89.9  -7.528992      7.220733 0.98 
1 1 1 -10 6  12 o 405.2393 3.694758 432.2339  35.2  16.45132       7.389516 0.97 
1 1 1 -10 6  13 o 319.3821 3.904611 555.3618  193.6 76.25986       7.809221 0.97 
1 1 1 -10 6  14 o 578.5436 5.051627 871.1227  185.6 43.44855       10.10325 0.99 
1 1 1 -10 6  15 o 117.9850 2.851856 126.0107  37.3  -2.258286      5.703711 0.60 
1 1 1 -10 6  16 o 466.8121 4.448600 672.3495  22.6  22.94946       8.897200 0.98 
1 1 1 -10 6  17 o 153.4155 2.644550 56.82339  240.2 -48.42242      5.289099 0.38 
1 1 1 -10 6  18 o 46.62515 6.157239 78.06853  80.8  -28.45206      12.31448 0.16 
1 1 1 -10 6  19 o 460.1919 4.370207 541.8153  111.2 35.93192       8.740414 0.99 
1 1 1 -10 6  20 o 173.6022 2.973455 272.5509  164.5 -6.665100      5.946911 0.97 
1 1 1 -10 6  21 o 255.8486 3.159659 381.7982  323.1 1.007965       6.319318 0.98 
1 1 1 -10 6  22 o 360.3242 3.700004 554.1483  324.6 -17.00812      7.400008 0.99 
1 1 1 -10 6  23 f 219.2935 3.183461 324.8504  41.6  -55.31119      6.366922 0.00 
1 1 1 -10 6  24 o 167.5827 3.483874 209.2377  131.0 -26.86575      6.967748 0.97 
1 1 1 -10 6  25 o 196.6584 3.723891 263.4165  237.6 21.26448       7.447781 0.98 
1 1 1 -10 6  26 o 151.0291 4.170875 203.5387  317.2 -15.13866      8.341749 0.98 
1 1 1 -10 6  27 o 59.50541 7.959602 127.9753  166.9 39.13273       15.91920 0.91 
1 1 1 -10 6  28 o 94.21736 6.879911 108.7570  4.3   38.65314       13.75982 0.91 
1 1 1 -10 6  29 o 53.02298 9.932616 88.45872  97.5  -8.564980      19.86523 0.80 
1 1 1 -10 6  30 o 85.78734 6.913412 116.2379  165.4 10.42754       13.82682 0.93 
1 1 1 -10 6  31 o 67.36526 10.07396 55.91092  119.8 12.48787       20.14792 0.84 
1 1 1 -10 6  32 o 36.90081 11.45870 43.21860  240.5 2.590603       22.91740 0.66 
1 1 1 -10 6  33 o 38.41194 11.49343 12.99392  77.0  -4.905544      22.98686 0.27 
1 1 1 -10 6  34 o 29.10705 9.777298 17.35709  262.3 -7.391241      19.55460 0.32 
1 1 1 -10 8  1  o 272.1444 3.050359 469.8334  72.9  -6.041687      6.100718 0.95 
1 1 1 -10 8  2  o 475.5182 4.384458 483.3980  246.9 5.767548       8.768915 0.98 
1 1 1 -10 8  3  o 214.9872 3.229328 338.1278  4.8   -16.24185      6.458656 0.91 
1 1 1 -10 8  4  o 163.9835 2.376773 412.9286  213.8 0.2038422      4.753545 0.89 
1 1 1 -10 8  5  o 342.7978 3.215273 679.9838  182.2 9.817108       6.430546 0.97 
1 1 1 -10 8  6  o 513.2316 4.286400 681.5101  43.5  16.54117       8.572801 0.98 
1 1 1 -10 8  7  f 166.2847 4.386113 329.6514  105.4 ?              ?        0.00 
1 1 1 -10 8  8  o 208.6065 3.318948 319.4484  297.6 34.66672       6.637897 0.91 
1 1 1 -10 8  9  o 394.6691 4.435290 590.4893  150.2 -4.493805      8.870580 0.97 
1 1 1 -10 8  10 o 613.9235 7.084558 882.7679  162.7 ?              ?        0.99 
1 1 1 -10 8  11 o 102.1499 4.466276 253.9868  51.9  -7.067978      8.932551 0.76 
1 1 1 -10 8  12 o 172.5068 4.012500 194.3088  314.0 16.02003       8.025001 0.86 
1 1 1 -10 8  13 o 287.3036 4.615742 511.4668  11.5  -9.842743      9.231484 0.97 
1 1 1 -10 8  14 o 111.9654 2.445993 60.79991  208.6 -30.18510      4.891986 0.39 
1 1 1 -10 8  15 o 423.9831 3.911085 664.7088  259.7 -57.96652      7.822169 0.99 
1 1 1 -10 8  16 o 184.5764 2.637679 315.3004  328.1 19.81627       5.275358 0.97 
1 1 1 -10 8  17 o 255.9296 2.987715 397.5345  138.0 -32.24286      5.975431 0.98 
1 1 1 -10 8  18 o 328.8870 3.475918 469.8221  170.2 -6.314331      6.951835 0.99 
1 1 1 -10 8  19 o 181.1637 3.005320 335.6924  204.1 4.383972       6.010641 0.97 
1 1 1 -10 8  20 o 109.1269 3.728273 185.8338  302.2 38.76485       7.456546 0.94 
1 1 1 -10 8  21 o 164.7307 3.554518 228.2240  57.9  55.16788       7.109035 0.97 
1 1 1 -10 8  22 o 197.9389 3.676088 396.1032  67.0  16.03476       7.352176 0.99 
1 1 1 -10 8  23 o 119.2838 3.854713 254.2838  79.0  -18.37670      7.709427 0.97 
1 1 1 -10 8  24 o 46.40182 8.366145 50.77972  24.6  14.21796       16.73229 0.65 
1 1 1 -10 8  25 o 100.1382 5.421804 192.0746  130.4 20.76768       10.84361 0.97 
1 1 1 -10 8  26 o 88.26309 6.089347 133.3522  101.8 -9.535057      12.17869 0.93 
1 1 1 -10 8  27 f 34.31225 9.625776 45.40350  42.9  -3.017315      19.25155 0.00 
1 1 1 -10 8  28 o 46.56676 10.27081 19.00233  260.8 4.323231       20.54162 0.31 
1 1 1 -10 8  29 o 104.8041 10.18406 121.4128  104.1 ?              ?        0.96 
1 1 1 -10 8  30 o 87.83037 8.127646 149.8112  164.0 1.147270       16.25529 0.97 
1 1 1 -10 8  31 o 74.69496 9.206975 148.4603  105.3 -31.04943      18.41395 0.96 
1 1 1 -10 8  32 o 31.98604 9.912414 35.17015  100.0 -10.90176      19.82483 0.58 
1 1 1 -10 8  33 o 30.89365 9.862620 32.91582  276.1 ?              ?        0.59 
1 1 1 -10 10 1  o 192.3913 2.905321 160.9113  119.2 -2.880768      5.810643 0.86 
1 1 1 -10 10 2  o 134.6201 2.680306 287.5128  320.1 50.64057       5.360611 0.89 
1 1 1 -10 10 3  o 412.7779 4.115182 589.5848  323.9 28.25854       8.230364 0.98 
1 1 1 -10 10 4  o 375.4269 3.898072 671.4613  317.4 47.40250       7.796144 0.98 
1 1 1 -10 10 5  o 368.8148 3.465001 580.1938  325.9 22.99292       6.930002 0.98 
1 1 1 -10 10 6  f 111.7731 2.840790 129.8140  78.8  -2.251579      5.681580 0.00 
1 1 1 -10 10 7  o 193.7365 2.728659 358.6830  106.7 -13.67914      5.457318 0.96 
1 1 1 -10 10 8  o 197.4504 2.530427 405.3619  357.5 49.67133       5.060853 0.96 
1 1 1 -10 10 9  o 146.8590 4.020491 164.6982  27.3  -12.18852      8.040982 0.88 
1 1 1 -10 10 10 o 109.9627 4.655533 150.3161  160.0 6.495399       9.311066 0.85 
1 1 1 -10 10 11 o 210.2588 4.226574 385.0121  190.0 -33.55876      8.453148 0.98 
1 1 1 -10 10 12 o 157.3873 4.736805 233.4822  84.6  -33.61327      9.473610 0.96 
1 1 1 -10 10 13 o 109.1228 6.414897 307.2401  55.3  29.30252       12.82979 0.96 
1 1 1 -10 10 14 o 145.5701 5.405859 359.9132  224.1 -36.15971      10.81172 0.97 
1 1 1 -10 10 15 o 139.6529 5.331245 256.7811  185.6 13.52565       10.66249 0.96 
1 1 1 -10 10 16 o 222.5689 4.983979 318.3935  86.6  37.88103       9.967958 0.98 
1 1 1 -10 10 17 o 103.2458 8.063528 198.1947  1.1   -18.91374      16.12706 0.95 
1 1 1 -10 10 18 o 123.9741 7.155576 241.2644  224.1 -11.35288      14.31115 0.97 
1 1 1 -10 10 19 o 49.41569 15.62202 91.23396  238.4 ?              ?        0.72 
1 1 1 -10 10 20 o 87.59074 9.074887 105.1888  352.9 48.87451       18.14977 0.91 
1 1 1 -10 10 21 o 74.12432 5.696177 130.2608  55.4  3.801285       11.39235 0.93 
1 1 1 -10 10 22 o 106.4324 4.721450 146.7556  143.3 13.34359       9.442901 0.96 
1 1 1 -10 10 23 o 61.63498 8.027667 75.43671  108.0 54.19003       16.05533 0.81 
1 1 1 -10 10 24 o 143.8562 3.859650 200.3583  190.7 -29.47124      7.719300 0.97 
1 1 1 -10 10 25 o 46.43375 9.908904 54.66390  294.0 1.419209       19.81781 0.66 
1 1 1 -10 10 26 o 143.1193 4.554781 238.8464  72.1  -3.288605      9.109562 0.98 
1 1 1 -10 10 27 o 110.1492 6.159406 158.5467  98.2  21.57261       12.31881 0.98 
1 1 1 -10 10 28 o 62.54452 9.471760 98.14733  300.9 8.090775       18.94352 0.93 
1 1 1 -10 10 29 o 41.03792 10.88120 67.21493  35.7  -17.86210      21.76239 0.83 
1 1 1 -10 10 30 o 49.53536 10.52460 38.72778  26.8  4.648781       21.04919 0.76 
1 1 1 -10 10 31 o 60.76507 10.16496 90.34034  107.7 ?              ?        0.94 
1 1 1 -10 12 1  o 221.1254 3.212972 434.1579  15.6  24.49083       6.425945 0.99 
1 1 1 -10 12 2  o 165.3169 3.019238 260.0960  347.8 41.38358       6.038477 0.97 
1 1 1 -10 12 3  o 61.82363 5.389107 69.79987  357.2 8.417305       10.77821 0.61 
1 1 1 -10 12 4  o 110.6113 3.924817 186.2182  334.9 -41.98692      7.849634 0.94 
1 1 1 -10 12 5  o 153.8207 3.305735 252.1288  324.2 -34.97191      6.611470 0.96 
1 1 1 -10 12 6  o 120.4691 3.112980 249.0578  220.2 6.600342       6.225960 0.95 
1 1 1 -10 12 7  o 36.17820 7.455196 97.99049  86.8  -12.00368      14.91039 0.54 
1 1 1 -10 12 8  o 185.8136 2.745951 345.0668  195.5 1.208191       5.491902 0.98 
1 1 1 -10 12 9  o 210.9575 2.583365 436.7931  159.8 -17.22743      5.166729 0.99 
1 1 1 -10 12 10 o 109.2339 5.518936 221.1366  182.1 14.05772       11.03787 0.96 
1 1 1 -10 12 11 o 63.07669 14.16661 60.42575  295.6 ?              ?        0.66 
1 1 1 -10 12 12 o 102.2113 7.201039 164.3489  28.2  -8.164925      14.40208 0.95 
1 1 1 -10 12 13 o 115.4142 6.310760 205.8828  80.4  -6.836845      12.62152 0.96 
1 1 1 -10 12 14 o 253.3627 5.082458 420.7657  180.0 13.72519       10.16492 0.99 
1 1 1 -10 12 15 o 133.1915 6.853910 260.2720  212.5 -1.032974      13.70782 0.98 
1 1 1 -10 12 16 o 32.01540 10.50102 58.93736  141.0 12.32900       21.00204 0.56 
1 1 1 -10 12 17 o 84.18492 11.68193 128.9928  34.8  -7.973076      23.36386 0.94 
1 1 1 -10 12 18 o 100.4993 10.69535 150.5194  122.0 -22.20666      21.39070 0.95 
1 1 1 -10 12 19 o 121.8378 8.464659 260.0829  100.2 -36.54293      16.92932 0.98 
1 1 1 -10 12 20 o 52.09539 13.22449 61.60197  7.5   -11.11880      26.44898 0.68 
1 1 1 -10 12 21 o 79.53522 14.51751 124.3879  168.5 ?              ?        0.91 
1 1 1 -10 12 22 o 130.7057 9.526903 189.2698  42.6  ?              ?        0.97 
1 1 1 -10 12 23 o 221.7131 7.532189 399.0324  11.3  -43.54759      15.06438 0.99 
1 1 1 -10 12 24 o 102.7587 10.30022 143.9551  29.7  ?              ?        0.97 
1 1 1 -10 12 25 o 103.3963 12.73137 195.1346  124.0 ?              ?        0.98 
1 1 1 -10 12 26 o 135.5847 11.54570 212.2032  123.2 ?              ?        0.99 
1 1 1 -10 12 27 o 56.10823 20.68828 58.22746  158.6 ?              ?        0.76 
1 1 1 -10 12 28 o 63.18817 11.40500 118.0790  280.0 ?              ?        0.95 
1 1 1 -10 14 1  o 134.4941 3.829968 260.9806  119.9 14.27603       7.659936 0.98 
1 1 1 -10 14 2  o 196.0798 4.736303 337.1535  167.6 0.7668762      9.472606 0.99 
1 1 1 -10 14 3  o 79.88518 5.839962 175.4586  288.6 20.54499       11.67992 0.95 
1 1 1 -10 14 4  o 100.4798 4.719317 201.9843  60.0  -33.05704      9.438635 0.97 
1 1 1 -10 14 5  o 197.1239 3.350056 362.6134  114.2 3.636032       6.700112 0.99 
1 1 1 -10 14 6  o 222.1348 3.568120 376.6927  190.5 -2.783829      7.136241 0.99 
1 1 1 -10 14 7  o 164.2589 3.225440 262.6877  240.1 -3.674438      6.450881 0.99 
1 1 1 -10 14 8  o 72.29238 5.168908 141.6385  233.1 40.86118       10.33782 0.95 
1 1 1 -10 14 9  o 91.16898 5.431118 183.7916  236.3 -43.35239      10.86224 0.97 
1 1 1 -10 14 10 o 113.7749 7.651486 237.5308  217.6 -15.91151      15.30297 0.98 
1 1 1 -10 14 11 o 203.5076 5.810624 316.3385  61.3  -35.90984      11.62125 0.99 
1 1 1 -10 14 12 o 127.0231 7.651215 186.6911  69.4  10.48827       15.30243 0.97 
1 1 1 -10 14 13 o 85.38455 11.56474 193.0390  155.7 -8.297928      23.12949 0.95 
1 1 1 -10 14 14 o 45.96119 19.63807 77.36407  127.3 ?              ?        0.66 
1 1 1 -10 14 15 o 94.03686 11.24433 196.2698  174.2 14.32664       22.48866 0.96 
1 1 1 -10 14 16 o 63.12189 13.84547 124.8874  285.2 -8.992275      27.69094 0.90 
1 1 1 -10 14 17 o 163.4727 11.64358 317.3803  325.3 ?              ?        0.99 
1 1 1 -10 14 18 o 36.75099 15.43461 55.16221  325.7 ?              ?        0.62 
1 1 1 -10 14 19 o 200.0141 7.490243 365.8445  26.7  16.51199       14.98049 0.99 
1 1 1 -10 14 20 o 130.7770 12.06281 249.6063  23.9  -29.91195      24.12563 0.99 
1 1 1 -10 14 21 f 46.74389 13.96441 14.90901  41.1  18.35353       27.92881 0.00 
1 1 1 -10 14 22 o 43.40443 13.63504 33.81593  105.9 10.73225       27.27008 0.62 
1 1 1 -10 14 23 o 42.09007 13.62735 57.47086  77.1  9.376415       27.25471 0.79 
1 1 1 -10 14 24 o 50.52431 15.07098 46.16455  57.8  ?              ?        0.77 
1 1 1 -10 16 1  o 44.39908 9.948462 87.90264  7.0   -9.904793      19.89692 0.83 
1 1 1 -10 16 2  o 56.89901 9.827859 59.13194  17.9  10.63383       19.65572 0.80 
1 1 1 -10 16 3  o 94.91896 7.863275 169.6140  251.2 2.497597       15.72655 0.97 
1 1 1 -10 16 4  o 53.74595 9.985060 33.16209  280.2 2.330196       19.97012 0.60 
1 1 1 -10 16 5  o 82.26521 6.878461 150.3447  306.9 -5.304115      13.75692 0.96 
1 1 1 -10 16 6  o 106.9721 5.662624 211.1152  325.1 9.196793       11.32525 0.98 
1 1 1 -10 16 7  o 82.02870 5.830679 153.8061  7.9   19.51684       11.66136 0.96 
1 1 1 -10 16 8  o 120.1661 4.174825 216.8985  307.9 16.41474       8.349649 0.98 
1 1 1 -10 16 9  o 81.51119 6.101672 223.6661  299.9 -25.80054      12.20334 0.98 
1 1 1 -10 16 10 o 45.78339 7.901875 48.03340  23.4  -15.20817      15.80375 0.78 
1 1 1 -10 16 11 o 135.9733 9.948297 223.9136  166.2 -33.54921      19.89659 0.99 
1 1 1 -10 16 12 o 53.45703 13.92521 103.7666  130.6 -5.250565      27.85042 0.91 
1 1 1 -10 16 13 o 62.10419 15.40395 104.1529  92.4  17.93867       30.80790 0.92 
1 1 1 -10 16 14 o 38.42142 11.96048 84.91102  116.5 -3.324383      23.92096 0.87 
1 1 1 -10 16 15 o 46.34370 21.13693 72.80178  250.9 ?              ?        0.75 
1 1 1 -10 16 16 o 41.50415 13.22531 63.73431  153.6 -0.1179428     26.45062 0.81 
1 1 1 -10 16 17 o 98.27325 22.47208 180.6004  193.9 ?              ?        0.95 
1 1 1 -10 16 18 o 77.19234 14.15532 235.6145  195.3 -34.45831      28.31063 0.98 
1 1 1 -10 16 19 o 42.73586 13.55552 53.95896  237.5 ?              ?        0.80 
1 1 1 -10 18 1  o 51.52443 10.11250 142.3692  16.0  -31.80331      20.22501 0.95 
1 1 1 -10 18 2  o 41.25501 10.72663 73.23992  81.7  29.44191       21.45325 0.87 
1 1 1 -10 18 3  o 46.80856 9.045797 84.79370  104.2 -34.03795      18.09159 0.92 
1 1 1 -10 18 4  o 47.94772 10.75538 111.0150  96.0  -13.10419      21.51075 0.93 
1 1 1 -10 18 5  o 25.84334 8.765898 48.26042  75.3  8.632179       17.53180 0.71 
1 1 1 -10 18 6  o 40.82460 9.925422 55.35091  152.2 -5.309002      19.85084 0.84 
1 1 1 -10 18 7  o 73.37009 7.745266 140.4368  207.4 ?              ?        0.97 
1 1 1 -10 18 8  o 31.94302 9.742336 25.34760  181.1 ?              ?        0.55 
1 1 1 -10 18 9  o 35.97353 9.164691 92.02580  183.0 ?              ?        0.91 
1 1 1 -10 18 10 o 28.13889 10.23930 30.27807  299.8 ?              ?        0.57 
1 1 1 -9  1  1  o 460.8919 4.517989 2089.772  241.3 89.21619       9.035977 0.98 
1 1 1 -9  1  2  o 299.3177 3.557331 1563.281  154.9 -145.5281      7.114662 0.94 
1 1 1 -9  1  3  o 300.7519 3.484725 1127.250  318.4 -155.0333      6.969449 0.96 
1 1 1 -9  1  4  o 295.3506 3.341027 665.9161  176.6 -22.90680      6.682055 0.94 
1 1 1 -9  1  5  o 219.5900 2.868835 1126.665  272.1 163.1384       5.737669 0.92 
1 1 1 -9  1  6  o 76.22353 1.947067 280.9178  275.5 20.41906       3.894134 0.64 
1 1 1 -9  1  7  f 99.76385 2.046217 775.4081  265.2 -38.59971      4.092434 0.00 
1 1 1 -9  1  8  o 401.7542 4.074606 934.6280  48.1  -37.16135      8.149213 0.97 
1 1 1 -9  1  9  o 98.54464 2.073466 408.6297  338.3 -39.07201      4.146932 0.51 
1 1 1 -9  1  10 f 416.8591 4.200460 1085.088  112.0 22.97070       8.400920 0.00 
1 1 1 -9  1  11 o 126.8609 2.944691 360.2626  255.1 ?              ?        0.67 
1 1 1 -9  1  12 o 410.6480 4.179750 720.3682  193.0 21.28363       8.359501 0.97 
1 1 1 -9  1  13 o 152.6180 2.409434 27.10550  213.5 -13.92310      4.818867 0.62 
1 1 1 -9  1  14 o 338.5133 3.529071 592.8296  319.3 18.50275       7.058141 0.95 
1 1 1 -9  1  15 o 277.9379 3.096225 573.4631  347.8 34.99615       6.192449 0.94 
1 1 1 -9  1  16 o 365.9706 3.779475 411.7074  189.1 19.20389       7.558950 0.96 
1 1 1 -9  1  17 o 472.8374 4.429234 633.0831  243.3 9.102753       8.858467 0.98 
1 1 1 -9  1  18 f 957.2635 8.021187 1187.231  312.5 61.85364       16.04237 0.00 
1 1 1 -9  1  19 o 435.7209 5.299813 574.8574  142.2 74.87439       10.59963 0.97 
1 1 1 -9  1  20 o 209.7811 2.878250 422.1084  80.9  -5.678528      5.756500 0.94 
1 1 1 -9  1  21 o 319.3589 3.433381 499.9721  156.8 -28.20050      6.866763 0.98 
1 1 1 -9  1  22 o 160.3276 2.924545 180.3158  158.4 18.61803       5.849091 0.91 
1 1 1 -9  1  23 o 177.5736 4.340558 345.9268  3.1   -27.96132      8.681116 0.97 
1 1 1 -9  1  24 o 168.1177 3.160267 150.5675  252.1 8.746613       6.320534 0.94 
1 1 1 -9  1  25 f 83.67920 5.144825 90.40117  184.2 19.98290       10.28965 0.00 
1 1 1 -9  1  26 o 163.9702 3.525082 228.2587  116.6 69.72432       7.050163 0.97 
1 1 1 -9  1  27 o 114.6147 4.611831 160.8735  160.1 30.19852       9.223662 0.95 
1 1 1 -9  1  28 o 155.1277 5.587140 186.0268  102.9 -24.96965      11.17428 0.97 
1 1 1 -9  1  29 o 177.4446 4.406373 221.6055  74.5  -28.25720      8.812745 0.98 
1 1 1 -9  1  30 o 154.3660 4.704586 171.9734  32.9  -12.56142      9.409171 0.97 
1 1 1 -9  1  31 o 48.99525 12.12719 56.41707  127.6 30.53724       24.25437 0.61 
1 1 1 -9  1  32 o 95.42365 8.477771 63.84054  322.2 -47.17234      16.95554 0.88 
1 1 1 -9  1  33 o 171.0064 5.353598 169.6768  51.6  -22.90381      10.70720 0.98 
1 1 1 -9  1  34 o 45.26035 12.19784 44.07124  196.8 1.227108       24.39568 0.72 
1 1 1 -9  1  35 f 31.90540 10.46316 47.11943  113.5 8.326654       20.92632 0.00 
1 1 1 -9  1  36 o 73.65273 10.91776 69.03852  127.6 ?              ?        0.92 
1 1 1 -9  3  1  o 769.4368 5.563673 1584.854  40.7  49.85632       11.12735 1.00 
1 1 1 -9  3  2  o 766.3889 5.551385 275.8528  179.7 15.88190       11.10277 0.99 
1 1 1 -9  3  3  o 152.5765 1.708770 696.0327  210.3 66.27448       3.417539 0.79 
1 1 1 -9  3  4  o 257.8379 2.601811 509.2254  101.2 2.678894       5.203623 0.93 
1 1 1 -9  3  5  o 295.8334 3.192998 415.0232  107.4 -69.56659      6.385996 0.75 
1 1 1 -9  3  6  o 407.5930 3.910192 362.3498  331.5 21.88052       7.820385 0.97 
1 1 1 -9  3  7  o 461.8442 4.264943 522.0974  342.7 -44.40558      8.529885 0.98 
1 1 1 -9  3  8  o 340.4060 3.360141 1057.161  41.7  26.36707       6.720282 0.98 
1 1 1 -9  3  9  o 454.7843 4.212945 716.0374  246.2 44.21771       8.425889 0.98 
1 1 1 -9  3  10 o 262.8061 2.845544 581.0002  32.3  -53.04330      5.691088 0.94 
1 1 1 -9  3  11 o 64.34616 2.807550 225.9105  121.6 43.94701       5.615099 0.26 
1 1 1 -9  3  12 o 247.7170 2.614673 251.2004  305.2 15.35353       5.229345 0.90 
1 1 1 -9  3  13 o 49.17392 3.815367 292.5545  326.6 -11.93546      7.630735 0.18 
1 1 1 -9  3  14 o 518.4814 4.562787 692.5562  169.6 44.87183       9.125574 0.98 
1 1 1 -9  3  15 f 597.0309 5.299692 711.1436  358.9 -8.395264      10.59938 0.00 
1 1 1 -9  3  16 o 627.2935 5.579642 918.2264  189.0 -53.55890      11.15928 0.99 
1 1 1 -9  3  17 o 689.4652 5.924181 1171.458  91.6  -19.31268      11.84836 0.99 
1 1 1 -9  3  18 o 275.5294 3.188318 521.8576  128.6 50.44780       6.376636 0.95 
1 1 1 -9  3  19 o 534.5347 4.810761 760.3794  109.0 -33.86365      9.621523 0.99 
1 1 1 -9  3  20 o 843.5513 7.026578 1186.010  89.7  -20.23059      14.05316 1.00 
1 1 1 -9  3  21 o 214.9881 3.480405 434.4182  102.5 4.020828       6.960809 0.97 
1 1 1 -9  3  22 o 338.7391 3.508179 611.7036  203.2 -22.02332      7.016359 0.99 
1 1 1 -9  3  23 o 41.76094 8.090951 130.4686  240.5 -27.46102      16.18190 0.64 
1 1 1 -9  3  24 o 254.0104 3.870813 398.4411  326.6 2.265503       7.741626 0.98 
1 1 1 -9  3  25 o 171.5455 3.499581 238.9170  215.7 21.76328       6.999161 0.97 
1 1 1 -9  3  26 o 148.1441 4.040048 193.4219  98.2  5.007385       8.080095 0.96 
1 1 1 -9  3  27 o 112.0374 5.115321 151.7932  99.3  5.397499       10.23064 0.94 
1 1 1 -9  3  28 f 261.2738 4.583271 311.8139  232.3 -16.26624      9.166542 0.00 
1 1 1 -9  3  29 o 34.29847 9.844026 57.10117  307.1 7.606752       19.68805 0.53 
1 1 1 -9  3  30 f 129.3604 4.793603 113.5793  21.7  11.32653       9.587206 0.00 
1 1 1 -9  3  31 o 341.7721 4.591442 422.1417  246.4 9.153229       9.182884 0.99 
1 1 1 -9  3  32 o 161.6541 5.388415 209.5266  224.4 -3.054337      10.77683 0.98 
1 1 1 -9  3  33 o 49.48103 13.33106 102.6106  93.0  -39.43417      26.66212 0.89 
1 1 1 -9  3  34 f 55.38411 12.29383 102.5842  359.4 19.85156       24.58767 0.00 
1 1 1 -9  3  35 f 124.2595 7.521088 140.7803  337.6 21.78770       15.04218 0.00 
1 1 1 -9  3  36 o 58.10694 13.56623 70.60835  254.4 ?              ?        0.89 
1 1 1 -9  5  1  o 464.3523 4.460330 1095.777  16.5  31.18671       8.920660 0.98 
1 1 1 -9  5  2  o 187.0325 2.663109 406.2190  109.2 ?              ?        0.91 
1 1 1 -9  5  3  o 516.2108 4.330370 973.9450  14.6  -16.93787      8.660741 0.98 
1 1 1 -9  5  4  o 349.4001 3.228093 467.3447  78.8  -10.26917      6.456187 0.96 
1 1 1 -9  5  5  o 380.7955 3.242455 783.5735  50.6  19.34973       6.484910 0.98 
1 1 1 -9  5  6  o 151.7344 1.897504 365.6151  155.2 54.25412       3.795008 0.81 
1 1 1 -9  5  7  o 182.1037 2.004544 127.8489  166.7 -11.38783      4.009087 0.85 
1 1 1 -9  5  8  o 294.4280 2.841002 577.6627  74.8  -2.928253      5.682003 0.95 
1 1 1 -9  5  9  o 555.4449 4.686390 940.9537  301.8 32.37573       9.372780 0.98 
1 1 1 -9  5  10 o 436.5457 3.898751 681.4841  86.3  -54.41736      7.797502 0.98 
1 1 1 -9  5  11 o 502.0555 4.435845 1150.611  30.1  17.78549       8.871691 0.98 
1 1 1 -9  5  12 o 568.2413 6.051841 668.3324  45.4  80.80341       12.10368 0.98 
1 1 1 -9  5  13 o 340.8440 3.474321 583.2604  181.3 -36.37610      6.948641 0.97 
1 1 1 -9  5  14 o 575.6964 6.164809 731.0151  199.2 49.90002       12.32962 0.99 
1 1 1 -9  5  15 o 104.2174 2.746107 78.54273  174.5 -16.29560      5.492215 0.30 
1 1 1 -9  5  16 o 321.6151 4.176350 373.6375  282.2 36.63513       8.352699 0.95 
1 1 1 -9  5  17 o 572.2757 5.049183 877.4275  148.7 -21.71533      10.09837 0.99 
1 1 1 -9  5  18 o 339.6432 3.620292 637.3480  130.4 -16.66275      7.240585 0.98 
1 1 1 -9  5  19 o 126.9127 2.920667 233.0510  151.9 -11.95465      5.841334 0.89 
1 1 1 -9  5  20 o 123.2495 3.184263 240.4592  265.3 21.63595       6.368526 0.91 
1 1 1 -9  5  21 o 298.9637 3.513064 459.0670  223.7 9.992432       7.026129 0.99 
1 1 1 -9  5  22 o 212.1381 3.201313 331.4526  201.4 -8.543564      6.402626 0.98 
1 1 1 -9  5  23 o 108.3219 3.816329 153.3402  119.3 4.770363       7.632658 0.91 
1 1 1 -9  5  24 o 173.2044 4.827107 262.8346  80.9  ?              ?        0.97 
1 1 1 -9  5  25 f 120.2779 4.204859 166.4561  114.0 -11.10313      8.409718 0.00 
1 1 1 -9  5  26 o 123.6040 4.459867 163.7156  149.1 5.645882       8.919733 0.96 
1 1 1 -9  5  27 o 71.49318 8.861902 74.91172  234.0 -48.52561      17.72380 0.86 
1 1 1 -9  5  28 o 188.7697 4.722275 209.0824  324.4 23.06151       9.444551 0.98 
1 1 1 -9  5  29 o 211.3883 4.308512 288.3712  8.9   -3.011475      8.617024 0.99 
1 1 1 -9  5  30 o 46.68778 9.959350 70.41355  278.2 -20.22393      19.91870 0.71 
1 1 1 -9  5  31 f 126.8690 6.000474 171.7729  263.9 -33.07134      12.00095 0.00 
1 1 1 -9  5  32 o 147.6157 6.072058 176.7922  266.6 -13.15678      12.14412 0.98 
1 1 1 -9  5  33 o 48.14996 11.57306 72.20012  276.9 5.380947       23.14611 0.86 
1 1 1 -9  5  34 o 66.39870 12.11271 66.34231  169.4 8.932480       24.22542 0.89 
1 1 1 -9  5  35 o 78.58607 11.13261 104.8183  354.7 ?              ?        0.95 
1 1 1 -9  7  1  o 273.9429 3.019172 284.4485  43.4  67.56335       6.038345 0.92 
1 1 1 -9  7  2  o 588.8131 5.164196 806.4070  299.6 -5.636658      10.32839 0.99 
1 1 1 -9  7  3  o 122.7557 2.255119 333.9814  193.3 4.417374       4.510238 0.75 
1 1 1 -9  7  4  o 709.6057 5.500166 973.6528  53.0  -2.499573      11.00033 0.99 
1 1 1 -9  7  5  o 449.7677 4.096742 956.9912  7.3   20.91391       8.193483 0.98 
1 1 1 -9  7  6  f 129.2499 3.340143 318.4756  44.5  -15.99374      6.680285 0.00 
1 1 1 -9  7  7  o 575.0859 5.739233 868.6046  64.4  1.742554       11.47847 0.99 
1 1 1 -9  7  8  o 535.9250 5.376821 895.8130  352.7 -32.54730      10.75364 0.99 
1 1 1 -9  7  9  o 398.0601 4.371058 561.3601  35.6  -9.870453      8.742117 0.98 
1 1 1 -9  7  10 o 196.0460 3.806998 242.3303  176.8 -36.91188      7.613995 0.83 
1 1 1 -9  7  11 f 704.7391 5.760777 841.4684  220.7 4.968872       11.52155 0.00 
1 1 1 -9  7  12 o 395.3087 3.516380 680.1240  199.7 1.926361       7.032760 0.98 
1 1 1 -9  7  13 o 386.7716 3.493287 524.5633  256.3 -36.29523      6.986574 0.97 
1 1 1 -9  7  14 o 132.5290 2.575803 132.2569  355.2 3.608337       5.151607 0.64 
1 1 1 -9  7  15 o 184.3556 2.732175 134.7291  296.0 6.878113       5.464351 0.78 
1 1 1 -9  7  16 o 208.6151 2.698642 293.3425  303.1 -17.72246      5.397283 0.94 
1 1 1 -9  7  17 o 177.0800 2.734733 360.9121  279.8 -13.59506      5.469466 0.96 
1 1 1 -9  7  18 o 146.7926 2.827904 278.4225  321.2 1.696564       5.655808 0.95 
1 1 1 -9  7  19 o 221.3947 2.979453 400.9200  217.6 21.01761       5.958907 0.98 
1 1 1 -9  7  20 o 179.3353 2.931958 188.9278  75.5  -10.17499      5.863916 0.95 
1 1 1 -9  7  21 o 67.28751 5.234210 188.3725  124.6 -1.769508      10.46842 0.88 
1 1 1 -9  7  22 f 158.1120 3.408860 297.6663  265.4 11.20164       6.817720 0.00 
1 1 1 -9  7  23 o 189.4415 3.638460 365.8556  86.5  -16.86299      7.276920 0.99 
1 1 1 -9  7  24 o 118.8376 4.343866 173.5048  92.8  -5.987617      8.687733 0.96 
1 1 1 -9  7  25 o 35.13146 9.343979 32.93376  90.0  -1.216351      18.68796 0.37 
1 1 1 -9  7  26 o 46.86951 9.228831 134.2633  144.9 14.59429       18.45766 0.88 
1 1 1 -9  7  27 o 158.0808 5.513978 245.1240  149.2 ?              ?        0.98 
1 1 1 -9  7  28 f 36.37355 10.21325 42.61269  218.5 -6.038681      20.42650 0.00 
1 1 1 -9  7  29 o 30.02947 9.573593 30.39646  314.3 -15.22475      19.14719 0.32 
1 1 1 -9  7  30 o 95.74715 6.769606 126.0753  186.2 14.97457       13.53921 0.96 
1 1 1 -9  7  31 o 70.91873 10.81052 107.7718  150.9 34.52331       21.62104 0.94 
1 1 1 -9  7  32 o 109.2355 7.730505 135.4565  161.4 13.93432       15.46101 0.97 
1 1 1 -9  7  33 o 33.73151 10.85636 79.68694  127.9 3.331123       21.71272 0.83 
1 1 1 -9  7  34 x ?        ?        109.1878  98.3  ?              ?        0.00 
1 1 1 -9  9  1  o 237.0803 4.051786 374.7918  26.1  ?              ?        0.93 
1 1 1 -9  9  2  o 130.5891 2.698344 246.0958  144.7 13.26591       5.396688 0.80 
1 1 1 -9  9  3  o 240.5553 2.772082 392.5096  168.1 13.88435       5.544164 0.94 
1 1 1 -9  9  4  o 409.1274 4.785007 634.0903  292.8 80.33411       9.570013 0.98 
1 1 1 -9  9  5  o 152.1122 2.806695 298.4122  307.5 ?              ?        0.83 
1 1 1 -9  9  6  o 337.8329 3.231762 423.4485  307.3 2.003357       6.463524 0.96 
1 1 1 -9  9  7  o 361.1813 3.400656 690.6780  142.0 36.26358       6.801311 0.98 
1 1 1 -9  9  8  o 50.86456 7.553350 195.3572  227.0 -14.50714      15.10670 0.43 
1 1 1 -9  9  9  o 278.9509 6.695910 598.6133  141.3 ?              ?        0.97 
1 1 1 -9  9  10 o 240.4800 4.190350 432.2008  184.9 7.669327       8.380700 0.96 
1 1 1 -9  9  11 o 117.1659 5.323686 200.4467  278.1 31.25838       10.64737 0.83 
1 1 1 -9  9  12 o 91.99756 6.223190 117.9478  348.6 -6.998878      12.44638 0.58 
1 1 1 -9  9  13 o 280.9047 4.628829 419.6497  357.8 -9.290405      9.257657 0.98 
1 1 1 -9  9  14 o 71.96845 8.505420 44.24224  246.1 -12.85689      17.01084 0.44 
1 1 1 -9  9  15 o 76.18114 8.693582 111.5486  265.0 9.326591       17.38716 0.79 
1 1 1 -9  9  16 o 137.4325 5.469995 232.9559  0.5   24.49387       10.93999 0.95 
1 1 1 -9  9  17 o 128.7335 5.190633 202.0514  306.6 -18.08262      10.38127 0.94 
1 1 1 -9  9  18 o 143.6740 2.933825 259.7107  187.2 4.535843       5.867651 0.96 
1 1 1 -9  9  19 o 138.5394 3.400620 203.5798  101.9 -13.35963      6.801239 0.96 
1 1 1 -9  9  20 o 155.1638 3.298801 214.2965  49.0  31.56566       6.597602 0.97 
1 1 1 -9  9  21 o 98.69512 4.037685 229.6387  234.4 15.74901       8.075370 0.96 
1 1 1 -9  9  22 o 168.0631 3.090111 287.7500  220.5 6.888397       6.180221 0.99 
1 1 1 -9  9  23 o 263.5765 3.962076 432.0439  351.4 27.97382       7.924152 1.00 
1 1 1 -9  9  24 o 125.1412 4.204508 163.2381  43.7  17.49454       8.409017 0.97 
1 1 1 -9  9  25 o 101.4934 4.712025 130.8294  186.4 16.63235       9.424049 0.94 
1 1 1 -9  9  26 o 72.19294 6.784520 139.7981  111.3 -1.243515      13.56904 0.93 
1 1 1 -9  9  27 o 41.93166 9.662337 21.41474  78.1  6.430901       19.32467 0.33 
1 1 1 -9  9  28 o 28.87378 9.215888 47.44069  319.2 -8.466867      18.43178 0.56 
1 1 1 -9  9  29 o 51.69720 9.971639 65.72648  1.1   8.122143       19.94328 0.87 
1 1 1 -9  9  30 o 40.76615 10.39199 83.25739  288.1 12.58228       20.78398 0.87 
1 1 1 -9  9  31 o 38.55781 10.99275 36.44183  335.9 2.951031       21.98550 0.65 
1 1 1 -9  9  32 f 47.09854 11.92299 34.63675  46.6  ?              ?        0.00 
1 1 1 -9  11 1  o 129.1534 3.085266 198.4962  11.2  28.86661       6.170532 0.91 
1 1 1 -9  11 2  o 75.07424 4.012875 153.7195  116.7 -12.81258      8.025749 0.78 
1 1 1 -9  11 3  o 87.68063 4.995994 290.9246  145.4 -17.59825      9.991988 0.91 
1 1 1 -9  11 4  o 158.1074 2.981583 348.4521  272.3 -17.01299      5.963165 0.96 
1 1 1 -9  11 5  o 105.8025 3.625429 283.2450  342.9 4.692177       7.250859 0.94 
1 1 1 -9  11 6  o 144.6837 3.016411 248.8869  259.8 35.99107       6.032822 0.95 
1 1 1 -9  11 7  o 315.9139 3.997953 577.7108  326.1 ?              ?        0.99 
1 1 1 -9  11 8  o 212.6010 3.141308 345.3346  271.9 -39.41995      6.282615 0.98 
1 1 1 -9  11 9  o 229.8669 3.785002 541.0457  221.0 -39.49179      7.570004 0.99 
1 1 1 -9  11 10 o 67.38150 6.270373 129.1117  274.5 6.763435       12.54075 0.82 
1 1 1 -9  11 11 f 84.61316 7.066095 185.0091  354.9 -5.363304      14.13219 0.00 
1 1 1 -9  11 12 o 211.0193 4.899549 286.0269  265.0 -48.58122      9.799099 0.98 
1 1 1 -9  11 13 o 48.13092 10.43853 147.0103  116.9 -12.42227      20.87706 0.79 
1 1 1 -9  11 14 o 154.0218 6.092545 287.1703  261.0 -36.05774      12.18509 0.98 
1 1 1 -9  11 15 o 236.2653 5.241318 393.8873  185.0 -48.16096      10.48264 0.99 
1 1 1 -9  11 16 o 202.3480 5.179052 325.8904  114.1 17.00977       10.35810 0.99 
1 1 1 -9  11 17 o 175.5200 5.454081 365.9418  2.2   -7.699463      10.90816 0.99 
1 1 1 -9  11 18 o 89.76273 8.994674 157.8787  268.0 18.23431       17.98935 0.95 
1 1 1 -9  11 19 f 99.20421 8.517490 168.6006  214.6 ?              ?        0.00 
1 1 1 -9  11 20 o 54.37789 11.67619 83.45462  276.2 -24.27942      23.35239 0.83 
1 1 1 -9  11 21 o 44.96177 17.16656 99.53581  27.5  ?              ?        0.75 
1 1 1 -9  11 22 f 130.1228 9.569575 226.1802  30.8  ?              ?        0.00 
1 1 1 -9  11 23 o 70.83746 11.98710 160.3242  348.2 32.50989       23.97421 0.93 
1 1 1 -9  11 24 o 36.50417 9.070450 71.30068  239.5 -21.18748      18.14090 0.72 
1 1 1 -9  11 25 o 196.0611 3.385958 301.4103  156.1 -45.21873      6.771916 0.99 
1 1 1 -9  11 26 o 87.55027 5.862691 149.5369  172.3 -1.160400      11.72538 0.97 
1 1 1 -9  11 27 o 68.43559 8.574757 165.2249  259.9 -2.605064      17.14951 0.97 
1 1 1 -9  11 28 o 44.76032 10.39897 121.2022  258.6 -1.173443      20.79793 0.92 
1 1 1 -9  11 29 o 28.57706 9.211829 62.52927  62.1  ?              ?        0.78 
1 1 1 -9  13 1  o 90.20117 4.978403 216.9877  23.9  -32.27486      9.956805 0.95 
1 1 1 -9  13 2  o 137.6690 3.396922 265.0228  280.4 17.44823       6.793845 0.98 
1 1 1 -9  13 3  o 140.6213 3.607939 220.2876  230.5 -16.72261      7.215878 0.97 
1 1 1 -9  13 4  o 167.2422 3.332561 343.9050  233.9 13.91248       6.665123 0.99 
1 1 1 -9  13 5  o 59.58935 7.171467 80.61654  306.9 -23.80347      14.34293 0.79 
1 1 1 -9  13 6  o 71.63437 5.011403 204.8655  242.2 6.392517       10.02281 0.94 
1 1 1 -9  13 7  o 83.21211 4.246236 105.3961  192.6 20.84407       8.492472 0.90 
1 1 1 -9  13 8  o 118.7401 3.201369 209.9476  123.9 33.51705       6.402738 0.97 
1 1 1 -9  13 9  o 223.8519 2.690836 395.1697  173.0 -13.17599      5.381671 0.99 
1 1 1 -9  13 10 o 154.5457 4.519993 314.4344  234.2 7.242477       9.039987 0.98 
1 1 1 -9  13 11 o 112.1010 9.852423 166.7648  7.3   -90.48022      19.70485 0.96 
1 1 1 -9  13 12 o 68.63118 10.96418 133.1243  321.1 -9.578091      21.92837 0.92 
1 1 1 -9  13 13 o 63.62382 12.58747 123.8971  221.7 -12.72489      25.17494 0.91 
1 1 1 -9  13 14 o 176.9069 6.221593 350.1234  251.4 -17.56921      12.44319 0.99 
1 1 1 -9  13 15 o 111.0771 9.528853 227.2728  104.8 ?              ?        0.97 
1 1 1 -9  13 16 o 34.27113 10.90222 61.38065  49.0  3.018406       21.80444 0.57 
1 1 1 -9  13 17 o 95.89694 15.67473 149.2554  286.6 ?              ?        0.93 
1 1 1 -9  13 18 o 142.8942 7.325234 287.0782  138.8 5.681808       14.65047 0.98 
1 1 1 -9  13 19 o 144.7375 7.800401 231.4129  76.9  -6.970215      15.60080 0.98 
1 1 1 -9  13 20 o 141.4615 8.656069 255.0632  43.9  -10.16974      17.31214 0.98 
1 1 1 -9  13 21 o 98.84203 12.29312 205.0840  107.2 2.460907       24.58624 0.97 
1 1 1 -9  13 22 o 216.9315 8.091057 375.8448  145.4 -31.77045      16.18211 1.00 
1 1 1 -9  13 23 o 102.1788 11.94398 196.8271  158.4 35.78803       23.88795 0.98 
1 1 1 -9  13 24 o 60.61231 16.01167 35.34518  23.2  23.42352       32.02334 0.70 
1 1 1 -9  13 25 o 37.49470 12.69223 100.5583  70.7  8.169437       25.38446 0.88 
1 1 1 -9  13 26 o 59.96748 20.04998 79.26940  299.8 ?              ?        0.85 
1 1 1 -9  15 1  o 142.5476 4.786173 222.5624  310.2 13.48842       9.572347 0.98 
1 1 1 -9  15 2  o 181.0087 3.672963 241.3937  300.8 6.202271       7.345927 0.99 
1 1 1 -9  15 3  o 56.22706 9.274859 103.2754  296.0 -0.2405815     18.54972 0.88 
1 1 1 -9  15 4  o 70.55228 6.779984 162.9585  349.3 21.09826       13.55997 0.94 
1 1 1 -9  15 5  o 132.3938 4.147035 225.3497  296.7 32.45141       8.294069 0.98 
1 1 1 -9  15 6  o 65.35271 7.349446 87.36707  278.3 -6.170464      14.69889 0.87 
1 1 1 -9  15 7  o 33.08505 7.962145 86.80724  195.6 -11.27941      15.92429 0.70 
1 1 1 -9  15 8  o 70.51108 7.331653 92.96536  191.7 -42.29223      14.66331 0.89 
1 1 1 -9  15 9  o 67.41374 5.405149 96.73227  26.3  26.33955       10.81030 0.90 
1 1 1 -9  15 10 o 70.48561 4.665247 120.0130  86.6  24.83015       9.330494 0.93 
1 1 1 -9  15 11 o 124.9339 7.646182 203.2701  171.8 -41.72723      15.29236 0.98 
1 1 1 -9  15 12 o 123.6251 8.542192 212.4950  194.9 2.697433       17.08438 0.98 
1 1 1 -9  15 13 o 124.2800 8.937593 258.6726  120.0 13.87610       17.87519 0.98 
1 1 1 -9  15 14 o 56.74922 13.31885 123.1941  104.5 -13.24575      26.63770 0.91 
1 1 1 -9  15 15 o 40.01760 12.15030 27.47539  210.1 -1.641163      24.30060 0.47 
1 1 1 -9  15 16 f 37.13507 12.01639 92.43314  297.0 -6.851418      24.03278 0.00 
1 1 1 -9  15 17 o 47.62014 14.05042 101.1713  271.1 -4.545609      28.10084 0.90 
1 1 1 -9  15 18 o 61.13135 12.92964 134.6542  231.8 -20.16919      25.85927 0.95 
1 1 1 -9  15 19 o 46.20720 14.44511 77.22035  230.6 7.447723       28.89021 0.85 
1 1 1 -9  15 20 o 70.53281 15.68530 116.5028  283.8 6.752625       31.37060 0.94 
1 1 1 -9  15 21 o 56.13022 14.60008 90.34310  254.5 -8.048431      29.20016 0.90 
1 1 1 -9  15 22 o 28.49564 14.06160 63.19390  312.5 ?              ?        0.72 
1 1 1 -9  17 1  o 60.10308 9.304880 141.5758  12.0  -37.74215      18.60976 0.96 
1 1 1 -9  17 2  o 47.96336 10.59997 122.7922  7.4   -8.637253      21.19994 0.93 
1 1 1 -9  17 3  o 63.39835 9.645373 95.74487  43.5  -8.517765      19.29075 0.94 
1 1 1 -9  17 4  o 46.73001 10.98758 73.94973  213.2 19.59581       21.97515 0.88 
1 1 1 -9  17 5  o 31.85518 9.405353 64.29362  257.2 -7.683512      18.81071 0.80 
1 1 1 -9  17 6  o 79.07343 8.378323 193.1510  87.3  -21.58080      16.75665 0.98 
1 1 1 -9  17 7  o 90.04662 5.768658 161.2638  128.3 15.16251       11.53732 0.98 
1 1 1 -9  17 8  o 103.9682 5.270538 201.3874  321.1 -6.789505      10.54108 0.99 
1 1 1 -9  17 9  f 84.08061 6.427279 129.9991  321.7 -16.78481      12.85456 0.00 
1 1 1 -9  17 10 f 63.79008 7.339939 111.0837  18.8  -6.920200      14.67988 0.00 
1 1 1 -9  17 11 o 39.32463 12.70838 81.25907  14.9  19.32246       25.41675 0.85 
1 1 1 -9  17 12 o 50.17372 13.78448 121.5271  349.7 -13.65456      27.56896 0.92 
1 1 1 -9  17 13 o 65.88680 15.51701 134.7096  322.2 -20.55639      31.03402 0.94 
1 1 1 -9  17 14 o 54.71520 14.88659 111.5868  349.3 -6.077854      29.77319 0.92 
1 1 1 -9  17 15 o 36.79008 12.43080 70.83609  278.7 ?              ?        0.84 
1 1 1 -9  17 16 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -8  0  1  o 62.89003 3.127881 1480.776  180.0 -0.000000      0.000000 0.83 
1 1 1 -8  0  2  o 873.3377 11.19679 3806.792  180.0 -0.000000      0.000000 1.00 
1 1 1 -8  0  3  o 145.3487 3.676840 369.3076  0.0   -0.000000      0.000000 0.75 
1 1 1 -8  0  4  o 580.5756 7.985115 554.6384  0.0   -0.000000      0.000000 1.00 
1 1 1 -8  0  5  o 123.9427 2.873931 198.5052  0.0   -0.000000      0.000000 0.66 
1 1 1 -8  0  6  o 471.3466 6.664184 1979.219  0.0   -0.000000      0.000000 1.00 
1 1 1 -8  0  7  o 469.3556 6.749433 697.1003  180.0 -0.000000      0.000000 1.00 
1 1 1 -8  0  8  o 224.7195 4.119427 478.8109  180.0 -0.000000      0.000000 0.97 
1 1 1 -8  0  9  o 206.4153 3.794781 862.1488  180.0 -0.000000      0.000000 0.96 
1 1 1 -8  0  10 o 81.28876 2.962869 596.5341  180.0 -0.000000      0.000000 0.60 
1 1 1 -8  0  11 o 71.84727 3.232768 409.6993  180.0 -0.000000      0.000000 0.01 
1 1 1 -8  0  12 o 676.8265 8.808064 990.6849  0.0   -0.000000      0.000000 1.00 
1 1 1 -8  0  13 f 156.1083 3.307918 2.851748  180.0 -0.000000      0.000000 0.00 
1 1 1 -8  0  14 o 85.68317 3.647481 91.46563  180.0 -0.000000      0.000000 0.07 
1 1 1 -8  0  15 o 166.2781 3.909665 557.8623  0.0   -0.000000      0.000000 0.99 
1 1 1 -8  0  16 f 31.40625 10.00134 44.96653  0.0   -0.000000      0.000000 0.00 
1 1 1 -8  0  17 o 344.9861 5.262267 349.7560  0.0   -0.000000      0.000000 1.00 
1 1 1 -8  0  18 o 642.3532 8.061588 932.7615  0.0   -0.000000      0.000000 1.00 
1 1 1 -8  0  19 o 459.5609 6.253999 539.5556  180.0 -0.000000      0.000000 1.00 
1 1 1 -8  0  20 o 393.9184 5.692664 504.2760  0.0   -0.000000      0.000000 1.00 
1 1 1 -8  0  21 o 66.07597 8.864305 124.1499  0.0   -0.000000      0.000000 0.50 
1 1 1 -8  0  22 o 44.98105 10.47242 238.7455  0.0   -0.000000      0.000000 0.77 
1 1 1 -8  0  23 o 39.94720 13.66405 134.3094  0.0   -0.000000      0.000000 0.63 
1 1 1 -8  0  24 o 113.2542 4.809369 51.23686  0.0   -0.000000      0.000000 0.75 
1 1 1 -8  0  25 o 65.44895 8.519784 205.7672  0.0   -0.000000      0.000000 0.98 
1 1 1 -8  0  26 o 21.95930 13.65689 72.55668  180.0 -0.000000      0.000000 0.34 
1 1 1 -8  0  27 o 292.9138 5.439586 320.5741  180.0 -0.000000      0.000000 1.00 
1 1 1 -8  0  28 o 126.2693 6.374110 104.9463  180.0 -0.000000      0.000000 1.00 
1 1 1 -8  0  29 o 65.64577 15.28788 92.65200  0.0   -0.000000      0.000000 0.97 
1 1 1 -8  0  30 o 17.42855 12.32654 6.804537  180.0 -0.000000      0.000000 0.03 
1 1 1 -8  0  31 o 40.62402 18.50138 12.32719  180.0 -0.000000      0.000000 0.14 
1 1 1 -8  0  32 o 54.77083 20.93455 84.52289  180.0 -0.000000      0.000000 0.90 
1 1 1 -8  0  33 o 53.82000 20.80704 66.83650  0.0   -0.000000      0.000000 0.90 
1 1 1 -8  0  34 o 46.88707 22.73756 62.89595  180.0 -0.000000      0.000000 0.87 
1 1 1 -8  0  35 o 41.87133 22.25903 5.746653  180.0 -0.000000      0.000000 0.11 
1 1 1 -8  0  36 o 21.77043 15.44679 26.38511  0.0   ?              ?        0.35 
1 1 1 -8  2  1  o 310.9049 2.848325 1042.548  211.9 40.92667       5.696651 0.96 
1 1 1 -8  2  2  o 670.8979 5.041178 1616.297  126.5 -71.63959      10.08236 0.99 
1 1 1 -8  2  3  o 383.8675 3.942306 1522.466  345.6 -44.03973      7.884611 0.98 
1 1 1 -8  2  4  o 77.86965 2.934125 383.7082  199.9 12.10753       5.868250 0.27 
1 1 1 -8  2  5  o 161.2905 2.310366 129.7491  80.5  36.66498       4.620731 0.90 
1 1 1 -8  2  6  o 286.5020 3.006890 805.8332  350.2 79.38492       6.013781 0.95 
1 1 1 -8  2  7  o 725.6768 8.898391 1493.725  314.6 ?              ?        0.99 
1 1 1 -8  2  8  o 285.7378 3.070215 585.9125  91.6  -11.10632      6.140430 0.96 
1 1 1 -8  2  9  o 690.5405 6.082448 1280.344  222.4 33.06451       12.16490 0.99 
1 1 1 -8  2  10 o 147.1044 2.146287 70.10591  309.3 38.25309       4.292574 0.38 
1 1 1 -8  2  11 o 319.5645 3.431059 362.1592  19.6  122.3261       6.862118 0.94 
1 1 1 -8  2  12 o 444.8030 4.340174 612.7512  222.0 19.11795       8.680348 0.97 
1 1 1 -8  2  13 o 884.9485 7.579536 1412.743  274.0 -7.275024      15.15907 0.99 
1 1 1 -8  2  14 o 287.9591 3.052633 427.0444  165.8 -38.90201      6.105267 0.91 
1 1 1 -8  2  15 o 1021.624 10.43490 1670.782  347.5 -30.97906      20.86981 1.00 
1 1 1 -8  2  16 o 487.7095 4.485386 600.6287  3.8   -82.49698      8.970773 0.98 
1 1 1 -8  2  17 o 743.1176 6.460767 850.3626  320.5 28.20642       12.92153 0.99 
1 1 1 -8  2  18 o 230.2443 3.426303 170.6673  295.3 28.06224       6.852607 0.84 
1 1 1 -8  2  19 o 307.0364 4.490141 414.6307  44.0  ?              ?        0.95 
1 1 1 -8  2  20 o 644.9033 7.056520 975.7292  52.1  22.09723       14.11304 0.99 
1 1 1 -8  2  21 o 94.67606 4.485106 163.4140  194.1 -70.60371      8.970212 0.75 
1 1 1 -8  2  22 o 185.1408 3.227144 161.5509  167.0 -3.211746      6.454288 0.92 
1 1 1 -8  2  23 o 38.45501 8.740964 214.2919  119.0 -8.627411      17.48193 0.73 
1 1 1 -8  2  24 o 219.6130 3.376749 314.1973  297.0 -4.496704      6.753497 0.98 
1 1 1 -8  2  25 o 157.9145 3.623017 130.1043  233.4 8.384705       7.246035 0.93 
1 1 1 -8  2  26 f 142.5627 4.124846 162.2897  74.1  1.363968       8.249692 0.00 
1 1 1 -8  2  27 o 221.6534 3.752745 313.1895  44.7  33.43263       7.505491 0.99 
1 1 1 -8  2  28 o 141.9158 4.549201 222.7558  339.5 22.70052       9.098401 0.98 
1 1 1 -8  2  29 o 43.92175 10.84066 19.71990  244.6 -18.38477      21.68131 0.27 
1 1 1 -8  2  30 o 65.00769 10.35511 57.01446  92.2  12.44537       20.71022 0.69 
1 1 1 -8  2  31 o 150.3158 6.273677 160.7673  298.8 -41.52798      12.54735 0.97 
1 1 1 -8  2  32 o 68.50427 10.38348 90.21130  7.4   -29.76369      20.76695 0.89 
1 1 1 -8  2  33 o 97.28114 7.978999 73.29370  214.9 -17.26786      15.95800 0.93 
1 1 1 -8  2  34 o 85.17053 9.920984 77.84292  268.4 -32.31059      19.84197 0.93 
1 1 1 -8  2  35 o 64.15601 13.07875 33.45726  305.9 17.12732       26.15750 0.74 
1 1 1 -8  2  36 o 51.97508 13.04694 80.96076  164.2 ?              ?        0.89 
1 1 1 -8  4  1  o 796.6590 6.980985 1398.231  11.9  64.65955       13.96197 0.99 
1 1 1 -8  4  2  o 292.9163 2.837651 829.3048  257.3 -23.87262      5.675302 0.97 
1 1 1 -8  4  3  o 461.4620 4.008007 801.1295  61.9  16.94357       8.016014 0.98 
1 1 1 -8  4  4  o 344.7165 2.732982 227.0893  96.5  37.79797       5.465964 0.96 
1 1 1 -8  4  5  o 93.65427 1.781088 291.4825  312.7 47.94611       3.562175 0.60 
1 1 1 -8  4  6  o 139.2816 2.015299 299.6163  41.7  2.942444       4.030598 0.73 
1 1 1 -8  4  7  o 153.7353 1.960305 230.8174  195.1 23.82677       3.920610 0.40 
1 1 1 -8  4  8  o 438.1888 3.950368 598.7923  104.7 39.70410       7.900735 0.98 
1 1 1 -8  4  9  f 212.7438 2.329232 137.3629  215.3 31.24785       4.658464 0.00 
1 1 1 -8  4  10 o 75.48208 2.455706 129.2141  231.7 66.20979       4.911413 0.36 
1 1 1 -8  4  11 o 49.16977 3.472460 121.8203  341.3 -36.34863      6.944919 0.28 
1 1 1 -8  4  12 o 397.5048 3.684514 1029.624  224.7 -26.66833      7.369028 0.98 
1 1 1 -8  4  13 f 527.3601 4.762642 1120.714  155.0 -61.40182      9.525285 0.00 
1 1 1 -8  4  14 o 389.5136 3.740943 450.0334  26.4  -66.81778      7.481886 0.96 
1 1 1 -8  4  15 o 1357.500 15.40357 1809.102  18.5  -34.62061      30.80715 1.00 
1 1 1 -8  4  16 o 137.5514 2.627519 108.9826  104.8 12.15161       5.255038 0.44 
1 1 1 -8  4  17 o 471.9927 4.330464 729.3987  138.0 -10.38696      8.660929 0.98 
1 1 1 -8  4  18 o 134.3775 3.008911 36.05504  312.5 49.03114       6.017822 0.30 
1 1 1 -8  4  19 o 485.3024 4.535576 603.6837  13.5  -22.21927      9.071152 0.99 
1 1 1 -8  4  20 o 256.9562 2.990371 428.3082  87.3  -38.12479      5.980743 0.97 
1 1 1 -8  4  21 o 199.0642 3.042169 209.2146  160.1 36.07133       6.084338 0.95 
1 1 1 -8  4  22 o 130.1542 3.364943 121.8378  242.5 10.65651       6.729885 0.89 
1 1 1 -8  4  23 o 169.0665 3.737860 128.6141  223.0 -11.71733      7.475721 0.93 
1 1 1 -8  4  24 o 200.7766 3.148749 270.0407  261.2 -2.840744      6.297498 0.98 
1 1 1 -8  4  25 o 226.0074 3.546877 310.3400  216.3 11.66966       7.093754 0.99 
1 1 1 -8  4  26 o 171.5106 4.390031 231.7267  139.5 7.030792       8.780063 0.98 
1 1 1 -8  4  27 o 111.3598 4.923634 163.6859  141.7 22.09200       9.847268 0.96 
1 1 1 -8  4  28 o 71.73134 8.901079 59.97221  182.2 20.81139       17.80216 0.82 
1 1 1 -8  4  29 o 142.6201 4.815772 185.1040  42.1  21.59940       9.631544 0.97 
1 1 1 -8  4  30 o 60.23604 10.74962 72.62055  50.0  -9.062298      21.49925 0.77 
1 1 1 -8  4  31 o 164.8570 4.898975 151.7975  275.0 12.34183       9.797951 0.97 
1 1 1 -8  4  32 o 84.97982 10.68579 98.35485  147.8 40.95555       21.37159 0.93 
1 1 1 -8  4  33 o 30.95214 10.25931 10.95323  226.0 10.57075       20.51862 0.19 
1 1 1 -8  4  34 o 34.47302 11.05900 40.22263  47.6  7.853516       22.11801 0.60 
1 1 1 -8  4  35 o 48.78104 14.09660 59.83956  300.5 ?              ?        0.82 
1 1 1 -8  6  1  o 468.7576 4.413084 864.3839  120.3 28.70990       8.826167 0.98 
1 1 1 -8  6  2  o 360.8433 3.499180 840.1658  141.0 37.91571       6.998361 0.97 
1 1 1 -8  6  3  o 394.1302 3.744003 722.4960  21.4  -7.479675      7.488006 0.97 
1 1 1 -8  6  4  o 597.0281 4.716555 1031.596  358.2 -41.09845      9.433109 0.99 
1 1 1 -8  6  5  f 151.8619 2.017486 422.0016  263.7 -7.563049      4.034971 0.00 
1 1 1 -8  6  6  o 158.7351 3.697372 175.6047  127.5 67.68420       7.394745 0.85 
1 1 1 -8  6  7  o 263.0781 3.427944 585.1791  276.8 -8.937805      6.855888 0.95 
1 1 1 -8  6  8  o 643.1887 6.706442 1048.836  61.1  40.15717       13.41288 0.99 
1 1 1 -8  6  9  o 304.3364 3.607929 301.2730  354.6 37.98120       7.215858 0.94 
1 1 1 -8  6  10 o 251.5011 2.882811 525.8405  220.1 -13.95097      5.765622 0.95 
1 1 1 -8  6  11 o 438.4754 3.821994 699.3272  311.3 -26.47409      7.643988 0.98 
1 1 1 -8  6  12 o 216.1445 2.606256 474.9931  144.8 62.80376       5.212513 0.94 
1 1 1 -8  6  13 o 229.5571 3.989621 395.1755  280.9 -33.80986      7.979243 0.93 
1 1 1 -8  6  14 o 421.8905 3.921220 600.8319  221.0 3.841248       7.842440 0.97 
1 1 1 -8  6  15 o 389.9618 3.765146 645.5627  133.7 15.55045       7.530293 0.98 
1 1 1 -8  6  16 o 298.2129 3.162275 459.3882  48.3  25.92453       6.324549 0.96 
1 1 1 -8  6  17 o 307.6979 3.228245 492.1714  306.1 17.19196       6.456491 0.97 
1 1 1 -8  6  18 o 305.8890 3.249116 400.6768  344.8 -1.640137      6.498233 0.97 
1 1 1 -8  6  19 o 237.5773 3.074188 266.2993  172.8 5.000580       6.148377 0.97 
1 1 1 -8  6  20 o 303.0632 3.436682 458.2393  124.6 -8.845795      6.873363 0.99 
1 1 1 -8  6  21 o 201.1950 3.061056 318.7417  125.6 -42.06502      6.122112 0.98 
1 1 1 -8  6  22 o 127.6657 3.756896 126.3096  188.1 17.57578       7.513793 0.91 
1 1 1 -8  6  23 o 138.2544 3.782793 157.6812  14.0  5.564056       7.565587 0.95 
1 1 1 -8  6  24 o 163.5117 3.852578 243.6482  143.6 -12.92960      7.705155 0.98 
1 1 1 -8  6  25 o 156.5001 3.742857 317.3553  209.3 -27.96461      7.485715 0.98 
1 1 1 -8  6  26 o 188.5557 3.652970 301.7016  168.1 -12.66780      7.305939 0.99 
1 1 1 -8  6  27 o 41.32029 10.03045 96.19464  17.4  6.692612       20.06090 0.78 
1 1 1 -8  6  28 o 145.7540 5.323776 186.2263  4.8   15.38043       10.64755 0.97 
1 1 1 -8  6  29 o 143.9951 5.542844 163.2842  347.0 51.43490       11.08569 0.97 
1 1 1 -8  6  30 o 108.7104 6.078194 148.7089  263.9 12.30322       12.15639 0.96 
1 1 1 -8  6  31 o 172.2363 5.427821 201.8075  212.4 -6.511475      10.85564 0.99 
1 1 1 -8  6  32 o 72.39935 10.64920 102.8711  141.8 -25.08777      21.29840 0.94 
1 1 1 -8  6  33 o 50.31481 11.63225 80.09844  163.0 35.11962       23.26451 0.88 
1 1 1 -8  6  34 o 35.23279 10.80959 47.93072  88.0  ?              ?        0.73 
1 1 1 -8  8  1  o 654.0110 5.779402 995.8958  108.0 10.88306       11.55880 0.99 
1 1 1 -8  8  2  o 219.8542 2.684158 307.8616  16.9  26.68483       5.368315 0.92 
1 1 1 -8  8  3  o 493.3548 5.991028 881.0809  221.7 17.67065       11.98206 0.98 
1 1 1 -8  8  4  o 84.22295 3.545052 135.6974  291.3 -34.31494      7.090104 0.24 
1 1 1 -8  8  5  o 596.0779 4.822546 1008.399  323.2 80.73700       9.645091 0.99 
1 1 1 -8  8  6  o 913.3075 6.825366 1506.940  268.5 -11.45746      13.65073 1.00 
1 1 1 -8  8  7  o 549.0089 5.910831 739.3379  181.6 15.69836       11.82166 0.99 
1 1 1 -8  8  8  o 407.3685 4.791976 628.3896  6.2   -35.54242      9.583953 0.97 
1 1 1 -8  8  9  o 231.8301 3.360710 336.8943  250.8 12.05853       6.721420 0.92 
1 1 1 -8  8  10 o 172.9200 4.835046 380.3071  337.0 ?              ?        0.90 
1 1 1 -8  8  11 f 90.71056 5.508795 265.9768  203.6 15.85121       11.01759 0.00 
1 1 1 -8  8  12 o 313.8439 4.735439 649.5885  119.3 11.07382       9.470879 0.98 
1 1 1 -8  8  13 o 223.5047 4.350638 296.8532  339.3 -20.80013      8.701276 0.94 
1 1 1 -8  8  14 f 239.0430 4.465121 470.0278  257.5 -27.15565      8.930242 0.00 
1 1 1 -8  8  15 o 38.80976 5.523574 86.94775  347.3 33.13198       11.04715 0.26 
1 1 1 -8  8  16 f 64.12508 4.345289 184.3837  267.9 -10.67088      8.690578 0.00 
1 1 1 -8  8  17 o 207.4830 2.817745 382.1647  21.6  13.41618       5.635489 0.98 
1 1 1 -8  8  18 o 115.7713 2.906762 275.3742  85.9  -0.7727127     5.813525 0.95 
1 1 1 -8  8  19 o 237.5648 3.564880 383.9257  197.7 16.61169       7.129760 0.98 
1 1 1 -8  8  20 o 266.7455 3.382927 401.5636  158.3 9.403992       6.765853 0.99 
1 1 1 -8  8  21 o 191.2417 3.382897 258.3006  215.9 19.71494       6.765795 0.98 
1 1 1 -8  8  22 o 77.67317 5.532555 60.48570  4.7   -12.50809      11.06511 0.77 
1 1 1 -8  8  23 o 109.9042 4.491518 170.3496  86.4  -0.3644562     8.983036 0.96 
1 1 1 -8  8  24 o 65.73415 7.469110 65.08933  82.6  20.86233       14.93822 0.83 
1 1 1 -8  8  25 o 160.0514 4.285452 248.5535  304.9 21.68927       8.570905 0.98 
1 1 1 -8  8  26 o 109.9690 5.225181 209.0153  28.0  9.744308       10.45036 0.96 
1 1 1 -8  8  27 o 69.76353 8.624729 85.13204  103.7 9.575439       17.24946 0.86 
1 1 1 -8  8  28 o 29.76993 9.282837 76.63358  19.4  -1.502825      18.56567 0.65 
1 1 1 -8  8  29 o 45.18709 10.55007 69.98508  285.2 19.25953       21.10014 0.81 
1 1 1 -8  8  30 o 101.7455 6.890031 133.0619  235.0 -5.207428      13.78006 0.97 
1 1 1 -8  8  31 o 33.06468 10.11575 65.14317  153.2 0.3856926      20.23149 0.77 
1 1 1 -8  8  32 o 132.9191 6.007246 194.1500  108.1 25.58585       12.01449 0.99 
1 1 1 -8  8  33 o 37.13049 11.29504 58.58124  62.2  ?              ?        0.81 
1 1 1 -8  10 1  o 251.0775 3.478246 448.0717  113.2 2.566696       6.956491 0.96 
1 1 1 -8  10 2  o 407.4254 4.055125 704.2570  207.8 46.53534       8.110250 0.99 
1 1 1 -8  10 3  o 339.0940 3.607584 549.1804  174.9 56.40488       7.215169 0.98 
1 1 1 -8  10 4  o 493.1245 4.676048 869.2438  132.5 -14.99603      9.352097 0.99 
1 1 1 -8  10 5  f 88.78145 3.205376 72.90210  281.5 -5.818283      6.410752 0.00 
1 1 1 -8  10 6  o 427.5595 3.834679 702.4004  219.1 7.467010       7.669358 0.99 
1 1 1 -8  10 7  o 305.0723 3.673549 474.5564  170.1 ?              ?        0.98 
1 1 1 -8  10 8  o 97.18815 2.680736 80.96720  21.1  -0.4955750     5.361473 0.50 
1 1 1 -8  10 9  f 219.6480 3.761872 427.5444  83.9  -30.11536      7.523744 0.00 
1 1 1 -8  10 10 o 68.93944 8.489831 138.1994  290.0 -22.68609      16.97966 0.72 
1 1 1 -8  10 11 o 317.1586 4.876301 564.1876  264.1 19.78653       9.752602 0.99 
1 1 1 -8  10 12 o 308.5672 4.667690 497.6633  220.2 -11.17438      9.335380 0.99 
1 1 1 -8  10 13 o 131.3476 5.576938 136.4216  80.0  -31.77047      11.15388 0.91 
1 1 1 -8  10 14 o 298.3824 5.091924 496.1842  288.1 7.518524       10.18385 0.99 
1 1 1 -8  10 15 o 167.7346 4.886020 230.1784  249.5 15.75966       9.772040 0.96 
1 1 1 -8  10 16 o 33.25277 10.25489 84.49734  275.6 4.588820       20.50978 0.46 
1 1 1 -8  10 17 o 95.23885 10.83333 170.9500  248.0 ?              ?        0.93 
1 1 1 -8  10 18 o 184.6669 5.009266 351.2750  210.3 7.128387       10.01853 0.99 
1 1 1 -8  10 19 o 137.4572 7.053051 180.1536  245.8 ?              ?        0.96 
1 1 1 -8  10 20 o 54.30190 14.70690 178.5353  300.3 ?              ?        0.90 
1 1 1 -8  10 21 o 33.80951 8.041819 50.68955  161.2 2.509945       16.08364 0.57 
1 1 1 -8  10 22 o 53.07784 7.479958 111.7679  67.7  -5.059101      14.95992 0.88 
1 1 1 -8  10 23 o 164.0329 3.722609 232.4399  15.1  -4.427429      7.445219 0.98 
1 1 1 -8  10 24 o 60.85923 7.565804 133.5494  233.9 -4.651661      15.13161 0.90 
1 1 1 -8  10 25 o 99.50136 5.686423 138.0131  222.5 11.40639       11.37285 0.95 
1 1 1 -8  10 26 o 95.99980 5.856939 151.6640  276.4 -5.510147      11.71388 0.96 
1 1 1 -8  10 27 o 72.79709 9.172967 110.5178  294.9 30.35394       18.34593 0.94 
1 1 1 -8  10 28 o 38.45335 10.72507 11.62920  141.3 -21.44244      21.45013 0.26 
1 1 1 -8  10 29 o 48.99290 10.47826 90.86834  330.2 17.31146       20.95651 0.90 
1 1 1 -8  10 30 o 53.88596 9.689526 60.81168  294.2 17.15200       19.37905 0.88 
1 1 1 -8  10 31 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -8  12 1  o 107.4505 3.786924 172.3457  118.9 2.321625       7.573849 0.92 
1 1 1 -8  12 2  o 140.7283 4.547604 263.2272  210.2 5.496155       9.095208 0.96 
1 1 1 -8  12 3  o 174.3369 2.919046 278.6912  146.0 -24.06529      5.838092 0.97 
1 1 1 -8  12 4  o 64.42006 5.351930 145.9130  93.0  27.36419       10.70386 0.83 
1 1 1 -8  12 5  o 107.2805 3.865750 150.2400  261.4 -0.1772003     7.731500 0.91 
1 1 1 -8  12 6  o 175.7466 3.153023 290.8572  298.3 21.97459       6.306047 0.97 
1 1 1 -8  12 7  o 150.7581 2.936933 228.3785  323.9 -1.069061      5.873866 0.96 
1 1 1 -8  12 8  f 194.4576 2.689103 368.6692  301.3 -43.30992      5.378205 0.00 
1 1 1 -8  12 9  o 144.8497 2.479778 201.4139  296.2 0.6973267E-01  4.959556 0.96 
1 1 1 -8  12 10 o 44.45514 10.07644 120.0503  321.5 19.05871       20.15287 0.75 
1 1 1 -8  12 11 o 35.16353 14.51706 77.55912  130.5 ?              ?        0.53 
1 1 1 -8  12 12 o 150.2782 5.670695 334.5366  281.3 -54.32410      11.34139 0.98 
1 1 1 -8  12 13 o 99.50554 7.743387 139.7063  118.1 -7.432579      15.48677 0.94 
1 1 1 -8  12 14 o 160.2942 6.349916 293.4213  296.4 -20.59850      12.69983 0.98 
1 1 1 -8  12 15 o 56.73284 12.86394 136.7678  56.8  19.05812       25.72788 0.88 
1 1 1 -8  12 16 o 68.43858 13.17771 90.83365  286.4 -5.539322      26.35542 0.87 
1 1 1 -8  12 17 o 208.8039 5.482559 387.4734  304.4 -23.86646      10.96512 0.99 
1 1 1 -8  12 18 o 135.7896 7.384246 226.7216  322.2 -7.742889      14.76849 0.98 
1 1 1 -8  12 19 o 123.4652 8.314810 214.6523  217.3 1.747467       16.62962 0.97 
1 1 1 -8  12 20 o 195.7946 6.749497 308.7899  243.4 -32.40274      13.49899 0.99 
1 1 1 -8  12 21 o 133.5979 10.51903 234.0760  220.1 ?              ?        0.98 
1 1 1 -8  12 22 o 175.2664 6.292761 307.5437  159.8 ?              ?        0.99 
1 1 1 -8  12 23 o 109.4370 9.184008 161.2708  164.0 ?              ?        0.97 
1 1 1 -8  12 24 o 180.8687 8.458301 236.4506  284.2 ?              ?        0.99 
1 1 1 -8  12 25 o 91.97385 12.47460 194.6821  255.4 -55.44426      24.94920 0.98 
1 1 1 -8  12 26 f 59.96344 19.47427 85.30391  282.1 ?              ?        0.00 
1 1 1 -8  12 27 f 45.26208 16.98848 103.9310  33.0  ?              ?        0.00 
1 1 1 -8  12 28 o 43.17730 12.50648 104.2019  61.8  ?              ?        0.91 
1 1 1 -8  14 1  o 29.92519 8.673707 67.64167  315.5 6.501320       17.34741 0.57 
1 1 1 -8  14 2  o 146.9880 3.902475 248.7346  256.9 -25.10635      7.804950 0.98 
1 1 1 -8  14 3  o 138.0555 3.899383 270.2477  227.4 -33.36879      7.798767 0.98 
1 1 1 -8  14 4  o 80.66326 5.748816 172.1839  28.7  29.86241       11.49763 0.95 
1 1 1 -8  14 5  o 246.2034 3.461101 360.0665  18.5  6.184830       6.922203 0.99 
1 1 1 -8  14 6  o 131.3502 3.748809 234.4920  6.4   19.48103       7.497617 0.98 
1 1 1 -8  14 7  o 85.72420 4.951149 73.71033  258.8 1.292915       9.902297 0.91 
1 1 1 -8  14 8  o 177.7470 3.024244 325.3498  52.6  -25.30051      6.048488 0.99 
1 1 1 -8  14 9  o 130.5305 3.119861 239.0072  20.8  18.88160       6.239722 0.99 
1 1 1 -8  14 10 o 85.60829 9.823849 156.2159  275.2 -2.905174      19.64770 0.96 
1 1 1 -8  14 11 o 66.30963 12.55260 108.6009  319.1 -17.89192      25.10520 0.90 
1 1 1 -8  14 12 o 59.11670 13.40372 51.51079  328.0 29.22555       26.80744 0.69 
1 1 1 -8  14 13 o 80.86432 11.73369 107.0076  92.2  16.18218       23.46738 0.90 
1 1 1 -8  14 14 o 92.87651 19.83149 167.9677  174.3 ?              ?        0.93 
1 1 1 -8  14 15 o 75.56155 11.92239 96.58447  157.3 -17.33634      23.84477 0.89 
1 1 1 -8  14 16 o 98.37718 12.53164 171.6587  351.6 -8.047836      25.06328 0.96 
1 1 1 -8  14 17 o 54.73672 12.11553 139.0018  159.4 -37.58679      24.23106 0.92 
1 1 1 -8  14 18 o 109.3637 9.840798 211.5286  172.0 ?              ?        0.98 
1 1 1 -8  14 19 o 39.99451 12.52468 49.57407  189.9 -13.13707      25.04936 0.70 
1 1 1 -8  14 20 o 48.54106 14.36262 34.49810  283.7 2.098099       28.72525 0.65 
1 1 1 -8  14 21 o 49.59367 14.24169 127.5025  273.5 9.103432       28.48339 0.92 
1 1 1 -8  14 22 o 85.01208 14.01132 108.1770  227.0 13.68355       28.02265 0.95 
1 1 1 -8  14 23 o 64.17286 14.94091 120.2798  83.3  -25.27452      29.88183 0.94 
1 1 1 -8  14 24 o 45.38705 13.45670 75.40482  72.0  ?              ?        0.87 
1 1 1 -8  16 1  o 142.2491 4.505187 239.1861  87.9  -27.50711      9.010373 0.98 
1 1 1 -8  16 2  o 64.33990 9.013391 121.2223  131.9 -35.23403      18.02678 0.92 
1 1 1 -8  16 3  o 43.53426 9.883105 17.21241  243.1 -14.72723      19.76621 0.30 
1 1 1 -8  16 4  o 62.89047 8.910394 136.2894  357.3 5.544949       17.82079 0.93 
1 1 1 -8  16 5  o 69.20607 7.796450 72.28308  165.5 6.597923       15.59290 0.88 
1 1 1 -8  16 6  o 97.74294 5.376096 190.5566  119.7 20.36970       10.75219 0.97 
1 1 1 -8  16 7  o 135.3853 4.342988 287.5966  132.9 -5.562271      8.685975 0.99 
1 1 1 -8  16 8  o 29.88867 8.802855 118.9514  113.2 15.08895       17.60571 0.85 
1 1 1 -8  16 9  o 82.10112 5.581673 139.0495  70.9  -16.56857      11.16335 0.96 
1 1 1 -8  16 10 o 132.1334 3.342693 200.1951  104.4 5.761124       6.685386 0.99 
1 1 1 -8  16 11 o 39.10835 11.53939 34.00612  8.3   -12.88913      23.07878 0.58 
1 1 1 -8  16 12 f 72.84697 14.12154 184.1626  319.4 11.18764       28.24307 0.00 
1 1 1 -8  16 13 o 61.63207 14.85581 87.35107  338.6 5.798149       29.71162 0.90 
1 1 1 -8  16 14 o 41.09357 12.83038 87.52319  340.4 26.03947       25.66076 0.87 
1 1 1 -8  16 15 o 76.78768 14.11924 122.3079  140.3 -22.30852      28.23847 0.95 
1 1 1 -8  16 16 o 52.93675 15.13558 88.92702  349.1 4.073872       30.27116 0.89 
1 1 1 -8  16 17 o 122.8180 13.61101 222.7948  25.9  -23.69309      27.22202 0.98 
1 1 1 -8  16 18 o 50.47060 13.07286 21.90448  353.2 ?              ?        0.56 
1 1 1 -8  16 19 o 39.57420 13.18563 24.76753  237.2 ?              ?        0.53 
1 1 1 -8  18 1  o 38.47059 10.54461 36.17264  101.5 -2.240570      21.08922 0.69 
1 1 1 -8  18 2  o 39.19124 11.16816 55.23575  262.6 20.38047       22.33633 0.81 
1 1 1 -8  18 3  o 30.40683 10.42163 103.5951  289.8 11.19817       20.84327 0.88 
1 1 1 -8  18 4  f 130.4128 5.835657 217.3590  307.3 -19.46059      11.67131 0.00 
1 1 1 -8  18 5  o 48.28854 11.85306 100.7011  344.8 0.5194359      23.70612 0.92 
1 1 1 -8  18 6  o 34.35812 10.12454 116.6834  12.4  -0.5886307     20.24907 0.91 
1 1 1 -8  18 7  o 43.68594 9.709457 70.70519  5.7   28.24013       19.41891 0.89 
1 1 1 -8  18 8  o 24.68583 8.128622 36.70207  3.1   ?              ?        0.63 
1 1 1 -8  18 9  o 40.06559 7.995950 87.63398  18.5  ?              ?        0.92 
1 1 1 -8  18 10 o 47.29494 10.40734 114.8756  77.2  ?              ?        0.94 
1 1 1 -7  1  1  o 451.6494 4.281281 2619.877  58.3  32.49927       8.562561 0.99 
1 1 1 -7  1  2  o 137.8946 2.204348 558.3401  279.1 33.66402       4.408697 0.83 
1 1 1 -7  1  3  o 325.7172 3.675116 1641.783  265.2 -28.40848      7.350232 0.96 
1 1 1 -7  1  4  o 388.1818 4.106991 1851.501  243.3 -21.48227      8.213982 0.95 
1 1 1 -7  1  5  o 521.8688 5.092505 1389.444  332.2 -2.156311      10.18501 0.99 
1 1 1 -7  1  6  o 843.5455 7.549859 917.1740  4.8   70.79498       15.09972 0.99 
1 1 1 -7  1  7  o 545.6096 5.231451 680.4457  206.4 34.21576       10.46290 0.99 
1 1 1 -7  1  8  f 263.5104 3.088615 571.8944  11.1  23.71858       6.177231 0.00 
1 1 1 -7  1  9  o 528.8820 5.124572 399.2773  10.5  18.30072       10.24914 0.98 
1 1 1 -7  1  10 o 107.1624 2.223925 199.1072  271.0 55.41624       4.447849 0.52 
1 1 1 -7  1  11 o 261.4438 3.101159 687.4516  44.4  75.94949       6.202317 0.95 
1 1 1 -7  1  12 o 321.1630 4.818833 746.6713  279.3 ?              ?        0.96 
1 1 1 -7  1  13 o 692.6462 6.305374 1116.187  279.9 -21.83496      12.61075 0.99 
1 1 1 -7  1  14 o 778.6387 6.827403 1234.434  82.0  -38.07159      13.65481 0.99 
1 1 1 -7  1  15 o 539.2488 5.049877 1004.611  344.5 10.72278       10.09975 0.98 
1 1 1 -7  1  16 o 548.9609 5.071247 880.5968  19.4  -48.43207      10.14249 0.99 
1 1 1 -7  1  17 o 350.7400 3.574471 467.4923  55.0  29.65955       7.148942 0.96 
1 1 1 -7  1  18 o 411.9220 4.068676 587.7177  51.0  -18.03357      8.137352 0.97 
1 1 1 -7  1  19 o 309.3328 4.008459 328.4374  9.8   -27.46088      8.016918 0.94 
1 1 1 -7  1  20 o 644.2936 5.656775 813.1099  18.0  5.536560       11.31355 0.99 
1 1 1 -7  1  21 o 79.82533 4.202277 96.81034  193.3 -10.36240      8.404554 0.50 
1 1 1 -7  1  22 f 199.8765 2.967402 301.9506  12.7  29.43483       5.934805 0.00 
1 1 1 -7  1  23 o 166.6997 3.145152 197.0326  195.6 -20.69484      6.290303 0.95 
1 1 1 -7  1  24 o 110.4067 4.124812 209.1813  143.9 -32.52668      8.249623 0.93 
1 1 1 -7  1  25 o 138.8750 3.862457 195.5349  229.6 -22.92184      7.724913 0.95 
1 1 1 -7  1  26 o 205.1425 4.312470 235.8874  208.8 -0.6632996     8.624940 0.98 
1 1 1 -7  1  27 o 218.1688 3.597847 215.9830  248.2 -40.88164      7.195694 0.98 
1 1 1 -7  1  28 o 73.01528 10.94792 119.9526  302.8 12.18408       21.89584 0.90 
1 1 1 -7  1  29 o 113.9458 4.893604 132.4411  205.3 -1.065125      9.787209 0.95 
1 1 1 -7  1  30 o 254.3653 4.231979 353.6324  204.3 -23.48233      8.463958 0.99 
1 1 1 -7  1  31 o 125.5178 6.925265 126.1637  232.3 -22.42116      13.85053 0.95 
1 1 1 -7  1  32 o 99.45297 7.732869 157.7852  94.8  11.38415       15.46574 0.96 
1 1 1 -7  1  33 o 178.8166 5.276234 203.2999  245.9 -5.805664      10.55247 0.99 
1 1 1 -7  1  34 o 116.1808 7.679095 141.9007  239.1 27.67604       15.35819 0.97 
1 1 1 -7  1  35 f 63.84992 13.19350 33.62902  191.4 0.9655838      26.38700 0.00 
1 1 1 -7  1  36 o 34.43557 10.71948 60.49197  293.6 ?              ?        0.79 
1 1 1 -7  3  1  o 296.3161 2.929532 282.1953  236.7 26.12183       5.859065 0.96 
1 1 1 -7  3  2  o 171.3121 1.776240 567.7539  109.8 -23.98325      3.552481 0.86 
1 1 1 -7  3  3  o 518.4365 3.874717 561.1214  137.5 -26.21219      7.749434 0.99 
1 1 1 -7  3  4  o 671.7285 5.365242 1240.045  84.8  -75.35260      10.73048 0.99 
1 1 1 -7  3  5  o 644.4954 5.601327 420.5764  112.5 -5.963684      11.20265 0.99 
1 1 1 -7  3  6  o 346.2333 3.360451 763.6624  224.4 4.826477       6.720902 0.95 
1 1 1 -7  3  7  o 433.3190 3.994510 343.6699  189.0 -41.33981      7.989020 0.98 
1 1 1 -7  3  8  o 240.2535 2.603376 140.4352  167.0 -16.90509      5.206752 0.93 
1 1 1 -7  3  9  o 435.2762 4.152092 536.4583  220.8 27.04434       8.304183 0.98 
1 1 1 -7  3  10 o 296.0578 3.016595 403.9126  89.1  1.048767       6.033190 0.93 
1 1 1 -7  3  11 o 199.5093 2.299886 406.6810  350.4 13.72168       4.599772 0.90 
1 1 1 -7  3  12 o 484.5888 4.394153 727.2718  305.2 49.13983       8.788306 0.98 
1 1 1 -7  3  13 f 267.4844 3.126951 569.2050  233.2 -8.874329      6.253902 0.00 
1 1 1 -7  3  14 o 466.6049 4.251095 885.1913  55.0  -27.71222      8.502191 0.98 
1 1 1 -7  3  15 o 438.1085 4.098187 381.6409  346.3 -14.72604      8.196375 0.97 
1 1 1 -7  3  16 o 760.5283 9.192324 919.2939  302.9 ?              ?        0.99 
1 1 1 -7  3  17 o 935.6506 7.760842 1118.438  322.7 -51.38531      15.52168 0.99 
1 1 1 -7  3  18 o 286.5402 3.160266 421.1076  310.9 17.21561       6.320533 0.94 
1 1 1 -7  3  19 o 628.8800 5.430832 777.4564  270.6 7.190002       10.86166 0.99 
1 1 1 -7  3  20 o 257.4103 3.177566 403.2795  106.9 -23.88889      6.355132 0.96 
1 1 1 -7  3  21 o 152.8522 3.637505 295.6912  72.8  18.43317       7.275011 0.94 
1 1 1 -7  3  22 f 49.74397 7.499262 182.5996  199.5 24.18163       14.99852 0.00 
1 1 1 -7  3  23 o 229.1589 3.198432 287.8663  210.8 -31.63715      6.396865 0.97 
1 1 1 -7  3  24 o 155.0423 4.156170 273.2522  111.0 1.881683       8.312341 0.96 
1 1 1 -7  3  25 o 199.7051 3.401183 240.6171  359.7 14.59673       6.802366 0.98 
1 1 1 -7  3  26 o 85.64058 5.685975 78.38065  20.5  -32.66799      11.37195 0.83 
1 1 1 -7  3  27 o 90.47285 6.125475 133.6004  141.3 37.07745       12.25095 0.92 
1 1 1 -7  3  28 o 84.82533 7.658214 133.7384  3.1   12.05458       15.31643 0.94 
1 1 1 -7  3  29 o 72.82494 8.460191 121.1214  59.5  35.08510       16.92038 0.90 
1 1 1 -7  3  30 o 33.18091 10.12158 53.70507  40.6  -3.913109      20.24317 0.44 
1 1 1 -7  3  31 o 155.9359 5.516751 235.6091  7.6   -18.88594      11.03350 0.98 
1 1 1 -7  3  32 o 80.61317 8.926812 119.6681  22.4  -24.15462      17.85362 0.94 
1 1 1 -7  3  33 o 163.5502 5.686355 183.4928  244.3 -7.261230      11.37271 0.99 
1 1 1 -7  3  34 o 79.89853 10.96380 107.6347  217.1 -6.322670      21.92760 0.95 
1 1 1 -7  3  35 o 69.02195 12.03546 97.95368  225.7 3.840225       24.07092 0.93 
1 1 1 -7  5  1  o 389.0901 3.767715 588.9680  125.2 -10.35910      7.535429 0.97 
1 1 1 -7  5  2  o 491.8969 4.521828 600.5379  277.7 6.457947       9.043655 0.98 
1 1 1 -7  5  3  o 161.5248 2.422879 501.8622  166.7 ?              ?        0.91 
1 1 1 -7  5  4  o 145.1086 1.993152 293.6249  17.7  -37.19451      3.986304 0.62 
1 1 1 -7  5  5  o 177.3724 1.905302 440.5537  143.8 42.09372       3.810604 0.86 
1 1 1 -7  5  6  o 286.3828 3.632642 418.6119  260.0 14.77322       7.265283 0.93 
1 1 1 -7  5  7  f 292.0229 2.847329 304.6657  215.9 -41.68933      5.694658 0.00 
1 1 1 -7  5  8  o 280.9017 2.638174 739.7067  301.4 -33.70029      5.276348 0.96 
1 1 1 -7  5  9  o 198.6234 2.219447 276.1445  107.9 11.09503       4.438895 0.89 
1 1 1 -7  5  10 o 394.9100 3.632417 671.9418  224.8 48.62030       7.264834 0.97 
1 1 1 -7  5  11 o 213.8385 2.500764 365.5453  61.4  -0.3345642     5.001529 0.86 
1 1 1 -7  5  12 o 307.9390 4.072922 568.7704  43.4  66.67752       8.145844 0.95 
1 1 1 -7  5  13 f 340.0076 3.327085 254.4411  31.5  26.53030       6.654170 0.00 
1 1 1 -7  5  14 o 412.6109 4.568751 442.3960  148.5 63.83789       9.137502 0.97 
1 1 1 -7  5  15 o 494.7526 4.448359 693.5021  53.8  -20.91415      8.896719 0.98 
1 1 1 -7  5  16 o 554.9951 4.957264 750.7031  2.3   -64.56165      9.914528 0.99 
1 1 1 -7  5  17 o 406.0952 3.849330 683.2019  344.2 -15.03833      7.698661 0.98 
1 1 1 -7  5  18 o 273.0123 3.188927 275.3292  32.6  -17.72311      6.377854 0.94 
1 1 1 -7  5  19 o 492.5513 4.618995 620.7583  84.5  63.92172       9.237989 0.99 
1 1 1 -7  5  20 o 228.1316 2.922575 288.9759  346.6 -1.078934      5.845150 0.96 
1 1 1 -7  5  21 o 394.3642 3.989337 576.1536  291.0 14.61621       7.978674 0.99 
1 1 1 -7  5  22 o 250.0218 3.119454 312.1016  178.4 -0.9755859     6.238909 0.98 
1 1 1 -7  5  23 o 95.88252 4.667825 221.0842  185.4 -16.04005      9.335650 0.93 
1 1 1 -7  5  24 o 90.83841 8.363393 116.3698  160.1 -20.59386      16.72679 0.89 
1 1 1 -7  5  25 o 169.7785 3.628193 267.7108  227.9 -15.51929      7.256385 0.98 
1 1 1 -7  5  26 o 33.76935 9.457353 105.2354  342.6 0.3339081      18.91471 0.70 
1 1 1 -7  5  27 o 78.06252 8.709337 117.5157  274.7 41.34257       17.41867 0.93 
1 1 1 -7  5  28 o 113.7280 5.820960 229.3070  271.5 12.28863       11.64192 0.97 
1 1 1 -7  5  29 o 80.18452 8.409323 89.56662  22.8  26.35053       16.81865 0.87 
1 1 1 -7  5  30 o 119.2720 5.351935 131.9761  144.6 -4.514633      10.70387 0.95 
1 1 1 -7  5  31 o 88.31435 8.982491 85.69389  177.5 -9.883736      17.96498 0.92 
1 1 1 -7  5  32 o 86.63985 9.765594 110.3776  52.0  1.598602       19.53119 0.95 
1 1 1 -7  5  33 o 48.17577 12.51079 81.90384  184.2 -0.8453865     25.02159 0.87 
1 1 1 -7  5  34 o 61.63609 11.72792 93.55750  138.7 -3.168079      23.45585 0.92 
1 1 1 -7  5  35 o 52.33463 13.19912 63.76289  90.1  ?              ?        0.87 
1 1 1 -7  7  1  o 718.4641 6.256353 1145.030  174.1 1.624146       12.51271 0.99 
1 1 1 -7  7  2  f 662.5528 5.780636 817.8721  166.6 -83.97266      11.56127 0.00 
1 1 1 -7  7  3  o 337.8524 4.896706 435.5705  305.3 ?              ?        0.95 
1 1 1 -7  7  4  o 315.4032 4.653032 591.4573  11.5  ?              ?        0.95 
1 1 1 -7  7  5  o 825.8940 6.272650 1375.017  239.6 34.00317       12.54530 0.99 
1 1 1 -7  7  6  o 330.4219 3.790958 829.1020  261.7 33.43967       7.581916 0.97 
1 1 1 -7  7  7  o 668.4242 7.072148 927.2559  243.2 -22.52289      14.14430 0.99 
1 1 1 -7  7  8  o 417.8497 4.589262 593.2590  105.4 11.43015       9.178523 0.98 
1 1 1 -7  7  9  o 584.2090 7.226298 952.1127  359.5 32.23138       14.45260 0.99 
1 1 1 -7  7  10 o 277.3446 4.247252 381.8584  13.8  49.97800       8.494505 0.95 
1 1 1 -7  7  11 o 179.2206 4.228146 88.38547  209.6 -1.213333      8.456292 0.77 
1 1 1 -7  7  12 o 276.2648 3.471396 457.6084  316.2 12.15933       6.942792 0.96 
1 1 1 -7  7  13 o 106.7779 2.296592 278.5330  313.7 7.823143       4.593185 0.76 
1 1 1 -7  7  14 o 487.5526 4.218205 798.7284  98.0  25.91739       8.436411 0.99 
1 1 1 -7  7  15 o 567.6641 4.929678 797.0788  85.6  -36.15277      9.859356 0.99 
1 1 1 -7  7  16 o 281.4975 4.075993 458.2726  147.8 ?              ?        0.97 
1 1 1 -7  7  17 o 279.2606 3.195513 370.8635  63.8  29.20306       6.391026 0.98 
1 1 1 -7  7  18 o 100.1316 3.173987 293.3694  122.0 5.556526       6.347973 0.94 
1 1 1 -7  7  19 o 168.5419 2.942861 201.3599  263.6 -4.580307      5.885722 0.95 
1 1 1 -7  7  20 o 145.7141 3.170179 210.9502  69.3  28.43965       6.340359 0.95 
1 1 1 -7  7  21 o 147.2962 3.464021 272.9256  337.5 38.53787       6.928041 0.97 
1 1 1 -7  7  22 f 204.4919 3.497246 341.0425  8.4   7.699371       6.994491 0.00 
1 1 1 -7  7  23 o 117.2652 3.845825 198.7610  261.8 -1.712585      7.691651 0.96 
1 1 1 -7  7  24 o 53.22166 8.337580 139.8223  133.5 -10.21867      16.67516 0.87 
1 1 1 -7  7  25 f 156.4513 4.228067 254.5929  354.3 34.25021       8.456134 0.00 
1 1 1 -7  7  26 o 82.94830 5.947171 139.5689  14.8  8.722061       11.89434 0.94 
1 1 1 -7  7  27 f 208.1730 5.655941 311.5011  55.5  -33.17827      11.31188 0.00 
1 1 1 -7  7  28 o 254.3611 4.656454 347.9327  69.3  16.23439       9.312908 0.99 
1 1 1 -7  7  29 o 112.3071 7.024920 192.3105  59.0  30.34592       14.04984 0.97 
1 1 1 -7  7  30 o 62.25690 10.51686 50.04395  4.2   17.24083       21.03372 0.81 
1 1 1 -7  7  31 o 38.63848 10.99675 19.18983  274.5 14.86599       21.99350 0.39 
1 1 1 -7  7  32 o 71.07787 10.59157 125.3602  42.3  -37.48570      21.18315 0.95 
1 1 1 -7  7  33 o 61.58860 11.99386 94.95929  255.2 34.89585       23.98772 0.93 
1 1 1 -7  9  1  o 417.2589 4.988615 625.0649  218.7 15.79703       9.977229 0.98 
1 1 1 -7  9  2  o 607.2773 5.486069 809.1335  250.7 -47.67810      10.97214 0.99 
1 1 1 -7  9  3  o 302.9778 3.269462 515.8594  251.5 -1.464874      6.538924 0.96 
1 1 1 -7  9  4  o 268.7920 3.633196 410.8196  20.5  -15.18781      7.266393 0.95 
1 1 1 -7  9  5  o 363.0152 3.668302 828.7731  10.1  38.22385       7.336604 0.98 
1 1 1 -7  9  6  o 269.4707 2.933652 310.6051  208.8 -59.57391      5.867303 0.93 
1 1 1 -7  9  7  o 431.7614 3.647508 566.8818  236.2 34.79190       7.295015 0.98 
1 1 1 -7  9  8  o 301.3113 4.089104 411.5866  324.0 -17.17154      8.178208 0.96 
1 1 1 -7  9  9  f 144.0581 5.556775 204.9003  228.0 ?              ?        0.00 
1 1 1 -7  9  10 o 229.4796 4.195061 336.4837  225.9 -0.9890137     8.390122 0.94 
1 1 1 -7  9  11 o 199.1915 4.267818 298.7900  200.5 -10.97739      8.535637 0.94 
1 1 1 -7  9  12 o 245.3254 4.231668 504.3792  177.2 -20.49545      8.463336 0.98 
1 1 1 -7  9  13 o 228.6902 4.278523 305.6946  28.9  -35.22136      8.557047 0.96 
1 1 1 -7  9  14 o 221.2098 4.466462 460.3368  271.9 -5.366699      8.932924 0.98 
1 1 1 -7  9  15 f 197.1818 4.343277 304.2433  187.9 -26.03986      8.686554 0.00 
1 1 1 -7  9  16 o 54.70721 9.879467 107.3355  290.7 -18.12203      19.75893 0.65 
1 1 1 -7  9  17 o 171.5992 5.209196 230.3489  327.1 -29.58374      10.41839 0.96 
1 1 1 -7  9  18 o 162.1697 2.429847 253.7132  250.0 -18.04764      4.859693 0.97 
1 1 1 -7  9  19 o 59.98389 5.278701 95.23612  91.2  -9.468002      10.55740 0.79 
1 1 1 -7  9  20 o 255.4443 3.465653 354.5216  94.6  3.300583       6.931306 0.99 
1 1 1 -7  9  21 o 217.9004 3.292534 365.2424  98.0  1.681305       6.585067 0.99 
1 1 1 -7  9  22 o 104.7091 3.871141 145.8897  113.6 -29.69120      7.742282 0.95 
1 1 1 -7  9  23 o 112.8531 3.799738 184.5962  125.5 -4.712914      7.599475 0.97 
1 1 1 -7  9  24 f 103.3535 4.918268 93.56716  79.0  9.228462       9.836536 0.00 
1 1 1 -7  9  25 o 185.4971 3.834048 305.4258  36.1  12.79475       7.668096 0.99 
1 1 1 -7  9  26 o 123.4046 4.646987 164.6869  5.4   8.506187       9.293975 0.97 
1 1 1 -7  9  27 o 106.9054 5.899713 156.0790  268.4 32.11774       11.79943 0.97 
1 1 1 -7  9  28 o 77.82449 7.449266 133.5128  129.9 -1.840408      14.89853 0.95 
1 1 1 -7  9  29 o 67.52373 10.45321 129.5233  173.8 14.62421       20.90641 0.95 
1 1 1 -7  9  30 f 90.46703 12.48624 148.1149  136.5 ?              ?        0.00 
1 1 1 -7  9  31 o 56.44228 11.73221 96.30261  110.7 -30.49060      23.46442 0.92 
1 1 1 -7  9  32 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -7  11 1  o 170.5052 2.883386 166.0844  196.7 25.84908       5.766772 0.92 
1 1 1 -7  11 2  o 235.5230 3.006823 452.7930  163.5 92.73451       6.013646 0.98 
1 1 1 -7  11 3  o 457.8673 4.491596 803.4283  136.3 50.00061       8.983192 0.99 
1 1 1 -7  11 4  o 384.2795 3.836832 699.2695  117.2 27.13104       7.673665 0.99 
1 1 1 -7  11 5  o 249.3957 3.050739 396.0635  157.7 22.14317       6.101478 0.98 
1 1 1 -7  11 6  o 90.82574 3.520574 256.2292  91.3  18.48991       7.041149 0.92 
1 1 1 -7  11 7  o 139.3115 2.508259 266.0372  62.1  -11.52612      5.016518 0.96 
1 1 1 -7  11 8  o 210.5899 2.421663 372.1433  47.6  -11.57895      4.843327 0.98 
1 1 1 -7  11 9  o 106.0167 4.338198 238.9762  127.1 -14.48074      8.676396 0.94 
1 1 1 -7  11 10 o 142.8299 5.280983 243.4889  133.5 -32.91080      10.56197 0.96 
1 1 1 -7  11 11 o 155.8152 5.129700 309.9690  29.2  -15.88026      10.25940 0.97 
1 1 1 -7  11 12 o 97.36225 7.513191 179.5439  294.1 -35.66129      15.02638 0.91 
1 1 1 -7  11 13 o 100.4737 7.422963 154.1755  99.4  -17.52496      14.84593 0.92 
1 1 1 -7  11 14 o 125.1034 6.104770 147.8956  27.4  -34.94302      12.20954 0.94 
1 1 1 -7  11 15 f 96.66083 7.944520 172.5088  22.9  -21.14512      15.88904 0.00 
1 1 1 -7  11 16 o 215.0464 5.283720 403.1895  258.8 4.116074       10.56744 0.99 
1 1 1 -7  11 17 o 272.1856 5.077548 514.4083  191.1 -18.30042      10.15510 0.99 
1 1 1 -7  11 18 o 68.26891 10.42288 119.4078  338.5 -23.43921      20.84577 0.90 
1 1 1 -7  11 19 f 112.4075 9.257816 198.7260  315.8 ?              ?        0.00 
1 1 1 -7  11 20 o 93.64240 11.30297 197.7061  235.7 ?              ?        0.96 
1 1 1 -7  11 21 o 88.30045 14.00135 187.5008  235.8 ?              ?        0.95 
1 1 1 -7  11 22 o 55.67257 17.66936 65.98842  233.3 ?              ?        0.68 
1 1 1 -7  11 23 o 72.43198 13.51780 100.0400  105.6 -1.745903      27.03560 0.88 
1 1 1 -7  11 24 o 83.38925 5.676492 146.7795  285.7 -16.09212      11.35298 0.95 
1 1 1 -7  11 25 o 105.9541 4.868878 189.9899  338.8 -13.08297      9.737756 0.98 
1 1 1 -7  11 26 f 48.93772 8.614826 87.43114  55.7  28.95312       17.22965 0.00 
1 1 1 -7  11 27 o 36.58500 10.28442 33.82034  229.5 -9.546337      20.56885 0.61 
1 1 1 -7  11 28 o 73.80113 8.472763 140.2758  205.3 -17.72529      16.94553 0.96 
1 1 1 -7  11 29 f 84.86505 7.145843 115.1828  221.5 ?              ?        0.00 
1 1 1 -7  13 1  o 187.7721 3.228708 389.0898  89.5  18.88751       6.457415 0.99 
1 1 1 -7  13 2  o 86.65286 4.965132 90.58164  123.1 -34.77905      9.930264 0.87 
1 1 1 -7  13 3  o 113.3927 3.857724 161.6732  86.1  -6.513374      7.715448 0.95 
1 1 1 -7  13 4  o 117.2404 3.510849 265.9233  65.0  32.62944       7.021698 0.97 
1 1 1 -7  13 5  o 148.5821 3.221149 321.5632  286.2 2.145920       6.442297 0.98 
1 1 1 -7  13 6  o 133.4727 3.209394 207.1388  294.8 27.44120       6.418787 0.97 
1 1 1 -7  13 7  o 142.9034 3.196755 226.8637  325.9 2.041946       6.393509 0.97 
1 1 1 -7  13 8  o 120.5301 3.026158 199.9816  236.3 -9.841736      6.052316 0.97 
1 1 1 -7  13 9  o 155.1466 2.654904 276.3636  124.9 -23.74608      5.309808 0.98 
1 1 1 -7  13 10 o 63.50517 9.800783 81.64254  58.4  -19.92620      19.60157 0.82 
1 1 1 -7  13 11 o 49.23262 12.03380 134.1410  297.4 -8.256989      24.06760 0.86 
1 1 1 -7  13 12 o 131.0469 7.011577 263.4229  148.2 -34.70769      14.02315 0.98 
1 1 1 -7  13 13 o 90.97231 10.94644 162.9944  144.0 -36.67387      21.89289 0.96 
1 1 1 -7  13 14 o 103.9837 8.568052 173.7431  299.7 3.777611       17.13610 0.97 
1 1 1 -7  13 15 o 54.25241 13.11367 46.37910  239.2 16.94749       26.22734 0.65 
1 1 1 -7  13 16 o 94.45000 10.48158 151.4702  3.8   18.60616       20.96315 0.95 
1 1 1 -7  13 17 o 101.1148 10.54052 164.7938  31.3  0.7741013      21.08104 0.95 
1 1 1 -7  13 18 o 93.44005 11.47603 166.6367  287.1 -9.572380      22.95207 0.95 
1 1 1 -7  13 19 o 265.5681 6.089616 490.1534  258.3 7.854767       12.17923 1.00 
1 1 1 -7  13 20 o 98.84294 11.82087 193.4537  263.3 -42.27030      23.64174 0.97 
1 1 1 -7  13 21 o 71.55907 13.09735 171.5251  244.9 -32.32632      26.19470 0.95 
1 1 1 -7  13 22 o 127.5559 9.581605 221.9528  234.0 -8.768570      19.16321 0.99 
1 1 1 -7  13 23 o 40.35188 13.08930 82.59798  41.4  5.974838       26.17859 0.85 
1 1 1 -7  13 24 o 40.30350 12.74946 73.90529  273.6 7.995911       25.49892 0.83 
1 1 1 -7  13 25 o 43.55738 13.98086 73.97790  219.4 27.61435       27.96173 0.84 
1 1 1 -7  13 26 o 32.51163 15.27420 9.369440  130.8 ?              ?        0.16 
1 1 1 -7  15 1  o 169.3895 4.856369 351.4800  97.4  -7.561218      9.712739 0.99 
1 1 1 -7  15 2  f 123.9809 4.385261 280.8319  165.5 12.24347       8.770521 0.00 
1 1 1 -7  15 3  o 176.1772 3.677200 302.7573  239.0 8.856476       7.354399 0.99 
1 1 1 -7  15 4  o 65.09988 6.868159 133.5723  71.1  14.73329       13.73632 0.93 
1 1 1 -7  15 5  o 124.9565 4.264570 240.0319  114.0 20.08479       8.529140 0.98 
1 1 1 -7  15 6  o 104.6149 4.721458 153.9263  322.8 -17.88454      9.442916 0.96 
1 1 1 -7  15 7  f 142.2963 3.640787 236.6276  275.1 11.35580       7.281573 0.00 
1 1 1 -7  15 8  o 69.23729 5.549540 118.0107  139.1 2.140076       11.09908 0.91 
1 1 1 -7  15 9  o 32.15595 7.495308 62.16959  209.3 -3.800451      14.99062 0.60 
1 1 1 -7  15 10 o 62.53408 4.737186 44.52521  170.4 41.17432       9.474372 0.74 
1 1 1 -7  15 11 o 105.2869 9.504683 202.7976  254.5 11.97280       19.00937 0.97 
1 1 1 -7  15 12 o 164.3591 7.174964 296.2476  316.0 4.428055       14.34993 0.99 
1 1 1 -7  15 13 o 66.36947 12.83845 146.8607  310.6 -21.54233      25.67689 0.93 
1 1 1 -7  15 14 o 60.66652 14.39543 112.2616  201.7 -1.347935      28.79087 0.90 
1 1 1 -7  15 15 o 122.8760 9.447972 215.8754  102.3 16.84843       18.89594 0.98 
1 1 1 -7  15 16 o 106.6911 12.97146 187.8883  88.8  -23.70655      25.94292 0.98 
1 1 1 -7  15 17 o 123.5724 10.40700 142.0999  81.3  47.05180       20.81400 0.98 
1 1 1 -7  15 18 o 49.15641 14.11705 62.61693  117.0 0.1129303      28.23409 0.83 
1 1 1 -7  15 19 o 49.85524 13.75603 64.40025  211.2 -20.20713      27.51205 0.84 
1 1 1 -7  15 20 o 58.14458 14.86056 109.4217  107.1 -17.37494      29.72113 0.92 
1 1 1 -7  15 21 o 57.12745 11.57782 102.8809  100.2 ?              ?        0.93 
1 1 1 -7  15 22 o 35.58219 15.97167 36.80529  224.3 ?              ?        0.56 
1 1 1 -7  17 1  o 103.8902 5.940308 166.1975  321.4 12.06962       11.88062 0.98 
1 1 1 -7  17 2  o 91.28207 8.642213 186.5445  261.2 7.797302       17.28443 0.98 
1 1 1 -7  17 3  o 31.36523 9.624897 53.16069  61.0  9.824013       19.24979 0.73 
1 1 1 -7  17 4  o 84.12502 7.927116 171.6956  66.3  11.81133       15.85423 0.98 
1 1 1 -7  17 5  o 108.4664 5.919886 207.1818  338.8 -14.39371      11.83977 0.99 
1 1 1 -7  17 6  o 139.3682 4.646761 266.7754  312.9 1.219910       9.293523 0.99 
1 1 1 -7  17 7  o 55.11575 9.331288 69.16112  95.6  6.501007       18.66258 0.91 
1 1 1 -7  17 8  o 59.47832 8.226228 129.3159  117.3 -15.72673      16.45246 0.96 
1 1 1 -7  17 9  o 27.19204 8.082088 20.30960  135.2 4.007858       16.16418 0.40 
1 1 1 -7  17 10 o 150.9762 3.380165 284.5681  164.6 8.821167       6.760329 0.99 
1 1 1 -7  17 11 o 85.90456 14.51880 182.6955  162.9 31.84721       29.03760 0.97 
1 1 1 -7  17 12 o 32.38416 10.81222 69.96384  162.2 -5.910549      21.62444 0.82 
1 1 1 -7  17 13 o 67.60120 11.04347 152.6577  147.1 -70.40450      22.08693 0.96 
1 1 1 -7  17 14 o 60.85677 13.95082 96.02274  169.3 ?              ?        0.92 
1 1 1 -7  17 15 o 35.52962 12.11030 65.41803  111.0 ?              ?        0.82 
1 1 1 -6  0  1  o 99.86911 2.765575 1973.853  180.0 -0.000000      0.000000 0.66 
1 1 1 -6  0  2  o 627.3233 8.567325 1678.131  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  3  o 577.6172 7.763979 3030.932  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  4  f 458.5021 6.404432 1080.250  0.0   -0.000000      0.000000 0.00 
1 1 1 -6  0  5  o 378.2457 5.764160 30.95840  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  6  o 403.2070 5.892630 364.7802  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  7  o 938.3301 11.84350 1480.095  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  8  o 512.3145 7.051668 956.3235  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  9  o 719.8514 9.356979 737.5310  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  10 o 484.2390 6.835893 204.1380  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  11 o 431.1985 6.335620 638.8074  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  12 o 529.7274 7.256582 689.8586  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  13 o 32.42672 8.895887 216.4244  180.0 -0.000000      0.000000 0.29 
1 1 1 -6  0  14 o 382.1889 5.634649 457.2890  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  15 o 56.92392 5.894521 72.82858  180.0 -0.000000      0.000000 0.24 
1 1 1 -6  0  16 o 62.46235 5.788799 36.31961  0.0   -0.000000      0.000000 0.01 
1 1 1 -6  0  17 o 43.02216 9.461625 203.3931  0.0   -0.000000      0.000000 0.27 
1 1 1 -6  0  18 o 152.1444 3.863914 159.1152  180.0 -0.000000      0.000000 0.52 
1 1 1 -6  0  19 o 258.0233 4.415232 233.1127  0.0   -0.000000      0.000000 0.97 
1 1 1 -6  0  20 o 109.8754 4.877687 64.50061  0.0   -0.000000      0.000000 0.39 
1 1 1 -6  0  21 o 257.3824 4.183901 90.38463  180.0 -0.000000      0.000000 0.96 
1 1 1 -6  0  22 o 46.98233 12.72721 191.1398  180.0 -0.000000      0.000000 0.71 
1 1 1 -6  0  23 o 454.1146 6.211465 544.1438  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  24 o 204.1066 4.362173 319.2752  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  25 o 331.2916 7.984074 283.7569  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  26 o 272.0298 4.842515 338.8894  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  27 o 280.9902 5.671194 357.3931  0.0   -0.000000      0.000000 1.00 
1 1 1 -6  0  28 o 54.29087 17.19030 73.15194  0.0   -0.000000      0.000000 0.83 
1 1 1 -6  0  29 o 259.5800 5.865926 373.9725  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  30 o 118.8546 8.390868 215.1927  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  31 o 23.82073 15.66181 72.51524  0.0   -0.000000      0.000000 0.47 
1 1 1 -6  0  32 f 20.67191 14.52872 77.17756  0.0   -0.000000      0.000000 0.00 
1 1 1 -6  0  33 o 314.3052 6.969104 388.1416  180.0 -0.000000      0.000000 1.00 
1 1 1 -6  0  34 o 22.14292 15.38728 8.798741  0.0   -0.000000      0.000000 0.11 
1 1 1 -6  0  35 o 19.37486 13.91483 20.95464  0.0   -0.000000      0.000000 0.24 
1 1 1 -6  0  36 o 122.0711 11.94027 130.5485  180.0 ?              ?        1.00 
1 1 1 -6  2  1  o 442.2222 3.535232 1971.916  309.8 -77.00543      7.070464 0.98 
1 1 1 -6  2  2  o 450.2190 3.526424 515.8738  318.9 20.09921       7.052848 0.98 
1 1 1 -6  2  3  o 308.8127 3.219957 340.0196  141.8 44.70828       6.439915 0.95 
1 1 1 -6  2  4  f 183.3959 3.346398 110.1211  99.8  ?              ?        0.00 
1 1 1 -6  2  5  o 541.4551 4.938666 1214.040  100.4 108.0833       9.877333 0.99 
1 1 1 -6  2  6  o 703.6902 6.184466 1631.853  161.9 -17.36737      12.36893 0.99 
1 1 1 -6  2  7  o 505.2261 4.680613 749.0273  249.1 -5.746674      9.361225 0.99 
1 1 1 -6  2  8  o 344.5323 3.452164 373.5247  14.2  -86.01761      6.904327 0.96 
1 1 1 -6  2  9  o 86.52697 2.878225 23.11498  115.8 ?              ?        0.80 
1 1 1 -6  2  10 o 590.8884 5.357389 598.7456  247.6 -81.74493      10.71478 0.99 
1 1 1 -6  2  11 o 263.8182 2.954124 762.4069  50.9  -20.61176      5.908248 0.94 
1 1 1 -6  2  12 o 404.1912 4.013098 655.8743  13.9  -40.77292      8.026196 0.97 
1 1 1 -6  2  13 o 43.68713 4.116132 171.8220  111.8 -3.055035      8.232265 0.41 
1 1 1 -6  2  14 o 627.7128 5.557847 788.4699  145.3 -69.36053      11.11569 0.99 
1 1 1 -6  2  15 o 371.7955 4.538761 537.2057  185.0 -26.25012      9.077522 0.96 
1 1 1 -6  2  16 o 114.0882 2.882854 244.9488  292.4 16.99406       5.765708 0.74 
1 1 1 -6  2  17 o 165.2125 2.703448 182.6177  286.3 3.118271       5.406896 0.75 
1 1 1 -6  2  18 o 187.4953 3.889928 302.3956  33.2  ?              ?        0.88 
1 1 1 -6  2  19 o 212.0029 2.858217 242.5128  220.2 43.39424       5.716434 0.88 
1 1 1 -6  2  20 o 233.4475 3.819569 253.5127  0.3   -14.02406      7.639138 0.92 
1 1 1 -6  2  21 o 55.20423 6.575459 75.14213  229.6 1.181168       13.15092 0.33 
1 1 1 -6  2  22 o 315.1680 3.510348 335.1971  106.8 -21.37332      7.020696 0.98 
1 1 1 -6  2  23 o 32.54873 8.596567 102.9689  302.4 3.721975       17.19313 0.39 
1 1 1 -6  2  24 o 410.8504 4.270798 538.5475  118.6 8.345093       8.541595 0.99 
1 1 1 -6  2  25 o 216.2954 3.360035 289.9518  180.8 -30.83099      6.720070 0.98 
1 1 1 -6  2  26 o 160.9818 3.683228 168.0814  194.9 -12.00514      7.366456 0.96 
1 1 1 -6  2  27 o 189.0138 4.074845 307.8214  120.3 43.56424       8.149690 0.98 
1 1 1 -6  2  28 o 140.0291 4.649687 148.4294  97.1  2.793747       9.299375 0.97 
1 1 1 -6  2  29 o 57.58511 10.65967 91.07567  186.8 8.250080       21.31933 0.83 
1 1 1 -6  2  30 o 324.8016 5.861070 419.4050  201.9 -24.41605      11.72214 0.99 
1 1 1 -6  2  31 o 201.5107 4.774107 240.9942  127.9 -11.85670      9.548213 0.98 
1 1 1 -6  2  32 o 120.8814 6.739091 119.8059  86.3  4.825050       13.47818 0.96 
1 1 1 -6  2  33 o 83.79148 10.58655 159.6576  290.0 -33.54895      21.17309 0.96 
1 1 1 -6  2  34 o 38.12606 11.56829 23.24405  245.2 -6.704880      23.13658 0.43 
1 1 1 -6  2  35 o 78.04526 11.57463 88.82502  230.8 3.816788       23.14926 0.93 
1 1 1 -6  2  36 x ?        ?        105.0616  267.7 ?              ?        0.00 
1 1 1 -6  4  1  o 1115.123 9.342973 1468.449  180.5 122.0748       18.68595 1.00 
1 1 1 -6  4  2  o 377.4606 5.066232 496.4705  281.3 ?              ?        0.97 
1 1 1 -6  4  3  o 490.9566 4.069903 326.9415  221.5 32.57938       8.139806 0.98 
1 1 1 -6  4  4  o 591.8999 5.150105 999.2734  325.2 69.37946       10.30021 0.99 
1 1 1 -6  4  5  o 366.6847 3.474518 817.3312  44.3  -101.6817      6.949035 0.96 
1 1 1 -6  4  6  o 427.4727 3.849388 796.2538  322.8 -70.51617      7.698775 0.98 
1 1 1 -6  4  7  o 460.2690 4.007106 508.5794  156.6 66.70667       8.014212 0.98 
1 1 1 -6  4  8  o 159.9921 1.907749 180.8882  213.6 46.67645       3.815499 0.81 
1 1 1 -6  4  9  o 315.7114 3.046927 193.0067  143.4 16.17773       6.093854 0.92 
1 1 1 -6  4  10 o 108.9715 1.875851 173.0054  343.9 23.58369       3.751701 0.05 
1 1 1 -6  4  11 o 131.3007 1.985152 285.5655  99.4  -66.77787      3.970304 0.73 
1 1 1 -6  4  12 o 232.6070 2.469642 588.3925  137.9 27.75023       4.939284 0.92 
1 1 1 -6  4  13 o 750.0485 6.305141 920.9846  185.5 21.81470       12.61028 0.99 
1 1 1 -6  4  14 f 346.1907 3.289061 559.8182  246.0 5.306976       6.578122 0.00 
1 1 1 -6  4  15 o 412.0220 3.784617 633.0964  244.6 -19.31699      7.569233 0.97 
1 1 1 -6  4  16 o 687.6375 5.744070 791.5566  320.4 2.868103       11.48814 0.99 
1 1 1 -6  4  17 o 57.12225 5.511601 78.43451  337.9 -29.57884      11.02320 0.14 
1 1 1 -6  4  18 o 225.4586 2.678958 191.3925  42.0  -0.9394531     5.357916 0.84 
1 1 1 -6  4  19 o 78.73669 4.632460 245.8468  241.4 -38.94488      9.264920 0.73 
1 1 1 -6  4  20 o 111.8934 3.546202 158.2952  277.3 16.53738       7.092404 0.81 
1 1 1 -6  4  21 o 181.4598 3.067353 226.2495  235.3 1.565277       6.134707 0.95 
1 1 1 -6  4  22 o 245.8447 3.224349 249.9088  89.8  29.64253       6.448699 0.97 
1 1 1 -6  4  23 o 56.11898 7.520846 86.50967  75.8  -24.07645      15.04169 0.60 
1 1 1 -6  4  24 o 138.2678 3.732098 175.1559  95.6  1.441895       7.464197 0.95 
1 1 1 -6  4  25 o 164.1415 4.106806 231.3352  210.5 -25.58002      8.213612 0.97 
1 1 1 -6  4  26 o 287.4000 3.723849 408.4184  232.4 -0.9201660     7.447697 0.99 
1 1 1 -6  4  27 o 139.2550 4.472828 206.5800  314.9 -0.4945526     8.945657 0.97 
1 1 1 -6  4  28 o 173.0017 4.715981 217.0874  340.9 -14.30217      9.431961 0.98 
1 1 1 -6  4  29 o 58.67079 12.59459 32.18385  336.4 -7.410721      25.18918 0.43 
1 1 1 -6  4  30 o 32.17854 9.383319 15.72274  270.6 -17.54713      18.76664 0.15 
1 1 1 -6  4  31 o 116.6293 6.377352 107.9818  55.7  -9.666405      12.75470 0.95 
1 1 1 -6  4  32 o 42.70206 11.19036 59.83671  275.8 16.40821       22.38071 0.76 
1 1 1 -6  4  33 o 51.80067 12.24503 56.98306  195.7 18.36244       24.49006 0.82 
1 1 1 -6  4  34 o 93.30125 9.973924 94.45004  89.2  -5.323227      19.94785 0.95 
1 1 1 -6  4  35 o 69.03845 14.89940 96.09680  150.8 ?              ?        0.93 
1 1 1 -6  6  1  o 125.7453 2.077235 296.3224  256.6 -34.64983      4.154469 0.58 
1 1 1 -6  6  2  o 274.5079 2.909132 351.3419  183.4 -65.59486      5.818265 0.91 
1 1 1 -6  6  3  o 380.6870 3.631060 613.3934  248.7 -48.94128      7.262120 0.98 
1 1 1 -6  6  4  o 776.4338 9.187304 1596.932  282.9 ?              ?        0.99 
1 1 1 -6  6  5  o 763.4161 5.769683 1213.169  224.1 22.88928       11.53937 0.99 
1 1 1 -6  6  6  o 659.5919 7.111252 1019.115  267.5 49.66034       14.22250 0.99 
1 1 1 -6  6  7  o 265.7763 3.513286 324.1035  253.9 3.415131       7.026572 0.91 
1 1 1 -6  6  8  o 431.6681 6.135681 694.2423  52.0  66.98151       12.27136 0.97 
1 1 1 -6  6  9  o 259.3447 4.063157 273.9685  217.2 56.38295       8.126313 0.92 
1 1 1 -6  6  10 o 361.4053 4.552976 549.2502  15.4  ?              ?        0.96 
1 1 1 -6  6  11 o 1080.224 8.553206 1815.995  144.5 14.87012       17.10641 1.00 
1 1 1 -6  6  12 o 107.9906 2.255506 175.6159  4.5   -40.27101      4.511012 0.62 
1 1 1 -6  6  13 o 784.5789 7.884882 1132.524  2.0   18.60980       15.76976 0.99 
1 1 1 -6  6  14 o 383.9990 3.538644 505.8316  339.0 50.29898       7.077289 0.97 
1 1 1 -6  6  15 o 167.9354 2.413786 234.3492  265.5 -17.94601      4.827572 0.81 
1 1 1 -6  6  16 o 470.6736 4.214567 803.8601  204.8 23.56860       8.429134 0.99 
1 1 1 -6  6  17 o 127.3525 2.862604 206.6626  270.9 -14.58181      5.725207 0.83 
1 1 1 -6  6  18 o 40.58715 6.960576 137.1851  203.1 -2.069523      13.92115 0.42 
1 1 1 -6  6  19 o 227.3692 2.979018 410.4873  320.0 -39.88960      5.958036 0.98 
1 1 1 -6  6  20 o 207.2398 3.948506 312.2185  316.7 ?              ?        0.97 
1 1 1 -6  6  21 o 144.9385 3.108635 239.7967  198.6 6.581573       6.217271 0.95 
1 1 1 -6  6  22 o 208.0883 3.173208 444.5043  94.4  6.078979       6.346415 0.99 
1 1 1 -6  6  23 o 91.47470 4.909913 156.0457  28.9  -41.80675      9.819826 0.92 
1 1 1 -6  6  24 o 216.2223 4.014738 290.0876  359.4 -5.740082      8.029475 0.98 
1 1 1 -6  6  25 o 271.0673 5.008829 418.3285  21.6  -34.28128      10.01766 0.99 
1 1 1 -6  6  26 o 95.13788 5.950629 129.4479  43.1  12.81509       11.90126 0.95 
1 1 1 -6  6  27 o 79.54181 7.466498 197.1382  23.0  -6.410507      14.93300 0.95 
1 1 1 -6  6  28 o 114.3148 5.692750 150.1057  53.3  -18.51018      11.38550 0.95 
1 1 1 -6  6  29 o 95.31241 8.006626 127.1056  47.0  16.34801       16.01325 0.94 
1 1 1 -6  6  30 o 55.87962 11.20218 88.82411  316.5 1.748684       22.40437 0.86 
1 1 1 -6  6  31 o 31.72227 10.25595 23.77918  339.1 5.918140       20.51191 0.36 
1 1 1 -6  6  32 o 40.33279 11.10058 33.06369  0.1   -20.22176      22.20116 0.60 
1 1 1 -6  6  33 o 112.1849 7.589922 177.0791  237.8 11.77617       15.17984 0.98 
1 1 1 -6  6  34 o 32.59398 10.61551 32.11914  24.9  ?              ?        0.57 
1 1 1 -6  8  1  o 301.0844 3.378308 505.7950  240.2 -3.998932      6.756616 0.95 
1 1 1 -6  8  2  o 164.4900 2.587285 156.6773  194.4 -67.79329      5.174569 0.80 
1 1 1 -6  8  3  o 228.3912 3.437413 268.9872  239.0 4.628693       6.874826 0.89 
1 1 1 -6  8  4  o 291.9008 3.048748 410.6282  41.2  -14.28540      6.097497 0.95 
1 1 1 -6  8  5  o 200.2949 2.682598 236.8905  56.1  16.02196       5.365195 0.86 
1 1 1 -6  8  6  o 616.8203 4.785177 1101.622  171.2 -25.67072      9.570354 0.99 
1 1 1 -6  8  7  o 267.9916 3.581736 447.4379  301.7 -20.60837      7.163471 0.95 
1 1 1 -6  8  8  o 650.1121 6.733896 1010.261  104.4 -42.71118      13.46779 0.99 
1 1 1 -6  8  9  o 343.9189 4.983236 612.1731  126.1 2.426575       9.966473 0.97 
1 1 1 -6  8  10 o 517.1403 9.184404 913.5518  255.0 ?              ?        0.99 
1 1 1 -6  8  11 o 194.0934 4.626141 114.8018  354.8 4.902588       9.252281 0.67 
1 1 1 -6  8  12 o 363.5264 5.219916 551.6727  62.5  -85.83505      10.43983 0.98 
1 1 1 -6  8  13 o 405.0643 5.300253 705.0615  35.6  -12.61856      10.60051 0.99 
1 1 1 -6  8  14 o 144.6791 5.087597 156.9244  50.3  38.21122       10.17519 0.81 
1 1 1 -6  8  15 o 242.7986 2.306592 388.2708  232.1 12.62735       4.613183 0.97 
1 1 1 -6  8  16 o 313.8384 3.153462 538.1531  261.9 27.49887       6.306923 0.99 
1 1 1 -6  8  17 o 291.3617 3.237783 390.7010  41.1  10.53976       6.475565 0.99 
1 1 1 -6  8  18 o 219.7249 3.082301 281.7040  322.4 49.16164       6.164602 0.97 
1 1 1 -6  8  19 o 241.2822 3.324091 314.6389  3.9   30.59004       6.648182 0.98 
1 1 1 -6  8  20 o 80.66544 4.371427 76.82271  186.4 -10.72655      8.742853 0.77 
1 1 1 -6  8  21 o 54.74259 7.431211 127.2119  320.2 35.71500       14.86242 0.84 
1 1 1 -6  8  22 o 104.1128 4.514798 75.82106  273.2 24.19530       9.029595 0.88 
1 1 1 -6  8  23 o 162.2205 3.601869 250.9140  109.0 -14.90875      7.203738 0.98 
1 1 1 -6  8  24 o 175.2703 3.729579 321.9348  127.4 -12.37888      7.459159 0.99 
1 1 1 -6  8  25 o 42.46223 9.843882 56.00299  76.9  1.544594       19.68776 0.61 
1 1 1 -6  8  26 o 137.1479 5.043831 161.9806  266.6 -5.920822      10.08766 0.96 
1 1 1 -6  8  27 f 82.20416 8.465321 98.46688  193.0 34.39762       16.93064 0.00 
1 1 1 -6  8  28 o 178.8659 6.455254 231.5885  100.9 -17.85986      12.91051 0.99 
1 1 1 -6  8  29 o 142.7042 4.977604 192.8275  93.8  -16.40160      9.955209 0.98 
1 1 1 -6  8  30 o 95.44057 8.333343 160.6842  20.4  11.34399       16.66669 0.97 
1 1 1 -6  8  31 o 44.56376 12.67960 50.01747  22.1  5.501877       25.35921 0.75 
1 1 1 -6  8  32 o 90.96118 8.835896 158.4882  31.9  -9.574554      17.67179 0.97 
1 1 1 -6  10 1  o 178.3081 3.040123 139.2971  37.4  36.20406       6.080245 0.80 
1 1 1 -6  10 2  o 84.95888 3.535434 184.8352  100.9 36.62276       7.070867 0.61 
1 1 1 -6  10 3  o 118.1063 2.953914 203.5156  65.7  40.26893       5.907829 0.75 
1 1 1 -6  10 4  o 104.3308 3.393230 301.2871  352.7 19.74718       6.786460 0.86 
1 1 1 -6  10 5  o 70.94239 3.899555 83.73703  184.6 -3.626892      7.799110 0.36 
1 1 1 -6  10 6  o 100.5579 3.096502 141.3712  277.2 1.055580       6.193004 0.68 
1 1 1 -6  10 7  o 158.4583 2.309648 331.8306  214.9 -35.48280      4.619296 0.93 
1 1 1 -6  10 8  o 170.9253 2.167091 273.9926  147.8 -6.801758      4.334182 0.94 
1 1 1 -6  10 9  o 97.21062 5.852553 150.0480  136.7 -5.888443      11.70511 0.82 
1 1 1 -6  10 10 o 64.80725 9.969876 173.6588  136.8 -17.86179      19.93975 0.75 
1 1 1 -6  10 11 o 183.1135 4.322741 330.4959  37.8  14.96519       8.645482 0.97 
1 1 1 -6  10 12 o 54.10901 15.58735 222.9435  83.0  ?              ?        0.86 
1 1 1 -6  10 13 o 235.3707 5.066820 445.2911  113.0 0.9174652      10.13364 0.99 
1 1 1 -6  10 14 o 267.7906 4.538284 526.4603  84.3  2.028595       9.076568 0.99 
1 1 1 -6  10 15 o 157.1576 5.554013 308.2654  101.5 38.72044       11.10803 0.97 
1 1 1 -6  10 16 o 148.1104 5.848506 307.3573  354.1 5.547211       11.69701 0.97 
1 1 1 -6  10 17 o 62.74412 15.28727 163.3588  323.2 ?              ?        0.88 
1 1 1 -6  10 18 f 181.3581 5.270681 277.9799  282.9 -46.76613      10.54136 0.00 
1 1 1 -6  10 19 o 43.52586 11.03327 58.93082  0.3   -16.69534      22.06655 0.57 
1 1 1 -6  10 20 o 115.9526 4.949343 183.6499  55.4  -7.866119      9.898686 0.97 
1 1 1 -6  10 21 o 94.99515 4.002111 110.9767  186.4 10.49065       8.004222 0.95 
1 1 1 -6  10 22 o 94.46906 4.179570 172.7758  166.4 0.4122925      8.359140 0.96 
1 1 1 -6  10 23 o 152.0336 3.345180 259.0389  94.7  -28.61563      6.690360 0.98 
1 1 1 -6  10 24 o 122.2622 4.486194 154.4949  56.3  -18.90466      8.972388 0.96 
1 1 1 -6  10 25 o 91.26729 6.301022 161.9863  65.3  15.73009       12.60204 0.96 
1 1 1 -6  10 26 o 65.51186 8.623757 102.4593  87.5  6.620758       17.24751 0.92 
1 1 1 -6  10 27 o 84.97964 7.210093 131.0746  239.8 24.27771       14.42019 0.96 
1 1 1 -6  10 28 o 57.72887 9.959571 102.2204  186.0 9.425144       19.91914 0.93 
1 1 1 -6  10 29 o 23.61694 8.097124 10.32232  157.2 -5.497765      16.19425 0.16 
1 1 1 -6  10 30 o 50.53159 11.67088 96.97189  136.7 ?              ?        0.92 
1 1 1 -6  12 1  f 181.3081 3.123920 260.4282  276.4 3.435226       6.247840 0.00 
1 1 1 -6  12 2  o 310.7416 4.602933 527.7861  171.5 31.83725       9.205867 0.99 
1 1 1 -6  12 3  o 77.55621 4.343444 124.9664  5.5   -9.693855      8.686889 0.85 
1 1 1 -6  12 4  o 228.8241 3.092695 488.7865  58.2  9.624756       6.185391 0.99 
1 1 1 -6  12 5  o 27.13103 7.923752 10.91384  30.3  2.162090       15.84750 0.04 
1 1 1 -6  12 6  o 151.4983 2.886952 212.9410  86.0  0.2114716      5.773904 0.96 
1 1 1 -6  12 7  o 78.92412 4.206021 190.4021  6.7   45.30668       8.412043 0.91 
1 1 1 -6  12 8  o 96.52513 3.061434 174.4476  105.3 -19.91955      6.122869 0.92 
1 1 1 -6  12 9  o 55.38398 4.037377 108.6736  351.6 4.159523       8.074755 0.78 
1 1 1 -6  12 10 o 239.0247 5.115875 372.2079  164.6 -13.99463      10.23175 0.99 
1 1 1 -6  12 11 o 52.87497 11.74731 121.9249  13.7  ?              ?        0.82 
1 1 1 -6  12 12 o 125.3463 6.589658 194.3290  348.8 -11.07499      13.17932 0.96 
1 1 1 -6  12 13 o 67.02670 11.44449 123.0001  315.7 9.530006       22.88899 0.88 
1 1 1 -6  12 14 o 234.7668 5.442655 426.9968  68.5  -30.58842      10.88531 0.99 
1 1 1 -6  12 15 o 132.6475 7.489315 276.9135  14.1  -31.61548      14.97863 0.98 
1 1 1 -6  12 16 o 120.4207 8.781436 166.8882  243.8 -25.45808      17.56287 0.97 
1 1 1 -6  12 17 o 175.7207 5.940075 299.5164  163.8 -21.06662      11.88015 0.99 
1 1 1 -6  12 18 o 111.1908 8.596649 214.2086  94.2  3.546631       17.19330 0.97 
1 1 1 -6  12 19 o 81.07866 12.31564 103.0585  59.7  -18.17931      24.63129 0.89 
1 1 1 -6  12 20 o 51.08127 13.97976 142.2206  47.9  2.108185       27.95951 0.87 
1 1 1 -6  12 21 o 136.3506 8.393995 226.3296  342.4 -13.09792      16.78799 0.98 
1 1 1 -6  12 22 o 87.67927 12.83195 186.2276  310.6 -27.08852      25.66391 0.96 
1 1 1 -6  12 23 f 123.8009 9.411646 200.5918  61.6  ?              ?        0.00 
1 1 1 -6  12 24 o 49.72523 14.25726 95.62351  117.5 6.635578       28.51452 0.89 
1 1 1 -6  12 25 o 29.95314 14.11823 40.44213  255.3 ?              ?        0.53 
1 1 1 -6  12 26 o 42.32551 17.35522 112.7451  270.1 ?              ?        0.87 
1 1 1 -6  12 27 o 41.74092 13.22769 117.6853  299.6 5.003056       26.45538 0.91 
1 1 1 -6  12 28 x ?        ?        62.56502  146.2 ?              ?        0.00 
1 1 1 -6  14 1  o 133.9691 4.184252 258.5475  311.4 -12.57358      8.368504 0.98 
1 1 1 -6  14 2  o 155.5585 3.569333 258.9084  78.6  -16.79269      7.138665 0.98 
1 1 1 -6  14 3  o 169.6489 3.689975 296.6591  173.1 33.53722       7.379951 0.99 
1 1 1 -6  14 4  o 280.7959 3.598373 511.7670  156.5 0.9738159      7.196745 1.00 
1 1 1 -6  14 5  o 112.5855 4.441483 192.4657  213.0 -22.91080      8.882966 0.97 
1 1 1 -6  14 6  o 180.6192 3.198023 262.5293  218.2 -4.972321      6.396047 0.99 
1 1 1 -6  14 7  o 178.6813 3.056666 356.7614  228.8 21.77003       6.113332 0.99 
1 1 1 -6  14 8  o 168.1797 2.689162 243.8927  221.2 35.54535       5.378325 0.99 
1 1 1 -6  14 9  o 34.81027 6.086915 24.64577  160.8 -21.30390      12.17383 0.40 
1 1 1 -6  14 10 o 176.6487 4.929970 257.7386  45.3  -1.421494      9.859940 0.99 
1 1 1 -6  14 11 o 83.12997 11.75098 138.4570  281.9 5.825089       23.50197 0.94 
1 1 1 -6  14 12 o 126.7251 8.073077 212.5351  255.4 -10.89887      16.14615 0.97 
1 1 1 -6  14 13 o 60.54309 12.37698 53.69374  13.9  18.88510       24.75396 0.70 
1 1 1 -6  14 14 o 54.41206 21.16075 141.3813  138.9 ?              ?        0.85 
1 1 1 -6  14 15 o 59.52196 13.83498 68.77418  168.6 14.45503       27.66996 0.78 
1 1 1 -6  14 16 o 80.95549 11.94423 90.24311  1.2   -5.209053      23.88846 0.90 
1 1 1 -6  14 17 o 47.09509 13.54487 90.09181  132.5 11.67756       27.08974 0.83 
1 1 1 -6  14 18 o 145.6523 10.13699 235.2870  137.5 ?              ?        0.99 
1 1 1 -6  14 19 o 55.68586 14.79290 142.2993  197.1 -11.99269      29.58581 0.93 
1 1 1 -6  14 20 o 51.43686 15.22176 78.07485  286.8 7.166237       30.44353 0.87 
1 1 1 -6  14 21 o 125.7220 11.44008 200.3115  298.2 -11.35441      22.88015 0.98 
1 1 1 -6  14 22 f 52.22155 14.33292 108.4145  292.2 -6.700317      28.66585 0.00 
1 1 1 -6  14 23 f 39.45508 12.33213 106.8419  168.9 -11.95898      24.66426 0.00 
1 1 1 -6  14 24 o 55.83301 15.76783 109.2157  196.5 ?              ?        0.92 
1 1 1 -6  16 1  o 48.38829 10.37951 67.46741  267.1 -16.45919      20.75903 0.77 
1 1 1 -6  16 2  o 83.94405 6.791607 166.9110  216.8 3.744850       13.58321 0.96 
1 1 1 -6  16 3  o 37.05661 10.35560 60.79511  343.4 15.44647       20.71120 0.66 
1 1 1 -6  16 4  o 33.65514 9.582363 34.75783  144.2 -3.207409      19.16473 0.44 
1 1 1 -6  16 5  o 26.07143 8.267350 98.07609  291.3 -2.388136      16.53470 0.74 
1 1 1 -6  16 6  o 202.5039 3.612686 342.8503  342.6 -22.87946      7.225372 0.99 
1 1 1 -6  16 7  o 79.75348 6.125316 86.35275  359.4 -4.048729      12.25063 0.93 
1 1 1 -6  16 8  f 150.0515 3.346980 207.4647  194.0 -2.986710      6.693960 0.00 
1 1 1 -6  16 9  o 173.3896 3.067530 324.3481  227.6 1.962677       6.135059 0.99 
1 1 1 -6  16 10 o 62.54072 5.627133 165.9261  223.8 16.24850       11.25427 0.96 
1 1 1 -6  16 11 o 67.84131 11.88391 50.08891  300.6 -50.76533      23.76782 0.85 
1 1 1 -6  16 12 o 62.70155 15.80695 56.71747  22.1  1.813427       31.61390 0.83 
1 1 1 -6  16 13 o 39.39287 12.70734 67.49665  275.5 14.06538       25.41469 0.82 
1 1 1 -6  16 14 f 38.46644 12.44071 109.8978  214.8 -2.269196      24.88142 0.00 
1 1 1 -6  16 15 f 79.07687 14.40212 84.46444  238.0 -26.03479      28.80424 0.00 
1 1 1 -6  16 16 o 57.37490 14.62537 88.50300  229.4 -19.69925      29.25075 0.90 
1 1 1 -6  16 17 o 49.59017 15.04000 166.2615  110.3 19.93388       30.08000 0.94 
1 1 1 -6  16 18 o 38.47031 11.56251 97.08540  64.7  ?              ?        0.90 
1 1 1 -6  16 19 f 42.68568 13.93224 74.44558  201.5 ?              ?        0.00 
1 1 1 -6  18 1  o 41.03577 11.10302 53.31199  130.4 2.390392       22.20603 0.81 
1 1 1 -6  18 2  o 55.22659 10.72155 123.0283  109.5 -4.597523      21.44309 0.95 
1 1 1 -6  18 3  f 37.15030 9.751360 39.96463  172.4 -14.15658      19.50272 0.00 
1 1 1 -6  18 4  o 29.93838 9.435431 31.60458  244.4 0.2482109      18.87086 0.59 
1 1 1 -6  18 5  o 36.42740 10.13222 66.84093  11.5  -0.5797997     20.26443 0.85 
1 1 1 -6  18 6  o 36.80437 10.00221 86.76242  347.7 -2.862751      20.00443 0.89 
1 1 1 -6  18 7  o 31.87630 9.557356 48.96504  174.1 6.537693       19.11471 0.76 
1 1 1 -6  18 8  o 49.68069 9.056867 133.8034  230.3 ?              ?        0.95 
1 1 1 -6  18 9  o 56.63073 8.242097 92.38078  289.4 ?              ?        0.95 
1 1 1 -6  18 10 o 34.71382 8.930883 47.05786  282.2 ?              ?        0.81 
1 1 1 -5  1  1  o 422.1720 4.306973 3482.839  116.1 172.5554       8.613946 0.98 
1 1 1 -5  1  2  o 899.7177 11.02267 3771.246  193.0 ?              ?        0.99 
1 1 1 -5  1  3  o 253.2935 3.015683 1190.753  18.2  109.2647       6.031366 0.98 
1 1 1 -5  1  4  o 803.6740 9.894088 1881.348  172.4 ?              ?        0.98 
1 1 1 -5  1  5  o 555.9453 7.455418 1013.102  162.0 ?              ?        0.98 
1 1 1 -5  1  6  o 104.8455 2.629843 905.0879  28.1  ?              ?        0.77 
1 1 1 -5  1  7  o 126.6643 2.949262 372.3017  285.6 ?              ?        0.77 
1 1 1 -5  1  8  o 476.2910 4.654725 188.2617  339.1 3.390808       9.309450 0.98 
1 1 1 -5  1  9  o 426.4407 4.254264 1174.664  142.3 -14.97021      8.508528 0.99 
1 1 1 -5  1  10 o 442.9349 4.514207 1181.401  162.7 -58.38724      9.028415 0.98 
1 1 1 -5  1  11 o 448.1096 4.470401 346.1559  244.4 -11.81259      8.940803 0.97 
1 1 1 -5  1  12 o 410.4131 4.237116 256.3064  169.6 49.79303       8.474232 0.95 
1 1 1 -5  1  13 o 419.9619 4.259891 479.2011  128.9 -16.72714      8.519781 0.97 
1 1 1 -5  1  14 o 74.36965 3.293302 114.7421  67.2  -19.73010      6.586603 0.30 
1 1 1 -5  1  15 o 536.9250 5.169251 894.4188  338.5 33.38275       10.33850 0.98 
1 1 1 -5  1  16 o 407.3975 5.023212 560.4862  241.2 -17.65567      10.04642 0.97 
1 1 1 -5  1  17 o 331.3883 3.564454 480.6925  127.0 39.85645       7.128909 0.95 
1 1 1 -5  1  18 o 328.9151 3.557221 569.6979  248.1 -18.05502      7.114441 0.95 
1 1 1 -5  1  19 o 268.6711 3.583893 391.7373  34.0  -15.31119      7.167787 0.94 
1 1 1 -5  1  20 o 339.0768 3.619591 491.0860  81.9  49.62473       7.239182 0.97 
1 1 1 -5  1  21 o 264.7526 3.219623 410.4410  44.2  -1.055450      6.439245 0.97 
1 1 1 -5  1  22 o 141.2502 3.248477 203.1024  62.4  14.22369       6.496953 0.92 
1 1 1 -5  1  23 o 176.6270 3.194036 277.3420  78.5  30.46086       6.388072 0.96 
1 1 1 -5  1  24 o 269.6435 3.397694 288.6938  54.3  57.45067       6.795389 0.98 
1 1 1 -5  1  25 o 229.7169 3.409648 291.2068  108.9 -4.153427      6.819297 0.98 
1 1 1 -5  1  26 o 339.1550 4.879792 441.4043  5.0   28.63565       9.759583 0.99 
1 1 1 -5  1  27 o 236.9719 3.822447 257.5566  346.8 -43.80356      7.644894 0.98 
1 1 1 -5  1  28 o 29.96232 9.297461 30.80083  193.0 -4.086185      18.59492 0.29 
1 1 1 -5  1  29 o 48.84631 11.13648 101.0761  142.5 5.531311       22.27296 0.81 
1 1 1 -5  1  30 o 91.91431 7.381803 107.9226  5.3   -13.15319      14.76361 0.90 
1 1 1 -5  1  31 o 47.05476 12.56213 78.72298  205.1 5.577885       25.12427 0.72 
1 1 1 -5  1  32 o 122.7409 6.333053 160.6316  229.5 10.64395       12.66611 0.97 
1 1 1 -5  1  33 o 156.1868 5.796349 189.0630  186.9 11.45926       11.59270 0.99 
1 1 1 -5  1  34 o 73.45735 11.47700 79.99597  36.7  20.77048       22.95400 0.92 
1 1 1 -5  1  35 o 45.40575 12.80348 34.77206  127.5 1.395378       25.60696 0.64 
1 1 1 -5  1  36 x ?        ?        57.31528  164.9 ?              ?        0.00 
1 1 1 -5  3  1  o 645.7592 5.765302 827.7670  225.7 131.1484       11.53060 0.99 
1 1 1 -5  3  2  o 430.8136 3.684442 1103.477  268.1 -54.40021      7.368884 0.98 
1 1 1 -5  3  3  f 572.1324 4.670310 936.5253  272.4 -66.28461      9.340620 0.00 
1 1 1 -5  3  4  f 739.4750 6.279464 1204.080  305.0 37.13513       12.55893 0.00 
1 1 1 -5  3  5  o 218.3490 2.331292 69.25361  116.9 -52.65645      4.662583 0.93 
1 1 1 -5  3  6  o 211.1606 3.243366 386.8714  315.5 ?              ?        0.92 
1 1 1 -5  3  7  f 63.52631 1.583938 646.5696  235.8 2.799217       3.167876 0.00 
1 1 1 -5  3  8  o 470.6007 4.290561 684.6622  299.4 -5.224457      8.581122 0.98 
1 1 1 -5  3  9  o 126.4756 1.989588 428.6462  94.9  0.3496780      3.979176 0.86 
1 1 1 -5  3  10 o 146.9150 2.053760 438.1476  188.9 9.559937       4.107521 0.82 
1 1 1 -5  3  11 o 291.1528 2.946746 335.8339  118.1 20.62848       5.893493 0.95 
1 1 1 -5  3  12 o 119.9686 2.198500 503.7564  186.7 -15.19347      4.396999 0.71 
1 1 1 -5  3  13 o 309.5200 3.221168 430.8381  221.8 69.06613       6.442336 0.95 
1 1 1 -5  3  14 o 757.6440 6.420722 927.0431  283.3 17.41638       12.84144 0.99 
1 1 1 -5  3  15 o 706.5879 6.054432 930.6814  148.8 -87.56439      12.10886 0.99 
1 1 1 -5  3  16 o 357.4501 3.519003 443.2858  103.6 4.103882       7.038006 0.96 
1 1 1 -5  3  17 f 239.2990 3.323761 302.6646  11.3  -92.89470      6.647523 0.00 
1 1 1 -5  3  18 o 614.4813 5.361197 805.6636  338.1 35.11591       10.72239 0.99 
1 1 1 -5  3  19 o 533.6792 4.813980 707.0542  140.3 -56.78525      9.627959 0.99 
1 1 1 -5  3  20 o 107.0046 3.674572 250.5436  139.2 -29.54378      7.349145 0.86 
1 1 1 -5  3  21 f 227.0626 4.377002 354.1742  152.6 -6.453796      8.754004 0.00 
1 1 1 -5  3  22 o 176.3058 2.942635 236.8365  112.6 -5.583389      5.885270 0.96 
1 1 1 -5  3  23 o 47.08821 7.435968 113.7596  153.3 -32.01350      14.87194 0.57 
1 1 1 -5  3  24 o 308.3845 3.690935 397.8022  177.3 -12.53967      7.381869 0.99 
1 1 1 -5  3  25 o 272.5843 3.650450 345.4826  129.4 -36.97014      7.300900 0.99 
1 1 1 -5  3  26 o 242.5868 3.715614 265.1129  117.2 -33.34496      7.431227 0.98 
1 1 1 -5  3  27 o 59.28453 8.460965 80.24193  247.0 36.98142       16.92193 0.79 
1 1 1 -5  3  28 o 127.1628 4.944868 146.1205  255.2 -5.132896      9.889735 0.97 
1 1 1 -5  3  29 o 60.90998 10.14791 105.4980  302.3 20.36019       20.29583 0.84 
1 1 1 -5  3  30 o 157.9782 4.653437 218.3140  245.0 17.51651       9.306873 0.98 
1 1 1 -5  3  31 f 176.6460 4.829858 156.7337  94.2  -16.28485      9.659717 0.00 
1 1 1 -5  3  32 o 59.08491 12.16625 72.27311  45.7  -24.32886      24.33251 0.85 
1 1 1 -5  3  33 o 145.7704 6.157871 170.2527  53.7  -21.27849      12.31574 0.98 
1 1 1 -5  3  34 o 60.03239 12.66371 70.47124  2.6   19.62426       25.32743 0.88 
1 1 1 -5  3  35 o 35.79640 11.50691 41.20606  169.7 ?              ?        0.66 
1 1 1 -5  5  1  o 297.9732 3.235613 386.7096  245.7 57.51068       6.471226 0.96 
1 1 1 -5  5  2  o 443.6918 4.244799 659.3309  128.8 14.97061       8.489597 0.98 
1 1 1 -5  5  3  o 244.8512 3.668913 297.6413  276.0 ?              ?        0.90 
1 1 1 -5  5  4  o 457.0230 3.866426 834.8477  345.7 93.89047       7.732852 0.98 
1 1 1 -5  5  5  o 295.1626 2.864079 557.7866  269.8 21.42691       5.728158 0.89 
1 1 1 -5  5  6  o 207.3198 3.052898 327.7624  144.1 61.60667       6.105795 0.84 
1 1 1 -5  5  7  o 240.9570 3.864416 681.3929  264.2 61.17729       7.728831 0.93 
1 1 1 -5  5  8  o 48.06713 3.749374 216.4549  72.1  -0.7133865     7.498748 0.16 
1 1 1 -5  5  9  o 40.58015 2.739588 109.8428  62.0  11.61422       5.479177 0.21 
1 1 1 -5  5  10 o 555.7151 4.725551 912.4725  274.4 93.22974       9.451101 0.99 
1 1 1 -5  5  11 o 503.6282 5.125906 664.7711  196.9 7.821533       10.25181 0.98 
1 1 1 -5  5  12 o 216.1876 2.328560 375.5359  295.4 3.616455       4.657120 0.93 
1 1 1 -5  5  13 o 435.1444 3.945833 389.9596  314.9 -10.56165      7.891666 0.96 
1 1 1 -5  5  14 o 265.6993 3.450884 375.4487  293.7 75.33255       6.901768 0.92 
1 1 1 -5  5  15 o 776.5418 6.411059 879.4647  210.2 -57.96326      12.82212 0.99 
1 1 1 -5  5  16 o 904.7463 7.402613 1271.546  185.5 -26.09430      14.80523 0.99 
1 1 1 -5  5  17 f 494.9778 4.549542 609.0908  277.9 15.96204       9.099085 0.00 
1 1 1 -5  5  18 o 380.4012 3.709014 490.7518  332.6 -29.28979      7.418029 0.98 
1 1 1 -5  5  19 o 43.41726 7.435266 64.56250  176.0 -7.766228      14.87053 0.19 
1 1 1 -5  5  20 o 296.7007 3.522379 354.4829  45.8  39.76086       7.044757 0.98 
1 1 1 -5  5  21 o 188.6394 3.165560 228.3799  113.4 14.77821       6.331120 0.96 
1 1 1 -5  5  22 o 135.7375 3.312986 185.3194  60.0  9.671005       6.625972 0.93 
1 1 1 -5  5  23 o 99.37658 4.824773 242.2480  330.5 -24.26892      9.649547 0.94 
1 1 1 -5  5  24 o 119.7180 4.124342 69.00123  113.7 20.09505       8.248684 0.86 
1 1 1 -5  5  25 o 48.34708 9.677588 134.7749  68.1  -4.020668      19.35518 0.83 
1 1 1 -5  5  26 o 38.59575 9.599543 63.48399  257.7 16.84222       19.19909 0.59 
1 1 1 -5  5  27 o 114.2504 5.602223 210.5839  65.7  5.313263       11.20445 0.97 
1 1 1 -5  5  28 o 73.84196 8.987250 184.0191  103.5 40.89419       17.97450 0.93 
1 1 1 -5  5  29 o 57.90119 9.759515 107.4907  60.6  17.76836       19.51903 0.85 
1 1 1 -5  5  30 o 75.57268 9.421370 106.2978  353.9 18.82059       18.84274 0.91 
1 1 1 -5  5  31 o 117.6458 7.052210 174.2843  85.6  34.79891       14.10442 0.97 
1 1 1 -5  5  32 o 69.29639 11.19625 119.0296  298.8 7.165009       22.39251 0.94 
1 1 1 -5  5  33 o 110.7291 7.364563 134.2765  289.1 13.34393       14.72913 0.97 
1 1 1 -5  5  34 o 54.48233 13.31316 109.1042  8.9   -3.179115      26.62632 0.92 
1 1 1 -5  7  1  o 396.6199 3.920634 701.4911  7.3   -47.07443      7.841268 0.97 
1 1 1 -5  7  2  o 564.2668 7.455810 960.5864  202.7 ?              ?        0.99 
1 1 1 -5  7  3  o 554.2062 4.909282 875.1323  114.5 10.66687       9.818563 0.98 
1 1 1 -5  7  4  o 578.9172 5.128343 1075.308  347.9 10.69037       10.25669 0.99 
1 1 1 -5  7  5  o 343.6559 4.632841 645.0513  101.8 ?              ?        0.97 
1 1 1 -5  7  6  o 515.9184 5.612521 615.8103  144.1 -14.59207      11.22504 0.98 
1 1 1 -5  7  7  o 220.1556 3.060174 302.0806  94.4  -23.13298      6.120347 0.89 
1 1 1 -5  7  8  o 480.6116 6.863408 664.4297  108.3 42.72238       13.72682 0.98 
1 1 1 -5  7  9  o 434.2825 5.637167 628.1689  153.8 34.44461       11.27433 0.98 
1 1 1 -5  7  10 o 397.3757 5.172167 726.5156  256.3 -54.57895      10.34433 0.98 
1 1 1 -5  7  11 o 413.5525 5.715605 592.5694  166.5 -32.55136      11.43121 0.98 
1 1 1 -5  7  12 o 503.4901 6.355097 699.5778  227.6 31.32599       12.71019 0.98 
1 1 1 -5  7  13 o 105.8466 3.193191 111.5680  249.7 ?              ?        0.35 
1 1 1 -5  7  14 o 344.2571 3.225603 590.9608  285.4 -23.54977      6.451207 0.97 
1 1 1 -5  7  15 o 183.5732 2.429260 284.7863  284.2 -29.29349      4.858519 0.92 
1 1 1 -5  7  16 o 531.0159 4.646927 775.0813  317.1 39.21594       9.293855 0.99 
1 1 1 -5  7  17 o 152.4535 2.540809 298.6594  13.3  -0.4476013     5.081619 0.94 
1 1 1 -5  7  18 o 164.2988 2.835290 260.0244  205.2 14.55051       5.670580 0.96 
1 1 1 -5  7  19 o 183.2489 2.886623 306.2375  57.1  -7.507690      5.773247 0.97 
1 1 1 -5  7  20 o 154.9979 3.119169 276.8840  289.0 -53.34125      6.238338 0.96 
1 1 1 -5  7  21 o 100.3789 4.179290 224.4610  165.1 13.12585       8.358581 0.94 
1 1 1 -5  7  22 o 98.94145 5.014304 207.7588  114.0 -36.04478      10.02861 0.95 
1 1 1 -5  7  23 o 119.8289 4.352242 171.0106  299.7 11.16122       8.704484 0.95 
1 1 1 -5  7  24 o 45.49448 9.213990 115.4398  228.7 11.79780       18.42798 0.82 
1 1 1 -5  7  25 o 63.83347 8.322282 114.2056  206.1 18.77317       16.64456 0.91 
1 1 1 -5  7  26 o 125.0759 4.725462 212.9935  301.9 5.786270       9.450924 0.97 
1 1 1 -5  7  27 o 89.29129 6.850157 73.27701  309.6 4.454140       13.70031 0.86 
1 1 1 -5  7  28 o 54.70913 10.74755 108.3659  216.6 20.85437       21.49511 0.85 
1 1 1 -5  7  29 o 65.54829 11.66010 122.2250  333.5 -27.97638      23.32021 0.92 
1 1 1 -5  7  30 o 93.38689 7.092514 130.0297  270.7 -9.525314      14.18503 0.96 
1 1 1 -5  7  31 o 47.38869 12.25182 74.93954  66.9  -20.12270      24.50364 0.86 
1 1 1 -5  7  32 o 129.2967 7.541439 163.8980  333.4 -6.698586      15.08288 0.98 
1 1 1 -5  7  33 o 38.44061 11.08595 64.40806  246.5 ?              ?        0.82 
1 1 1 -5  9  1  o 248.9609 3.842749 420.4525  39.5  50.37175       7.685498 0.94 
1 1 1 -5  9  2  o 296.3825 3.204232 484.0751  110.2 -3.027313      6.408463 0.96 
1 1 1 -5  9  3  o 136.8069 2.574764 182.0433  276.4 -6.239883      5.149528 0.70 
1 1 1 -5  9  4  o 163.5225 3.313374 198.9782  122.7 6.178284       6.626747 0.81 
1 1 1 -5  9  5  o 279.7510 3.022617 256.9053  63.4  15.69128       6.045234 0.94 
1 1 1 -5  9  6  o 265.6621 3.339742 565.0864  35.2  -0.9531860     6.679483 0.96 
1 1 1 -5  9  7  f 228.3851 2.341560 309.9887  295.0 4.840820       4.683121 0.00 
1 1 1 -5  9  8  o 53.34261 7.743532 86.58533  186.8 0.2199936E-01  15.48706 0.22 
1 1 1 -5  9  9  o 119.4140 5.187058 162.1544  6.4   4.079102       10.37412 0.74 
1 1 1 -5  9  10 o 533.7607 7.041441 805.5839  79.3  0.8750610      14.08288 0.99 
1 1 1 -5  9  11 o 288.6991 4.552121 509.0509  194.9 -24.76428      9.104241 0.98 
1 1 1 -5  9  12 o 205.6191 4.594855 294.3054  233.8 34.34068       9.189711 0.95 
1 1 1 -5  9  13 f 248.2713 4.643402 322.9653  63.1  -17.61665      9.286804 0.00 
1 1 1 -5  9  14 o 292.1940 4.817091 452.5114  34.9  -16.50366      9.634183 0.99 
1 1 1 -5  9  15 f 170.4864 4.674874 253.7117  186.4 -7.414902      9.349748 0.00 
1 1 1 -5  9  16 o 305.0001 5.174498 487.9507  137.4 -37.11679      10.34900 0.99 
1 1 1 -5  9  17 o 218.2108 4.723095 286.2304  142.9 11.59251       9.446191 0.98 
1 1 1 -5  9  18 o 310.1207 2.918959 519.9863  311.1 27.03952       5.837919 0.99 
1 1 1 -5  9  19 o 246.1535 2.733172 378.2621  282.7 3.259399       5.466344 0.99 
1 1 1 -5  9  20 o 133.8242 3.239572 194.8463  210.2 40.98503       6.479144 0.97 
1 1 1 -5  9  21 o 81.05251 4.483729 140.8621  272.1 -14.05111      8.967458 0.92 
1 1 1 -5  9  22 o 98.39403 4.757188 218.3032  264.2 27.86028       9.514376 0.97 
1 1 1 -5  9  23 o 84.43022 5.599597 177.6741  228.0 14.42363       11.19919 0.96 
1 1 1 -5  9  24 o 174.7894 4.108587 306.0475  232.3 33.27850       8.217175 0.99 
1 1 1 -5  9  25 o 93.18894 5.431538 107.1133  120.9 -4.248566      10.86308 0.92 
1 1 1 -5  9  26 o 81.22117 7.151702 157.3732  23.4  -8.496506      14.30340 0.94 
1 1 1 -5  9  27 o 66.75136 9.100423 149.8317  314.8 -3.231422      18.20085 0.94 
1 1 1 -5  9  28 o 148.3172 5.436804 196.7308  263.8 25.89177       10.87361 0.99 
1 1 1 -5  9  29 f 64.15231 10.57791 119.7999  327.3 0.2470779      21.15581 0.00 
1 1 1 -5  9  30 o 79.67075 15.62848 89.01233  16.2  ?              ?        0.92 
1 1 1 -5  9  31 o 45.87534 11.70559 102.8338  207.4 ?              ?        0.91 
1 1 1 -5  11 1  o 128.2340 3.129610 280.1129  301.6 31.10718       6.259220 0.93 
1 1 1 -5  11 2  f 283.0929 3.292346 476.5529  301.1 43.02301       6.584693 0.00 
1 1 1 -5  11 3  o 202.4331 3.828279 384.3094  336.9 -6.109116      7.656558 0.97 
1 1 1 -5  11 4  o 75.60139 3.859362 211.9628  335.7 11.48315       7.718723 0.85 
1 1 1 -5  11 5  o 183.0482 2.676422 294.5319  309.5 20.75580       5.352843 0.96 
1 1 1 -5  11 6  o 126.3598 2.611146 349.7543  315.6 29.66817       5.222292 0.96 
1 1 1 -5  11 7  o 128.3778 2.601427 229.8566  45.6  40.81338       5.202853 0.95 
1 1 1 -5  11 8  o 195.1629 2.360786 328.0962  130.5 -18.46118      4.721572 0.98 
1 1 1 -5  11 9  o 161.0606 3.870752 289.4200  277.4 -8.204346      7.741504 0.97 
1 1 1 -5  11 10 o 136.3252 5.147395 341.8304  230.3 -9.070435      10.29479 0.97 
1 1 1 -5  11 11 o 79.03642 9.137913 294.9016  310.8 -30.47322      18.27583 0.93 
1 1 1 -5  11 12 o 202.5773 5.107563 340.2285  341.6 -0.7713470     10.21513 0.98 
1 1 1 -5  11 13 o 150.6165 5.726970 269.5026  297.3 -38.36218      11.45394 0.97 
1 1 1 -5  11 14 o 355.5218 5.935213 586.9865  73.5  -7.805664      11.87043 1.00 
1 1 1 -5  11 15 o 233.6535 4.940677 449.3382  35.8  5.889755       9.881354 0.99 
1 1 1 -5  11 16 o 120.5709 8.485499 228.2222  73.3  2.914360       16.97100 0.97 
1 1 1 -5  11 17 o 52.50114 12.16612 86.34018  72.4  8.663818       24.33224 0.76 
1 1 1 -5  11 18 o 106.9032 8.926253 164.7381  221.4 -17.59025      17.85251 0.96 
1 1 1 -5  11 19 o 63.01038 12.74589 153.7519  27.2  24.43668       25.49177 0.93 
1 1 1 -5  11 20 o 214.8380 7.120911 333.0001  34.8  ?              ?        0.99 
1 1 1 -5  11 21 f 89.08478 11.05855 133.4315  302.2 -1.673851      22.11710 0.00 
1 1 1 -5  11 22 o 78.71560 14.43705 124.5720  198.3 ?              ?        0.91 
1 1 1 -5  11 23 o 181.5631 4.567841 292.9632  106.2 -14.61978      9.135681 0.99 
1 1 1 -5  11 24 o 195.8988 4.398906 313.8306  115.9 -7.168472      8.797812 0.99 
1 1 1 -5  11 25 o 41.19109 9.960478 59.49902  26.6  -23.75350      19.92096 0.77 
1 1 1 -5  11 26 o 91.00418 6.082776 164.6138  15.4  -39.12567      12.16555 0.98 
1 1 1 -5  11 27 o 146.7702 4.610567 224.8699  81.8  -16.67305      9.221133 0.99 
1 1 1 -5  11 28 o 128.8700 5.037329 215.9607  90.2  14.67679       10.07466 0.99 
1 1 1 -5  11 29 o 42.69563 10.22079 48.84489  3.1   ?              ?        0.81 
1 1 1 -5  13 1  o 340.8963 5.029812 584.7194  262.1 36.51724       10.05962 1.00 
1 1 1 -5  13 2  o 51.49323 7.238997 87.68070  260.2 36.13995       14.47799 0.74 
1 1 1 -5  13 3  o 219.8998 3.393636 359.8288  21.5  -35.49153      6.787271 0.99 
1 1 1 -5  13 4  o 223.5337 3.183462 503.9185  91.6  -40.17557      6.366924 0.99 
1 1 1 -5  13 5  o 71.85403 5.294182 142.3413  249.7 10.17128       10.58836 0.91 
1 1 1 -5  13 6  o 88.83384 4.151863 212.3527  194.4 38.47511       8.303726 0.95 
1 1 1 -5  13 7  o 81.55407 3.802705 131.5784  164.0 15.09984       7.605410 0.92 
1 1 1 -5  13 8  o 194.0323 2.896505 354.6071  117.9 -11.91017      5.793009 0.99 
1 1 1 -5  13 9  o 126.6333 2.667807 188.4576  348.0 -25.45998      5.335614 0.97 
1 1 1 -5  13 10 o 143.0036 9.018603 259.2811  353.0 ?              ?        0.98 
1 1 1 -5  13 11 o 61.03032 13.09846 184.8072  39.4  13.72481       26.19693 0.92 
1 1 1 -5  13 12 o 186.5746 5.582419 324.5394  157.3 28.02567       11.16484 0.99 
1 1 1 -5  13 13 o 118.2183 7.605398 269.4509  133.4 2.837074       15.21080 0.98 
1 1 1 -5  13 14 o 120.6947 8.882444 176.1731  96.5  -29.86115      17.76489 0.97 
1 1 1 -5  13 15 f 100.0435 10.52991 177.1198  321.9 -12.86282      21.05981 0.00 
1 1 1 -5  13 16 o 44.84725 13.16912 43.04533  159.3 14.22372       26.33825 0.50 
1 1 1 -5  13 17 o 47.72347 13.52621 39.72565  73.0  23.70259       27.05241 0.49 
1 1 1 -5  13 18 o 98.02658 11.35439 176.6624  47.1  17.03469       22.70878 0.96 
1 1 1 -5  13 19 o 44.00027 12.98164 103.9186  65.5  -10.33606      25.96328 0.83 
1 1 1 -5  13 20 o 45.56284 11.53820 121.2595  77.6  39.92820       23.07640 0.89 
1 1 1 -5  13 21 o 45.53356 14.33670 92.09544  11.3  25.52812       28.67340 0.85 
1 1 1 -5  13 22 o 87.48895 12.88172 108.3563  40.2  -38.03940      25.76344 0.95 
1 1 1 -5  13 23 o 35.99459 11.77407 49.30472  126.7 0.3563423      23.54815 0.72 
1 1 1 -5  13 24 o 34.23040 11.41029 38.37621  64.4  6.898401       22.82058 0.62 
1 1 1 -5  13 25 o 50.73986 14.93209 73.97376  212.3 1.022972       29.86418 0.86 
1 1 1 -5  13 26 o 46.59573 12.23147 8.310092  161.2 ?              ?        0.25 
1 1 1 -5  15 1  o 69.88953 8.779709 72.07946  282.8 -21.58099      17.55942 0.87 
1 1 1 -5  15 2  o 82.41364 6.829354 107.5317  161.6 7.903587       13.65871 0.93 
1 1 1 -5  15 3  o 143.9898 3.755714 291.6410  264.4 12.71640       7.511428 0.99 
1 1 1 -5  15 4  o 47.55533 9.221663 33.06164  156.1 8.666363       18.44333 0.52 
1 1 1 -5  15 5  o 171.5323 3.485420 318.6771  44.3  16.79172       6.970840 0.99 
1 1 1 -5  15 6  o 71.47662 6.336482 140.2699  92.2  16.90609       12.67296 0.93 
1 1 1 -5  15 7  o 31.62817 6.844528 74.50335  127.1 -23.27155      13.68906 0.64 
1 1 1 -5  15 8  o 71.90115 5.133405 140.5298  24.1  12.11869       10.26681 0.93 
1 1 1 -5  15 9  o 87.98061 3.943852 172.7098  242.5 10.71413       7.887704 0.96 
1 1 1 -5  15 10 o 53.78696 6.820250 79.98996  181.0 -15.47772      13.64050 0.84 
1 1 1 -5  15 11 o 186.3022 6.840671 344.6120  43.1  9.629395       13.68134 0.99 
1 1 1 -5  15 12 o 121.4061 9.978716 152.0070  9.8   -6.789345      19.95743 0.97 
1 1 1 -5  15 13 o 87.78750 13.10462 169.7998  280.6 2.569977       26.20923 0.96 
1 1 1 -5  15 14 o 40.91775 12.89011 74.17768  33.0  16.40456       25.78023 0.78 
1 1 1 -5  15 15 o 86.57539 12.81651 135.0855  187.2 30.25660       25.63303 0.95 
1 1 1 -5  15 16 o 110.8313 12.24620 129.5454  272.8 -2.454063      24.49241 0.97 
1 1 1 -5  15 17 o 42.19765 19.22110 63.39269  5.6   ?              ?        0.72 
1 1 1 -5  15 18 o 47.36866 13.59294 96.22141  145.4 23.27942       27.18588 0.89 
1 1 1 -5  15 19 o 59.11447 15.50589 121.3252  221.7 5.334763       31.01178 0.93 
1 1 1 -5  15 20 o 66.89005 16.16201 115.1477  248.3 -3.792320      32.32402 0.93 
1 1 1 -5  15 21 o 46.94776 14.40844 136.7424  325.6 ?              ?        0.93 
1 1 1 -5  15 22 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -5  17 1  o 54.23326 9.658090 156.6010  90.5  -23.14928      19.31618 0.95 
1 1 1 -5  17 2  o 31.83798 9.700708 107.7891  48.8  1.509382       19.40142 0.88 
1 1 1 -5  17 3  o 115.5811 5.567705 183.5399  278.6 -19.24310      11.13541 0.98 
1 1 1 -5  17 4  o 91.83279 8.179865 177.0750  190.0 -16.94337      16.35973 0.98 
1 1 1 -5  17 5  o 97.33250 5.999114 228.3770  137.1 -17.81373      11.99823 0.99 
1 1 1 -5  17 6  o 59.66753 8.734324 97.32528  19.1  -4.985661      17.46865 0.94 
1 1 1 -5  17 7  o 127.5659 4.623485 238.8929  352.1 -7.988831      9.246969 0.99 
1 1 1 -5  17 8  o 71.90407 8.162979 99.98816  293.0 -39.75813      16.32596 0.95 
1 1 1 -5  17 9  o 29.82241 8.456672 34.05326  273.8 8.338514       16.91334 0.61 
1 1 1 -5  17 10 o 31.88317 8.440827 50.90907  8.1   18.10013       16.88165 0.77 
1 1 1 -5  17 11 o 68.67382 14.73684 133.4413  314.2 -9.121780      29.47369 0.95 
1 1 1 -5  17 12 o 86.16895 13.60646 123.6500  327.6 -17.30108      27.21292 0.96 
1 1 1 -5  17 13 o 47.86697 14.64358 103.2445  336.0 4.730675       29.28716 0.90 
1 1 1 -5  17 14 o 44.09107 14.02639 73.07322  341.0 ?              ?        0.85 
1 1 1 -5  17 15 o 61.59465 16.09797 148.3080  316.7 ?              ?        0.94 
1 1 1 -4  0  1  o 202.5135 4.925529 832.3120  0.0   -0.000000      0.000000 0.45 
1 1 1 -4  0  2  o 443.5791 8.870675 509.4945  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  3  x ?        ?        1353.996  0.0   ?              ?        0.00 
1 1 1 -4  0  4  x ?        ?        1566.727  0.0   ?              ?        0.00 
1 1 1 -4  0  5  o 690.6847 9.146762 333.6837  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  6  o 796.5696 10.17587 1778.064  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  7  o 507.8197 7.184345 220.4919  180.0 -0.000000      0.000000 1.00 
1 1 1 -4  0  8  f 150.1942 3.260493 366.8429  0.0   -0.000000      0.000000 0.00 
1 1 1 -4  0  9  o 100.1023 3.116515 344.6360  0.0   -0.000000      0.000000 0.25 
1 1 1 -4  0  10 o 110.4844 3.145283 5.265719  180.0 -0.000000      0.000000 0.42 
1 1 1 -4  0  11 o 119.6005 3.202900 677.3644  0.0   -0.000000      0.000000 0.66 
1 1 1 -4  0  12 o 365.9571 5.617318 318.5138  180.0 -0.000000      0.000000 1.00 
1 1 1 -4  0  13 o 119.4813 3.730099 326.6273  180.0 -0.000000      0.000000 0.11 
1 1 1 -4  0  14 o 610.0919 8.123640 801.6682  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  15 f 1681.682 28.16046 2274.492  0.0   -0.000000      0.000000 0.00 
1 1 1 -4  0  16 o 54.88238 6.300258 20.07119  180.0 -0.000000      0.000000 0.10 
1 1 1 -4  0  17 o 1135.240 13.36257 1435.105  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  18 o 99.39474 5.676315 20.56815  180.0 -0.000000      0.000000 0.42 
1 1 1 -4  0  19 o 523.2908 6.614244 745.5988  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  20 o 392.9901 7.429454 427.6886  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  21 f 95.10407 5.939722 80.76678  0.0   -0.000000      0.000000 0.00 
1 1 1 -4  0  22 o 71.91907 8.616406 143.5527  0.0   -0.000000      0.000000 0.88 
1 1 1 -4  0  23 f 102.0880 6.412236 211.1403  0.0   -0.000000      0.000000 0.00 
1 1 1 -4  0  24 o 76.36099 8.081182 174.6935  180.0 -0.000000      0.000000 0.96 
1 1 1 -4  0  25 f 41.33023 21.53397 28.36219  180.0 -0.000000      0.000000 0.00 
1 1 1 -4  0  26 o 37.54827 17.23085 78.31058  0.0   -0.000000      0.000000 0.57 
1 1 1 -4  0  27 o 53.03976 17.14010 152.5453  180.0 -0.000000      0.000000 0.96 
1 1 1 -4  0  28 o 21.61544 14.30631 24.42565  180.0 -0.000000      0.000000 0.17 
1 1 1 -4  0  29 o 146.2899 6.410513 179.2444  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  30 o 215.6595 7.110750 204.2556  0.0   -0.000000      0.000000 1.00 
1 1 1 -4  0  31 o 88.17471 12.58824 163.0399  180.0 -0.000000      0.000000 1.00 
1 1 1 -4  0  32 o 24.04065 16.14500 27.42242  0.0   -0.000000      0.000000 0.26 
1 1 1 -4  0  33 o 30.87346 19.47509 72.24287  180.0 -0.000000      0.000000 0.78 
1 1 1 -4  0  34 o 18.68439 13.47680 15.13706  0.0   -0.000000      0.000000 0.16 
1 1 1 -4  0  35 o 47.05767 22.60023 40.01304  0.0   -0.000000      0.000000 0.71 
1 1 1 -4  0  36 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -4  2  1  o 457.9594 4.319713 1157.214  51.4  -52.41364      8.639426 0.98 
1 1 1 -4  2  2  o 150.4773 2.423433 570.2224  204.7 ?              ?        0.90 
1 1 1 -4  2  3  o 364.8878 3.550147 876.3312  233.0 20.46747       7.100293 0.95 
1 1 1 -4  2  4  o 295.2562 2.976178 455.7548  265.0 131.3799       5.952356 0.94 
1 1 1 -4  2  5  o 214.2170 3.363173 351.5582  231.5 ?              ?        0.95 
1 1 1 -4  2  6  o 502.5130 4.579950 572.9103  200.0 -19.48273      9.159900 0.98 
1 1 1 -4  2  7  o 659.2333 8.284140 957.4839  45.9  ?              ?        0.99 
1 1 1 -4  2  8  o 557.1666 5.099686 743.6967  29.2  -123.4239      10.19937 0.99 
1 1 1 -4  2  9  o 240.8001 2.812869 422.1256  151.9 61.36598       5.625738 0.87 
1 1 1 -4  2  10 o 121.4090 2.039667 181.9336  347.9 24.01824       4.079333 0.66 
1 1 1 -4  2  11 o 428.8514 4.176226 753.0096  294.8 62.92978       8.352451 0.97 
1 1 1 -4  2  12 o 226.2934 3.891181 530.7560  38.6  ?              ?        0.94 
1 1 1 -4  2  13 o 548.1364 4.976747 678.1900  45.4  38.28717       9.953494 0.98 
1 1 1 -4  2  14 o 686.1884 6.159631 1113.758  327.9 -4.763794      12.31926 0.99 
1 1 1 -4  2  15 o 62.10985 3.686649 120.7150  104.8 -10.44633      7.373299 0.25 
1 1 1 -4  2  16 o 136.4741 2.705693 267.1841  168.7 18.24640       5.411386 0.75 
1 1 1 -4  2  17 o 174.1346 2.655936 394.4000  16.0  -23.69376      5.311873 0.88 
1 1 1 -4  2  18 o 189.9451 2.634429 343.4719  293.3 -38.66449      5.268857 0.89 
1 1 1 -4  2  19 o 598.1517 5.335948 825.1309  106.0 11.28937       10.67190 0.99 
1 1 1 -4  2  20 o 267.4574 3.828961 440.7090  108.1 2.848175       7.657922 0.97 
1 1 1 -4  2  21 o 187.5446 2.951072 260.0031  64.8  5.714478       5.902143 0.94 
1 1 1 -4  2  22 o 154.2328 3.106174 168.3736  157.9 -39.71446      6.212348 0.92 
1 1 1 -4  2  23 o 129.6916 3.855594 183.6301  267.7 3.011810       7.711189 0.93 
1 1 1 -4  2  24 o 355.7332 3.766600 465.3291  291.4 -4.250366      7.533200 0.99 
1 1 1 -4  2  25 o 205.4397 3.477356 285.2299  251.6 -1.781799      6.954712 0.98 
1 1 1 -4  2  26 o 318.7085 3.719320 381.7657  336.0 10.93048       7.438640 0.99 
1 1 1 -4  2  27 f 224.1096 4.007807 247.0541  260.8 47.39980       8.015615 0.00 
1 1 1 -4  2  28 o 145.8240 4.564145 227.7126  286.5 5.549759       9.128289 0.98 
1 1 1 -4  2  29 o 247.5379 4.437449 342.7138  329.6 -16.85597      8.874897 0.99 
1 1 1 -4  2  30 o 123.9566 8.775414 196.6583  327.8 29.57887       17.55083 0.96 
1 1 1 -4  2  31 o 97.26696 7.785262 166.5812  255.1 23.61002       15.57052 0.95 
1 1 1 -4  2  32 o 161.3258 5.728394 232.9606  257.8 -12.23283      11.45679 0.99 
1 1 1 -4  2  33 o 183.8467 7.555251 182.7200  105.2 -15.40466      15.11050 0.99 
1 1 1 -4  2  34 o 65.09040 12.51753 66.11622  332.5 -21.17376      25.03506 0.88 
1 1 1 -4  2  35 o 74.12388 10.86297 106.2706  86.7  -57.28468      21.72594 0.95 
1 1 1 -4  4  1  o 466.0630 4.444704 129.7582  352.0 92.84894       8.889407 0.98 
1 1 1 -4  4  2  o 981.3364 8.259398 1479.258  90.5  67.80383       16.51880 1.00 
1 1 1 -4  4  3  o 302.6451 3.992203 179.7800  315.2 18.30762       7.984406 0.94 
1 1 1 -4  4  4  f 687.9893 5.833838 991.4388  245.7 -45.94293      11.66768 0.00 
1 1 1 -4  4  5  o 457.9700 6.035617 978.4490  3.6   46.89426       12.07123 0.97 
1 1 1 -4  4  6  o 309.8871 3.775753 633.6163  46.6  19.99164       7.551505 0.97 
1 1 1 -4  4  7  o 246.8462 2.459289 211.8732  269.9 0.9307098      4.918579 0.93 
1 1 1 -4  4  8  o 370.6516 3.342298 454.6708  258.8 12.28848       6.684596 0.97 
1 1 1 -4  4  9  o 105.5381 1.668290 246.1707  335.0 4.128098       3.336580 0.27 
1 1 1 -4  4  10 o 449.0945 4.131285 1171.854  170.4 -5.163055      8.262569 0.98 
1 1 1 -4  4  11 o 405.1801 3.721520 868.0931  294.9 43.02664       7.443039 0.97 
1 1 1 -4  4  12 o 318.9801 3.213994 519.0651  65.7  9.916626       6.427988 0.95 
1 1 1 -4  4  13 o 743.7106 6.231750 1393.978  47.6  -25.56555      12.46350 0.99 
1 1 1 -4  4  14 o 689.3350 5.803254 980.3754  34.0  -2.007263      11.60651 0.99 
1 1 1 -4  4  15 o 462.3095 4.955164 606.5679  188.1 -47.23602      9.910329 0.98 
1 1 1 -4  4  16 o 418.0220 3.849762 649.5673  183.1 26.24438       7.699523 0.98 
1 1 1 -4  4  17 o 380.2648 3.759499 494.7408  359.1 -33.42371      7.518998 0.96 
1 1 1 -4  4  18 o 249.6964 3.836049 326.6545  283.6 -44.02019      7.672099 0.93 
1 1 1 -4  4  19 o 279.9312 3.067379 586.5452  193.7 59.49065       6.134759 0.98 
1 1 1 -4  4  20 o 289.1971 3.246146 319.8260  326.9 36.93167       6.492291 0.97 
1 1 1 -4  4  21 o 237.1117 3.156351 415.6909  104.6 -3.587753      6.312702 0.98 
1 1 1 -4  4  22 o 64.70971 9.099607 139.4962  275.6 -32.91697      18.19921 0.75 
1 1 1 -4  4  23 o 83.82382 5.866705 137.8288  38.8  -46.13866      11.73341 0.85 
1 1 1 -4  4  24 o 160.2108 3.685928 246.4506  58.0  -25.37657      7.371855 0.97 
1 1 1 -4  4  25 o 114.6818 4.622443 158.7842  98.1  4.267845       9.244886 0.94 
1 1 1 -4  4  26 f 49.56186 9.823053 93.26321  134.2 1.745373       19.64611 0.00 
1 1 1 -4  4  27 o 149.4619 4.431767 198.8326  101.3 -27.37445      8.863534 0.98 
1 1 1 -4  4  28 o 105.8746 6.026374 130.2347  196.0 11.51469       12.05275 0.94 
1 1 1 -4  4  29 o 74.14006 9.194525 49.03446  48.5  -20.10329      18.38905 0.70 
1 1 1 -4  4  30 o 97.01970 7.455609 129.1157  346.5 1.558502       14.91122 0.94 
1 1 1 -4  4  31 o 89.74976 8.915460 110.2600  25.9  -22.44722      17.83092 0.94 
1 1 1 -4  4  32 o 111.4878 7.557130 145.8680  254.4 -0.3213577     15.11426 0.97 
1 1 1 -4  4  33 o 71.96652 11.13516 90.32616  18.5  -6.990715      22.27031 0.93 
1 1 1 -4  4  34 o 153.3710 6.397679 201.5913  345.0 -5.301849      12.79536 0.99 
1 1 1 -4  4  35 o 40.69176 12.24813 59.34182  89.0  ?              ?        0.81 
1 1 1 -4  6  1  o 393.3079 3.793006 955.6917  105.2 -18.61166      7.586012 0.97 
1 1 1 -4  6  2  o 193.2617 2.458499 449.7313  83.6  -79.99495      4.916998 0.92 
1 1 1 -4  6  3  o 49.66367 2.756382 373.3915  314.6 18.44437       5.512764 0.37 
1 1 1 -4  6  4  o 299.2438 2.983706 619.3239  79.6  16.41318       5.967412 0.94 
1 1 1 -4  6  5  o 186.5484 2.956625 597.1652  318.2 -24.11375      5.913250 0.88 
1 1 1 -4  6  6  o 565.3914 6.155696 1200.878  259.3 94.18616       12.31139 0.99 
1 1 1 -4  6  7  o 803.7062 9.697392 1506.485  33.8  -39.95892      19.39478 0.99 
1 1 1 -4  6  8  o 418.8040 5.720098 800.9411  197.0 23.78391       11.44020 0.97 
1 1 1 -4  6  9  o 444.2249 5.827628 775.3539  188.7 -15.87253      11.65526 0.98 
1 1 1 -4  6  10 o 159.7079 3.973041 281.2498  53.6  15.46349       7.946083 0.86 
1 1 1 -4  6  11 f 358.2315 4.543656 541.3843  60.2  ?              ?        0.00 
1 1 1 -4  6  12 o 223.2500 2.519812 231.7672  142.0 -16.84550      5.039623 0.84 
1 1 1 -4  6  13 o 392.5530 3.579821 460.1128  138.0 -19.21848      7.159642 0.97 
1 1 1 -4  6  14 o 581.4865 5.044007 921.7404  305.5 30.47089       10.08801 0.99 
1 1 1 -4  6  15 o 80.74687 3.728012 215.9738  345.3 25.56798       7.456023 0.57 
1 1 1 -4  6  16 o 407.2916 3.848381 719.8456  281.7 19.69785       7.696762 0.98 
1 1 1 -4  6  17 o 206.9536 2.734720 230.5689  28.5  -7.591721      5.469440 0.92 
1 1 1 -4  6  18 o 147.4448 3.169779 180.3457  209.9 47.33205       6.339558 0.87 
1 1 1 -4  6  19 o 109.3216 3.561591 345.1169  120.9 -21.01955      7.123183 0.95 
1 1 1 -4  6  20 o 154.9863 3.087381 266.8016  279.8 5.689682       6.174762 0.96 
1 1 1 -4  6  21 o 121.5714 3.672150 212.4828  270.0 -38.45626      7.344300 0.94 
1 1 1 -4  6  22 o 101.3206 4.008028 206.3805  27.1  19.41070       8.016056 0.93 
1 1 1 -4  6  23 o 156.9342 3.498935 235.7789  278.1 -25.89366      6.997869 0.97 
1 1 1 -4  6  24 o 73.32646 6.430477 205.7198  225.4 6.442764       12.86095 0.93 
1 1 1 -4  6  25 o 135.7208 6.220365 159.4720  284.9 -12.45676      12.44073 0.96 
1 1 1 -4  6  26 o 243.9420 3.881544 380.3898  310.0 4.372330       7.763089 0.99 
1 1 1 -4  6  27 o 114.2753 5.700265 179.5014  277.5 -24.61298      11.40053 0.96 
1 1 1 -4  6  28 o 172.4957 4.137780 260.9294  176.6 -12.44128      8.275560 0.98 
1 1 1 -4  6  29 o 117.6451 5.923222 107.7464  20.8  -1.451202      11.84644 0.94 
1 1 1 -4  6  30 o 44.98816 11.79242 94.86478  275.9 -10.00164      23.58484 0.84 
1 1 1 -4  6  31 o 127.8917 6.032824 146.3720  45.6  0.7299805E-01  12.06565 0.98 
1 1 1 -4  6  32 o 86.67865 9.324327 116.2072  4.3   -8.947762      18.64865 0.96 
1 1 1 -4  6  33 o 67.51794 12.35514 74.51661  20.4  -29.78732      24.71027 0.91 
1 1 1 -4  6  34 o 31.22364 10.35880 38.62769  213.0 ?              ?        0.64 
1 1 1 -4  8  1  o 506.7433 4.696166 599.4716  337.7 29.55521       9.392331 0.98 
1 1 1 -4  8  2  o 780.8047 6.714163 1167.542  294.5 16.69043       13.42833 0.99 
1 1 1 -4  8  3  o 498.4429 5.801180 678.3726  123.7 15.60019       11.60236 0.98 
1 1 1 -4  8  4  o 331.3974 3.425220 411.7357  7.7   -9.815430      6.850440 0.96 
1 1 1 -4  8  5  o 190.6938 2.388526 253.9806  338.6 -27.74442      4.777052 0.84 
1 1 1 -4  8  6  o 229.1184 2.437014 392.1932  95.2  32.39989       4.874027 0.94 
1 1 1 -4  8  7  o 388.7844 4.664739 725.7893  175.3 -26.75552      9.329478 0.98 
1 1 1 -4  8  8  o 497.0630 6.298774 767.8495  24.2  15.75848       12.59755 0.98 
1 1 1 -4  8  9  o 560.7950 6.907463 857.9343  56.3  19.22351       13.81493 0.99 
1 1 1 -4  8  10 o 320.0316 6.308863 544.3622  356.2 ?              ?        0.97 
1 1 1 -4  8  11 o 367.0732 5.628822 667.2039  186.8 -9.649750      11.25764 0.98 
1 1 1 -4  8  12 f 429.9864 5.721499 973.8837  192.0 -15.96362      11.44300 0.00 
1 1 1 -4  8  13 f 294.6937 4.920493 514.3445  198.3 -5.049194      9.840985 0.00 
1 1 1 -4  8  14 o 300.6907 4.806276 569.0337  109.0 -8.413177      9.612553 0.98 
1 1 1 -4  8  15 o 276.3191 2.554309 483.5430  131.2 28.27527       5.108618 0.98 
1 1 1 -4  8  16 o 184.7127 2.318429 383.5113  84.6  21.21138       4.636859 0.97 
1 1 1 -4  8  17 o 144.7750 2.257663 241.2735  193.6 24.04591       4.515326 0.95 
1 1 1 -4  8  18 o 146.1745 2.839547 184.0315  171.0 -4.839951      5.679095 0.94 
1 1 1 -4  8  19 f 50.37608 6.631142 107.6814  170.2 12.70201       13.26228 0.00 
1 1 1 -4  8  20 o 179.5273 3.009152 352.0371  357.4 -26.75893      6.018303 0.98 
1 1 1 -4  8  21 o 116.0711 3.708338 190.8119  313.5 -23.25436      7.416676 0.96 
1 1 1 -4  8  22 o 130.1077 3.760007 187.7078  254.2 7.560257       7.520013 0.96 
1 1 1 -4  8  23 o 112.7353 4.551739 167.3602  257.1 -7.938705      9.103477 0.96 
1 1 1 -4  8  24 o 92.94071 5.457801 165.3496  213.2 18.22398       10.91560 0.96 
1 1 1 -4  8  25 o 138.9479 4.590605 239.0677  23.8  1.565933       9.181211 0.98 
1 1 1 -4  8  26 o 149.0725 4.768389 195.3058  348.1 24.01210       9.536778 0.97 
1 1 1 -4  8  27 o 84.18544 7.832667 108.6168  285.2 -41.84684      15.66533 0.92 
1 1 1 -4  8  28 o 80.18716 11.54607 142.1796  253.1 1.303276       23.09214 0.94 
1 1 1 -4  8  29 o 115.3948 6.372074 178.9071  324.6 19.78163       12.74415 0.98 
1 1 1 -4  8  30 o 29.69621 9.737893 55.07891  315.3 0.5247688      19.47579 0.69 
1 1 1 -4  8  31 o 34.55966 11.06565 29.81256  58.2  0.5126495      22.13130 0.51 
1 1 1 -4  8  32 o 154.3196 5.324528 229.9247  302.4 ?              ?        0.99 
1 1 1 -4  10 1  o 244.7559 3.371742 344.2632  327.4 19.86722       6.743485 0.94 
1 1 1 -4  10 2  o 206.4720 2.955389 285.4468  291.1 22.94632       5.910779 0.92 
1 1 1 -4  10 3  o 388.2481 3.910729 475.1965  49.5  21.46655       7.821457 0.98 
1 1 1 -4  10 4  o 186.4955 3.191874 258.2224  37.5  21.63777       6.383748 0.91 
1 1 1 -4  10 5  o 300.4065 3.117132 471.3819  302.6 -25.96051      6.234264 0.97 
1 1 1 -4  10 6  o 148.5695 2.544542 201.2792  308.3 -29.67834      5.089085 0.88 
1 1 1 -4  10 7  o 108.6959 2.557897 211.4083  277.9 -59.88326      5.115793 0.84 
1 1 1 -4  10 8  o 128.1037 2.301264 279.7037  141.1 -24.36475      4.602528 0.91 
1 1 1 -4  10 9  o 83.98071 6.916707 292.0654  240.0 1.664383       13.83341 0.89 
1 1 1 -4  10 10 o 174.0325 4.702789 243.4490  263.1 -29.24892      9.405578 0.95 
1 1 1 -4  10 11 o 504.5487 7.102846 881.6888  309.6 -49.63837      14.20569 1.00 
1 1 1 -4  10 12 o 243.7585 4.420196 495.0097  318.5 24.49860       8.840391 0.99 
1 1 1 -4  10 13 o 145.2677 5.077625 259.9914  286.4 18.67877       10.15525 0.96 
1 1 1 -4  10 14 o 148.1677 5.315644 332.5368  16.8  -11.72394      10.63129 0.97 
1 1 1 -4  10 15 o 54.55621 11.96351 95.09936  212.3 4.929253       23.92701 0.68 
1 1 1 -4  10 16 o 324.7047 5.694098 585.4241  145.2 -28.20499      11.38820 0.99 
1 1 1 -4  10 17 o 82.45244 10.50332 70.37083  340.4 -4.999947      21.00664 0.80 
1 1 1 -4  10 18 o 33.59480 10.85901 58.14843  259.4 0.5581551      21.71802 0.45 
1 1 1 -4  10 19 o 125.3459 7.346191 218.3181  216.9 -28.75639      14.69238 0.97 
1 1 1 -4  10 20 o 38.41473 8.319584 49.75077  19.6  6.664104       16.63917 0.55 
1 1 1 -4  10 21 o 59.54050 6.506453 69.63280  62.6  0.7546120      13.01291 0.86 
1 1 1 -4  10 22 o 79.53860 6.756179 120.9641  134.7 38.55215       13.51236 0.92 
1 1 1 -4  10 23 o 31.69382 8.447414 47.12863  279.6 2.571304       16.89483 0.42 
1 1 1 -4  10 24 o 67.80644 7.111397 102.5277  79.9  -36.24543      14.22279 0.89 
1 1 1 -4  10 25 o 49.88226 8.813449 48.74006  117.7 10.94596       17.62690 0.69 
1 1 1 -4  10 26 o 28.32622 8.990629 54.89999  138.9 -9.327507      17.98126 0.61 
1 1 1 -4  10 27 o 87.65113 6.276353 116.9540  118.8 10.49794       12.55271 0.96 
1 1 1 -4  10 28 o 32.59383 9.760295 24.98073  204.4 4.795315       19.52059 0.45 
1 1 1 -4  10 29 o 30.86426 9.972681 33.01624  4.4   -11.33287      19.94536 0.54 
1 1 1 -4  10 30 o 45.28983 10.12677 81.46549  343.1 ?              ?        0.90 
1 1 1 -4  12 1  o 102.7464 3.597139 226.5993  231.6 32.86534       7.194279 0.94 
1 1 1 -4  12 2  f 111.8216 4.644526 162.6468  191.7 -12.98949      9.289051 0.00 
1 1 1 -4  12 3  o 70.60397 5.227493 74.85785  15.8  -16.93502      10.45499 0.69 
1 1 1 -4  12 4  o 112.0170 3.176824 231.4129  50.0  -18.58019      6.353649 0.95 
1 1 1 -4  12 5  o 124.3431 3.348082 221.6082  170.3 -15.50481      6.696164 0.95 
1 1 1 -4  12 6  o 233.4007 2.896507 445.9799  190.8 8.436462       5.793014 0.99 
1 1 1 -4  12 7  o 109.1735 2.850488 141.9677  202.3 2.453178       5.700976 0.91 
1 1 1 -4  12 8  o 114.1432 2.775144 260.0417  75.5  2.116348       5.550288 0.96 
1 1 1 -4  12 9  o 46.87832 5.040264 141.9865  148.9 -7.945751      10.08053 0.80 
1 1 1 -4  12 10 o 48.64861 11.47306 62.94565  240.4 19.64436       22.94613 0.56 
1 1 1 -4  12 11 o 217.7663 7.842035 431.7085  102.9 ?              ?        0.99 
1 1 1 -4  12 12 o 162.2371 5.756921 249.4012  40.0  -7.024063      11.51384 0.98 
1 1 1 -4  12 13 o 82.05466 9.675297 188.8671  300.0 -7.181931      19.35059 0.94 
1 1 1 -4  12 14 o 47.55714 12.98471 59.65367  83.6  13.46749       25.96942 0.61 
1 1 1 -4  12 15 o 89.90346 10.52678 186.2090  7.9   -14.94978      21.05356 0.95 
1 1 1 -4  12 16 o 54.04408 11.91933 149.2375  120.5 -14.05602      23.83866 0.91 
1 1 1 -4  12 17 o 201.2212 6.514242 310.3036  283.2 -4.222778      13.02848 0.99 
1 1 1 -4  12 18 o 171.8258 6.566678 326.4403  335.0 -2.431335      13.13336 0.99 
1 1 1 -4  12 19 o 189.5688 6.470676 285.7709  91.5  28.74396       12.94135 0.99 
1 1 1 -4  12 20 o 187.3715 7.077754 337.6310  149.7 -20.88647      14.15551 0.99 
1 1 1 -4  12 21 o 90.77345 12.67094 134.3256  232.4 9.211678       25.34187 0.94 
1 1 1 -4  12 22 o 40.92179 12.17155 53.90268  292.4 -21.45296      24.34311 0.66 
1 1 1 -4  12 23 o 106.7084 12.50149 159.8841  232.1 6.099243       25.00299 0.97 
1 1 1 -4  12 24 o 55.28861 14.26944 89.15535  67.0  -20.95367      28.53887 0.89 
1 1 1 -4  12 25 o 71.80621 16.01241 107.5271  96.3  -2.637093      32.02481 0.93 
1 1 1 -4  12 26 o 35.32499 10.53091 53.13523  51.7  -9.301283      21.06182 0.75 
1 1 1 -4  12 27 o 33.79161 10.57639 50.25865  244.6 ?              ?        0.75 
1 1 1 -4  14 1  o 58.32424 8.552247 51.41392  320.7 -31.05869      17.10449 0.69 
1 1 1 -4  14 2  o 106.1492 4.556581 172.1440  344.1 45.22294       9.113162 0.96 
1 1 1 -4  14 3  o 171.2133 3.533692 379.3339  16.4  -22.65854      7.067384 0.99 
1 1 1 -4  14 4  o 169.6590 3.284397 275.0052  322.7 -5.634216      6.568794 0.99 
1 1 1 -4  14 5  o 100.2281 4.287721 163.3332  336.0 14.31968       8.575442 0.96 
1 1 1 -4  14 6  o 241.9236 3.119650 406.9769  86.8  8.054092       6.239301 0.99 
1 1 1 -4  14 7  o 118.7400 3.321053 260.0497  129.3 10.93533       6.642107 0.98 
1 1 1 -4  14 8  o 108.8290 3.548102 130.7198  157.3 14.36581       7.096204 0.96 
1 1 1 -4  14 9  o 144.1792 2.795739 200.2340  120.4 8.566696       5.591479 0.98 
1 1 1 -4  14 10 o 124.3559 6.433285 272.6921  95.6  -9.437408      12.86657 0.98 
1 1 1 -4  14 11 o 76.81686 11.64990 153.0906  66.1  -23.25677      23.29980 0.94 
1 1 1 -4  14 12 o 95.09776 10.52624 216.5359  190.3 11.26121       21.05248 0.96 
1 1 1 -4  14 13 o 53.63918 11.59668 71.62071  253.3 -43.38428      23.19337 0.75 
1 1 1 -4  14 14 o 141.9901 7.617990 285.8289  18.6  -5.468430      15.23598 0.98 
1 1 1 -4  14 15 o 97.66644 12.24771 155.8105  131.6 -14.19878      24.49542 0.95 
1 1 1 -4  14 16 o 115.8745 11.44055 222.8089  199.7 -19.50075      22.88111 0.97 
1 1 1 -4  14 17 o 127.0974 9.210304 224.8441  317.8 -18.12497      18.42061 0.98 
1 1 1 -4  14 18 o 80.07047 17.89447 141.6517  346.2 ?              ?        0.94 
1 1 1 -4  14 19 f 57.68355 14.10946 142.0279  91.0  -13.07546      28.21892 0.00 
1 1 1 -4  14 20 o 55.08644 14.67621 40.85232  218.0 -19.11133      29.35242 0.75 
1 1 1 -4  14 21 o 49.02900 14.89561 27.34592  345.6 6.036350       29.79122 0.56 
1 1 1 -4  14 22 o 59.29649 12.72129 115.3183  70.9  -41.59713      25.44257 0.93 
1 1 1 -4  14 23 o 45.43522 14.57535 98.22682  51.9  17.91894       29.15070 0.89 
1 1 1 -4  14 24 o 46.82272 14.71342 103.7547  104.2 ?              ?        0.91 
1 1 1 -4  16 1  o 53.68293 9.689591 139.8064  208.0 12.45076       19.37918 0.91 
1 1 1 -4  16 2  o 41.70415 9.949429 81.71267  106.3 2.385990       19.89886 0.79 
1 1 1 -4  16 3  f 92.65665 7.228343 78.18494  52.1  -26.79945      14.45669 0.00 
1 1 1 -4  16 4  o 157.3103 3.960350 258.1807  126.7 -15.56319      7.920701 0.99 
1 1 1 -4  16 5  o 26.88263 8.424186 53.19464  284.8 0.5370560      16.84837 0.53 
1 1 1 -4  16 6  o 130.6610 4.256895 246.6228  289.2 -4.417725      8.513789 0.98 
1 1 1 -4  16 7  o 177.7220 3.345096 376.0975  22.3  -0.7297516     6.690193 0.99 
1 1 1 -4  16 8  o 165.2572 3.396858 303.5252  63.3  -7.985275      6.793716 0.99 
1 1 1 -4  16 9  f 39.32330 7.032366 75.19099  236.0 -23.06770      14.06473 0.00 
1 1 1 -4  16 10 o 128.1504 3.087883 214.1386  239.6 -0.8811951     6.175766 0.99 
1 1 1 -4  16 11 o 35.94276 11.75511 48.12647  60.2  1.964561       23.51022 0.67 
1 1 1 -4  16 12 o 96.53931 13.43489 167.1903  26.4  -19.50562      26.86978 0.97 
1 1 1 -4  16 13 o 39.14837 12.62087 66.07168  26.2  6.548927       25.24175 0.82 
1 1 1 -4  16 14 o 43.74390 13.07404 85.77864  112.3 -16.32618      26.14808 0.88 
1 1 1 -4  16 15 o 42.97905 13.66336 88.33814  302.4 18.63119       27.32673 0.87 
1 1 1 -4  16 16 o 46.48615 14.01018 88.95172  331.1 -3.888500      28.02036 0.88 
1 1 1 -4  16 17 o 56.21979 15.97902 46.09713  321.4 8.845646       31.95803 0.77 
1 1 1 -4  16 18 o 48.29402 13.72974 126.7824  11.4  ?              ?        0.93 
1 1 1 -4  16 19 x ?        ?        157.1767  6.5   ?              ?        0.00 
1 1 1 -4  18 1  o 95.87965 7.103525 130.2914  205.0 -6.102066      14.20705 0.98 
1 1 1 -4  18 2  o 39.63931 10.91073 47.49490  34.9  20.47762       21.82146 0.77 
1 1 1 -4  18 3  o 46.56630 10.89496 157.7873  38.9  0.6441422      21.78992 0.95 
1 1 1 -4  18 4  o 39.08311 10.19478 44.14802  206.5 -8.340408      20.38956 0.77 
1 1 1 -4  18 5  o 42.47382 10.49492 38.39989  194.7 12.61018       20.98985 0.75 
1 1 1 -4  18 6  o 71.54715 9.134216 167.0086  120.7 -33.67633      18.26843 0.97 
1 1 1 -4  18 7  o 67.27005 8.883373 151.4618  100.8 -7.926445      17.76675 0.97 
1 1 1 -4  18 8  o 30.36208 8.678057 41.00575  70.1  ?              ?        0.72 
1 1 1 -4  18 9  o 30.21006 8.342105 67.00774  211.5 ?              ?        0.85 
1 1 1 -4  18 10 o 67.03159 6.124063 156.7543  287.9 ?              ?        0.98 
1 1 1 -3  1  1  o 327.7533 6.757257 3083.892  82.1  ?              ?        0.90 
1 1 1 -3  1  2  o 351.5131 4.169284 1484.924  65.9  -37.65338      8.338569 0.97 
1 1 1 -3  1  3  o 377.9947 3.641476 1047.684  126.1 -80.58554      7.282952 0.95 
1 1 1 -3  1  4  x ?        ?        1221.390  116.6 ?              ?        0.00 
1 1 1 -3  1  5  o 782.9182 9.781487 1154.049  33.3  ?              ?        0.99 
1 1 1 -3  1  6  o 350.7501 3.582810 625.3204  97.5  -118.3063      7.165621 0.97 
1 1 1 -3  1  7  o 175.8459 2.385937 792.4990  37.2  42.58089       4.771874 0.84 
1 1 1 -3  1  8  o 663.2504 6.144572 1063.818  268.3 -52.86310      12.28914 0.99 
1 1 1 -3  1  9  o 434.5401 4.470597 888.2425  219.1 -25.86646      8.941195 0.98 
1 1 1 -3  1  10 o 251.1672 3.088819 418.9177  98.1  -24.57639      6.177639 0.95 
1 1 1 -3  1  11 o 291.2259 3.353309 435.5896  49.6  -37.03207      6.706619 0.95 
1 1 1 -3  1  12 f 304.8763 3.524820 379.5466  0.6   -90.14050      7.049640 0.00 
1 1 1 -3  1  13 o 321.5785 3.559474 607.3386  7.1   7.151062       7.118947 0.95 
1 1 1 -3  1  14 o 570.1280 5.273011 785.7163  52.5  2.353638       10.54602 0.98 
1 1 1 -3  1  15 o 585.4279 5.366417 820.3567  349.0 -105.2527      10.73283 0.98 
1 1 1 -3  1  16 o 217.8683 3.766716 253.4253  211.0 10.94000       7.533432 0.85 
1 1 1 -3  1  17 o 681.3458 6.012975 982.4205  49.7  -22.99280      12.02595 0.99 
1 1 1 -3  1  18 o 374.2334 3.871367 521.8815  176.4 35.51782       7.742734 0.96 
1 1 1 -3  1  19 f 426.1680 4.027993 656.4346  250.7 -21.87894      8.055986 0.00 
1 1 1 -3  1  20 o 299.4762 3.304443 308.2115  335.4 26.49677       6.608886 0.96 
1 1 1 -3  1  21 o 129.1040 3.973265 71.09681  292.7 -19.96626      7.946529 0.53 
1 1 1 -3  1  22 o 268.7255 3.357431 329.6882  214.2 14.18631       6.714863 0.98 
1 1 1 -3  1  23 o 278.4977 3.457952 428.6687  224.2 1.591431       6.915904 0.99 
1 1 1 -3  1  24 o 280.8653 3.512764 411.0324  248.1 26.38080       7.025527 0.99 
1 1 1 -3  1  25 o 37.41074 9.776136 142.5174  276.8 -1.320614      19.55227 0.71 
1 1 1 -3  1  26 f 245.1833 4.341043 199.2835  299.2 24.94658       8.682085 0.00 
1 1 1 -3  1  27 o 68.12144 9.102549 115.1398  68.0  -1.624634      18.20510 0.87 
1 1 1 -3  1  28 o 91.86172 7.118415 82.96078  17.7  13.71544       14.23683 0.91 
1 1 1 -3  1  29 o 60.63286 10.00435 36.42798  95.8  -23.17780      20.00871 0.54 
1 1 1 -3  1  30 o 179.4761 4.584836 180.6187  28.3  32.31917       9.169672 0.97 
1 1 1 -3  1  31 o 105.3424 7.496194 144.8850  307.7 -21.47502      14.99239 0.95 
1 1 1 -3  1  32 o 165.3395 5.819597 176.3990  285.5 5.009796       11.63919 0.98 
1 1 1 -3  1  33 o 70.00392 11.60220 79.73777  299.8 2.446266       23.20439 0.91 
1 1 1 -3  1  34 o 36.75491 11.55103 54.83453  226.0 -10.97148      23.10207 0.72 
1 1 1 -3  1  35 o 34.98313 11.35228 16.67060  246.7 -11.01771      22.70457 0.33 
1 1 1 -3  3  1  f 698.7804 6.134546 2055.682  33.9  140.1407       12.26909 0.00 
1 1 1 -3  3  2  o 115.9827 2.574673 189.3846  205.6 -63.47366      5.149345 0.82 
1 1 1 -3  3  3  o 700.6634 8.555958 1320.329  125.0 ?              ?        0.99 
1 1 1 -3  3  4  o 762.4502 8.239480 1575.360  203.0 -70.23932      16.47896 0.99 
1 1 1 -3  3  5  o 351.5647 4.359552 231.1397  254.1 -38.89899      8.719105 0.97 
1 1 1 -3  3  6  o 368.5219 3.422208 816.5033  203.7 -10.52090      6.844416 0.97 
1 1 1 -3  3  7  o 56.73904 2.351405 748.0153  317.7 ?              ?        0.66 
1 1 1 -3  3  8  o 344.2941 3.332825 609.5253  59.3  -54.76285      6.665649 0.97 
1 1 1 -3  3  9  o 136.7764 2.000945 808.2764  51.0  1.037537       4.001889 0.85 
1 1 1 -3  3  10 o 535.5634 4.876419 1031.069  59.8  101.4347       9.752838 0.99 
1 1 1 -3  3  11 o 406.0559 3.885450 508.1618  347.1 58.97516       7.770901 0.97 
1 1 1 -3  3  12 o 235.5175 2.758476 395.4843  96.2  -38.91872      5.516953 0.91 
1 1 1 -3  3  13 o 95.29175 2.675608 299.8816  354.8 10.07906       5.351216 0.68 
1 1 1 -3  3  14 o 342.6191 3.475485 690.7559  346.7 -29.67728      6.950970 0.97 
1 1 1 -3  3  15 o 476.5398 4.374776 732.8679  190.7 11.57208       8.749553 0.98 
1 1 1 -3  3  16 o 537.6785 4.895233 813.6740  140.0 4.493164       9.790466 0.98 
1 1 1 -3  3  17 o 457.6978 5.331479 748.3239  342.5 46.95190       10.66296 0.98 
1 1 1 -3  3  18 o 276.9860 3.246409 556.2722  216.4 10.67691       6.492818 0.96 
1 1 1 -3  3  19 o 293.6063 3.341917 468.7684  181.3 -3.499054      6.683834 0.97 
1 1 1 -3  3  20 o 411.7697 4.162252 542.9242  297.2 -0.9611206     8.324504 0.98 
1 1 1 -3  3  21 o 224.1414 3.114106 277.6642  30.0  -8.616806      6.228212 0.96 
1 1 1 -3  3  22 o 124.3298 3.870275 201.1217  198.5 0.4865723      7.740551 0.93 
1 1 1 -3  3  23 o 219.2927 3.342174 243.1784  289.6 4.832062       6.684349 0.97 
1 1 1 -3  3  24 o 361.6595 4.077726 465.1096  330.7 8.233551       8.155452 0.99 
1 1 1 -3  3  25 o 221.2643 3.558419 317.0008  263.2 -7.400879      7.116838 0.99 
1 1 1 -3  3  26 f 288.5467 3.921088 347.0712  295.0 -20.52917      7.842175 0.00 
1 1 1 -3  3  27 o 55.36376 8.337956 40.98768  163.3 45.44992       16.67591 0.58 
1 1 1 -3  3  28 o 52.02353 11.11716 142.6013  203.9 -3.700520      22.23432 0.89 
1 1 1 -3  3  29 o 79.29256 8.760013 88.49052  236.0 -24.30064      17.52003 0.85 
1 1 1 -3  3  30 o 88.63232 7.027657 141.1782  271.2 -12.90415      14.05531 0.93 
1 1 1 -3  3  31 o 198.3553 4.747157 208.9559  267.4 2.147232       9.494313 0.99 
1 1 1 -3  3  32 o 86.40337 8.781462 77.11950  197.1 -10.29408      17.56292 0.92 
1 1 1 -3  3  33 o 51.15624 12.38427 45.50772  121.6 -27.92282      24.76854 0.76 
1 1 1 -3  3  34 o 119.2729 7.905047 138.3721  339.6 -9.718018      15.81009 0.98 
1 1 1 -3  3  35 o 64.44434 11.63776 102.3098  82.1  ?              ?        0.94 
1 1 1 -3  5  1  o 505.3421 4.693710 996.0359  336.0 -4.396484      9.387421 0.99 
1 1 1 -3  5  2  f 273.5488 2.932472 556.1277  256.1 46.27353       5.864943 0.00 
1 1 1 -3  5  3  o 126.8885 1.855362 360.7232  94.1  16.11202       3.710725 0.77 
1 1 1 -3  5  4  o 416.6266 8.283290 711.6549  329.8 ?              ?        0.97 
1 1 1 -3  5  5  o 84.29808 2.486163 172.8157  174.4 -47.53553      4.972327 0.43 
1 1 1 -3  5  6  o 142.0775 3.088589 495.7976  140.9 23.00685       6.177178 0.89 
1 1 1 -3  5  7  o 432.0153 6.369758 636.8494  50.8  40.41272       12.73952 0.97 
1 1 1 -3  5  8  o 267.6921 4.473603 433.5311  27.7  47.19429       8.947206 0.95 
1 1 1 -3  5  9  f 478.4981 4.113554 888.7178  16.4  14.58658       8.227109 0.00 
1 1 1 -3  5  10 o 330.1398 3.055502 577.9526  62.0  26.65115       6.111004 0.95 
1 1 1 -3  5  11 o 386.7161 4.067822 548.6760  4.8   66.49969       8.135645 0.97 
1 1 1 -3  5  12 o 181.9215 2.195151 185.4778  231.0 -42.77261      4.390301 0.77 
1 1 1 -3  5  13 o 444.8179 3.994036 670.2871  79.1  12.02634       7.988073 0.97 
1 1 1 -3  5  14 o 463.7665 4.141933 599.9942  3.6   -94.63239      8.283866 0.98 
1 1 1 -3  5  15 f 500.2575 4.449966 525.1352  29.2  29.07309       8.899933 0.00 
1 1 1 -3  5  16 o 255.4163 2.881838 314.9094  230.1 4.424805       5.763675 0.93 
1 1 1 -3  5  17 f 439.1938 4.092936 582.4028  123.9 40.16678       8.185872 0.00 
1 1 1 -3  5  18 o 301.4172 3.276894 457.7212  231.2 20.10672       6.553789 0.97 
1 1 1 -3  5  19 o 208.0911 3.900137 240.7719  251.6 17.87239       7.800275 0.95 
1 1 1 -3  5  20 o 336.7704 3.539219 422.4824  263.9 1.278931       7.078438 0.99 
1 1 1 -3  5  21 o 59.89906 6.625721 91.94254  101.3 -35.07146      13.25144 0.68 
1 1 1 -3  5  22 o 74.55402 5.441978 114.4739  348.8 9.322830       10.88396 0.78 
1 1 1 -3  5  23 o 109.6884 4.471879 196.1944  290.9 -3.940659      8.943757 0.94 
1 1 1 -3  5  24 o 161.1770 3.674543 168.6199  304.5 15.91733       7.349086 0.96 
1 1 1 -3  5  25 o 243.9731 3.454064 332.7215  285.9 6.807266       6.908128 0.99 
1 1 1 -3  5  26 o 51.40251 10.47396 58.69923  54.9  -44.06911      20.94793 0.69 
1 1 1 -3  5  27 o 129.1149 4.772851 189.2312  259.6 9.185600       9.545701 0.97 
1 1 1 -3  5  28 f 152.5424 4.991864 218.5449  230.8 4.526611       9.983728 0.00 
1 1 1 -3  5  29 o 74.03078 9.726573 66.47410  276.1 -39.85326      19.45315 0.81 
1 1 1 -3  5  30 o 108.9424 7.163079 142.4264  213.9 25.55584       14.32616 0.96 
1 1 1 -3  5  31 o 114.1547 7.157075 124.4213  19.1  -14.70998      14.31415 0.97 
1 1 1 -3  5  32 o 34.84115 10.76383 34.33347  6.0   -18.49237      21.52766 0.56 
1 1 1 -3  5  33 o 58.75096 12.97929 85.05940  70.4  -4.577194      25.95857 0.90 
1 1 1 -3  5  34 o 45.22316 11.80393 98.00224  284.0 ?              ?        0.90 
1 1 1 -3  7  1  o 379.9720 3.748942 468.1667  342.0 -10.19968      7.497885 0.96 
1 1 1 -3  7  2  o 144.4827 2.173877 165.1241  77.8  -31.32831      4.347754 0.57 
1 1 1 -3  7  3  o 280.5902 2.957586 358.7993  296.0 16.47198       5.915171 0.93 
1 1 1 -3  7  4  f 366.0939 3.560342 498.0917  305.8 -55.17194      7.120685 0.00 
1 1 1 -3  7  5  o 698.5503 6.010052 1246.090  49.8  16.82562       12.02010 0.99 
1 1 1 -3  7  6  o 482.7500 6.349249 805.3004  55.4  32.28857       12.69850 0.98 
1 1 1 -3  7  7  o 249.9163 4.074853 481.6871  65.2  -86.19370      8.149707 0.94 
1 1 1 -3  7  8  o 399.3718 5.503403 800.8589  314.0 14.03012       11.00681 0.98 
1 1 1 -3  7  9  o 476.1439 6.340328 710.1732  50.7  9.534943       12.68066 0.98 
1 1 1 -3  7  10 o 763.0517 9.037796 916.9756  109.6 -1.170288      18.07559 0.99 
1 1 1 -3  7  11 o 362.5218 5.179021 374.6121  86.8  -2.972931      10.35804 0.95 
1 1 1 -3  7  12 o 767.6078 7.271493 973.4895  126.0 45.44037       14.54299 0.99 
1 1 1 -3  7  13 o 99.47186 2.103861 280.2250  161.5 -46.65501      4.207722 0.72 
1 1 1 -3  7  14 o 236.9147 2.374197 345.8212  110.9 -38.02199      4.748394 0.94 
1 1 1 -3  7  15 o 327.9305 3.193227 573.5142  132.3 -3.709930      6.386454 0.98 
1 1 1 -3  7  16 o 104.4344 2.866802 202.6904  157.1 19.24789       5.733604 0.83 
1 1 1 -3  7  17 o 104.2412 3.049798 171.6361  260.8 12.47074       6.099595 0.86 
1 1 1 -3  7  18 o 187.9814 2.607093 335.6837  163.7 20.07481       5.214185 0.98 
1 1 1 -3  7  19 f 129.6376 2.973746 358.2189  227.1 22.78295       5.947493 0.00 
1 1 1 -3  7  20 o 275.9996 3.342920 430.5782  319.4 -6.300262      6.685841 0.99 
1 1 1 -3  7  21 o 204.2896 3.158203 317.9453  45.2  -3.511673      6.316406 0.98 
1 1 1 -3  7  22 o 266.7181 3.502650 413.2644  79.4  26.18289       7.005300 0.99 
1 1 1 -3  7  23 o 81.04141 7.364818 25.02023  89.8  44.65638       14.72964 0.48 
1 1 1 -3  7  24 o 60.50768 8.861245 160.1449  233.2 10.48934       17.72249 0.91 
1 1 1 -3  7  25 o 151.5976 4.139147 208.2982  271.4 29.08867       8.278295 0.98 
1 1 1 -3  7  26 o 102.7528 9.060094 133.3855  321.4 23.37155       18.12019 0.94 
1 1 1 -3  7  27 o 122.7806 5.430363 148.2344  267.8 -36.54074      10.86073 0.95 
1 1 1 -3  7  28 o 38.75583 10.96184 71.84675  346.0 1.141167       21.92368 0.67 
1 1 1 -3  7  29 o 141.8491 5.283776 202.7451  332.0 7.205444       10.56755 0.98 
1 1 1 -3  7  30 o 38.77394 10.74653 53.49377  229.6 16.78065       21.49306 0.73 
1 1 1 -3  7  31 o 77.01315 10.88654 97.78743  196.8 1.328217       21.77308 0.94 
1 1 1 -3  7  32 o 35.89701 11.01008 54.67398  269.5 -15.47045      22.02016 0.75 
1 1 1 -3  7  33 o 133.5259 6.680919 188.5849  23.7  ?              ?        0.99 
1 1 1 -3  9  1  o 351.0457 4.265008 490.3436  285.1 -14.61633      8.530016 0.96 
1 1 1 -3  9  2  o 761.3407 6.679007 1074.349  348.0 1.321472       13.35801 0.99 
1 1 1 -3  9  3  o 242.7899 2.914328 212.2071  82.7  -0.8800812     5.828656 0.87 
1 1 1 -3  9  4  o 607.1556 6.627707 973.8422  198.8 -62.59265      13.25541 0.99 
1 1 1 -3  9  5  o 385.5080 3.745181 566.3638  83.8  47.57465       7.490361 0.97 
1 1 1 -3  9  6  o 323.4153 3.549395 552.7186  57.4  30.27200       7.098789 0.97 
1 1 1 -3  9  7  o 283.3215 3.996876 515.4326  188.2 -73.44510      7.993753 0.96 
1 1 1 -3  9  8  o 477.0111 6.618372 751.9469  249.7 -43.93185      13.23674 0.99 
1 1 1 -3  9  9  o 197.6801 4.185035 361.6408  229.2 -11.19325      8.370070 0.93 
1 1 1 -3  9  10 o 332.1021 5.010448 539.4251  29.3  15.89114       10.02090 0.98 
1 1 1 -3  9  11 o 267.7005 4.481441 281.3835  19.9  27.48824       8.962881 0.95 
1 1 1 -3  9  12 o 72.52792 9.071514 70.30962  312.0 -31.08697      18.14303 0.46 
1 1 1 -3  9  13 f 157.1232 4.551064 373.0739  251.9 -17.51364      9.102129 0.00 
1 1 1 -3  9  14 o 132.2869 5.848396 131.7228  184.7 -3.050308      11.69679 0.89 
1 1 1 -3  9  15 o 37.44199 10.40880 136.7453  12.8  -7.492104      20.81761 0.63 
1 1 1 -3  9  16 o 141.5405 5.770524 282.2127  86.7  40.21074       11.54105 0.96 
1 1 1 -3  9  17 o 130.0305 4.130802 206.0820  188.6 8.432335       8.261603 0.94 
1 1 1 -3  9  18 o 348.8882 3.327778 486.1496  70.1  29.17221       6.655555 0.99 
1 1 1 -3  9  19 o 195.6517 2.746901 328.9460  53.5  28.51398       5.493803 0.99 
1 1 1 -3  9  20 o 58.86696 5.812842 112.7503  56.2  -12.74017      11.62568 0.85 
1 1 1 -3  9  21 o 23.37493 7.375646 40.75566  206.2 -1.420864      14.75129 0.28 
1 1 1 -3  9  22 o 143.5471 3.810583 242.7554  57.6  35.29836       7.621166 0.98 
1 1 1 -3  9  23 o 30.41612 8.822367 102.8204  10.9  -8.460171      17.64473 0.74 
1 1 1 -3  9  24 o 30.95758 8.771357 46.49086  100.8 -17.00232      17.54271 0.39 
1 1 1 -3  9  25 o 45.05190 8.995263 44.38689  163.1 -43.36166      17.99053 0.53 
1 1 1 -3  9  26 o 93.42879 6.489317 120.8081  149.4 8.714767       12.97863 0.94 
1 1 1 -3  9  27 o 89.54279 7.452081 144.1967  86.9  14.13467       14.90416 0.96 
1 1 1 -3  9  28 o 87.97252 7.699437 77.75919  144.1 -7.124565      15.39887 0.94 
1 1 1 -3  9  29 o 56.89555 14.15237 83.31993  54.6  1.402290       28.30475 0.89 
1 1 1 -3  9  30 o 34.50065 10.71255 54.94936  21.0  -10.96456      21.42511 0.74 
1 1 1 -3  9  31 o 32.35899 10.73183 30.79203  143.7 ?              ?        0.56 
1 1 1 -3  11 1  o 252.5781 3.064209 371.3310  90.8  4.258667       6.128417 0.97 
1 1 1 -3  11 2  o 207.1990 2.838465 323.6725  37.7  -5.405869      5.676930 0.96 
1 1 1 -3  11 3  o 243.6633 3.688121 375.0098  316.6 35.87952       7.376242 0.98 
1 1 1 -3  11 4  o 92.97517 3.446021 133.9244  174.7 -15.99071      6.892041 0.79 
1 1 1 -3  11 5  o 321.3465 3.315736 551.2937  185.5 20.46127       6.631471 0.99 
1 1 1 -3  11 6  o 246.7847 3.285924 412.9246  205.6 20.53009       6.571848 0.98 
1 1 1 -3  11 7  o 199.5413 2.813666 318.9777  209.5 12.44824       5.627333 0.98 
1 1 1 -3  11 8  f 108.3508 2.488283 227.8519  122.1 -9.714119      4.976566 0.00 
1 1 1 -3  11 9  o 164.5410 4.642383 319.5974  84.8  -20.97850      9.284766 0.97 
1 1 1 -3  11 10 o 91.40344 8.388785 190.3130  4.2   -31.89556      16.77757 0.91 
1 1 1 -3  11 11 o 188.3139 4.691262 295.6230  138.3 -3.348938      9.382524 0.97 
1 1 1 -3  11 12 o 145.0298 5.684584 217.3592  196.8 -12.25124      11.36917 0.96 
1 1 1 -3  11 13 o 217.5580 4.979067 406.1956  208.1 -14.40520      9.958134 0.99 
1 1 1 -3  11 14 o 114.8183 6.898739 155.2451  234.0 25.50584       13.79748 0.94 
1 1 1 -3  11 15 o 258.7303 5.425441 396.2590  201.3 14.82085       10.85088 0.99 
1 1 1 -3  11 16 o 135.3266 6.836478 255.0083  92.1  -15.99421      13.67296 0.97 
1 1 1 -3  11 17 o 279.9317 5.790851 445.4000  19.2  -21.00241      11.58170 0.99 
1 1 1 -3  11 18 o 78.48656 11.14705 157.0199  332.5 -64.77171      22.29410 0.94 
1 1 1 -3  11 19 o 154.8454 6.603804 241.5645  183.0 -10.90480      13.20761 0.99 
1 1 1 -3  11 20 o 190.5044 7.182671 316.1843  161.8 -47.73532      14.36534 0.99 
1 1 1 -3  11 21 o 111.1217 8.646457 173.1985  212.0 13.59384       17.29291 0.96 
1 1 1 -3  11 22 o 130.9394 9.122758 162.7639  273.2 5.503204       18.24552 0.96 
1 1 1 -3  11 23 f 155.6354 5.064764 246.1411  249.2 -20.61090      10.12953 0.00 
1 1 1 -3  11 24 f 66.92310 9.944904 64.75347  343.3 27.47963       19.88981 0.00 
1 1 1 -3  11 25 o 115.8862 5.341336 148.1125  279.7 4.467827       10.68267 0.98 
1 1 1 -3  11 26 o 219.6804 3.620439 336.8810  265.7 -19.00127      7.240879 1.00 
1 1 1 -3  11 27 o 126.5281 4.840703 205.5793  284.3 -6.990791      9.681407 0.99 
1 1 1 -3  11 28 o 31.37798 9.809996 38.10507  10.9  -3.823874      19.61999 0.63 
1 1 1 -3  11 29 x ?        ?        52.74954  13.2  ?              ?        0.00 
1 1 1 -3  13 1  o 332.6392 4.800145 568.5343  106.1 5.835693       9.600290 0.99 
1 1 1 -3  13 2  o 116.1472 4.061512 238.6071  183.4 -47.57018      8.123025 0.96 
1 1 1 -3  13 3  o 168.6175 3.181924 302.1504  263.2 -8.798676      6.363848 0.98 
1 1 1 -3  13 4  o 64.20473 5.493395 169.5616  274.2 -16.03102      10.98679 0.91 
1 1 1 -3  13 5  o 88.07684 4.201950 149.4253  208.9 -16.80070      8.403899 0.93 
1 1 1 -3  13 6  o 27.52159 7.381597 152.8037  29.3  15.43019       14.76319 0.75 
1 1 1 -3  13 7  f 30.77409 7.400820 168.0498  41.2  -4.627178      14.80164 0.00 
1 1 1 -3  13 8  o 189.3788 2.852852 407.7307  9.7   -4.119354      5.705703 0.99 
1 1 1 -3  13 9  o 120.0163 2.865776 186.7483  265.9 -19.16143      5.731551 0.97 
1 1 1 -3  13 10 o 144.8437 9.395285 286.3661  217.2 ?              ?        0.98 
1 1 1 -3  13 11 o 99.29859 9.243746 135.8667  180.6 6.659546       18.48749 0.94 
1 1 1 -3  13 12 o 186.0258 5.750949 367.0789  57.3  -20.51585      11.50190 0.99 
1 1 1 -3  13 13 o 86.15595 10.04319 114.1541  46.0  24.03499       20.08639 0.94 
1 1 1 -3  13 14 o 93.23388 12.49729 148.5048  30.2  ?              ?        0.95 
1 1 1 -3  13 15 o 159.6858 7.251116 238.5540  63.8  -26.94240      14.50223 0.98 
1 1 1 -3  13 16 o 125.5003 8.561808 221.1593  180.6 -15.26831      17.12362 0.97 
1 1 1 -3  13 17 f 208.3163 6.741207 271.3726  265.3 -18.10892      13.48241 0.00 
1 1 1 -3  13 18 o 74.47282 14.33740 201.8262  269.6 -8.496513      28.67479 0.95 
1 1 1 -3  13 19 o 89.19444 12.13850 128.9182  166.8 -4.912292      24.27699 0.94 
1 1 1 -3  13 20 o 90.45148 13.48837 182.7033  226.9 -9.193657      26.97673 0.96 
1 1 1 -3  13 21 o 34.19528 11.52740 7.380469  257.6 1.095482       23.05480 0.13 
1 1 1 -3  13 22 o 37.00481 12.34705 34.29535  133.9 1.097702       24.69409 0.59 
1 1 1 -3  13 23 o 60.22025 15.91921 79.18649  254.4 19.02299       31.83842 0.88 
1 1 1 -3  13 24 o 62.09046 14.41680 134.0922  191.9 -31.04374      28.83360 0.94 
1 1 1 -3  13 25 o 55.15971 15.28166 111.6729  155.7 ?              ?        0.92 
1 1 1 -3  13 26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -3  15 1  o 105.3470 5.920630 227.3920  23.4  -12.13544      11.84126 0.98 
1 1 1 -3  15 2  o 58.78054 8.367505 93.98020  315.9 -16.21706      16.73501 0.88 
1 1 1 -3  15 3  o 45.23802 9.453884 110.8275  129.7 6.370090       18.90777 0.86 
1 1 1 -3  15 4  f 91.00056 5.726915 232.8337  296.8 -32.53361      11.45383 0.00 
1 1 1 -3  15 5  o 125.4862 4.483531 233.6700  334.3 -45.89461      8.967063 0.98 
1 1 1 -3  15 6  o 112.5926 4.002908 171.1313  55.5  -0.5549622     8.005816 0.97 
1 1 1 -3  15 7  o 42.90066 7.679014 142.9516  41.5  -14.66621      15.35803 0.88 
1 1 1 -3  15 8  o 55.48917 6.652995 82.38995  135.0 40.92564       13.30599 0.83 
1 1 1 -3  15 9  o 86.83330 4.175852 157.0272  151.3 20.86418       8.351705 0.95 
1 1 1 -3  15 10 o 138.9256 2.857774 242.8659  177.5 -10.34511      5.715549 0.98 
1 1 1 -3  15 11 o 146.7638 8.575800 250.2947  149.4 28.14003       17.15160 0.98 
1 1 1 -3  15 12 o 80.32845 12.89210 125.1760  146.2 1.268784       25.78420 0.93 
1 1 1 -3  15 13 o 43.95590 13.08087 83.04297  317.7 -7.015133      26.16174 0.80 
1 1 1 -3  15 14 o 55.04422 14.05457 97.51325  7.9   5.680218       28.10913 0.88 
1 1 1 -3  15 15 o 38.94551 12.46106 80.36974  268.8 -7.647484      24.92213 0.82 
1 1 1 -3  15 16 o 53.72628 15.02670 52.92702  275.1 5.755337       30.05339 0.79 
1 1 1 -3  15 17 o 68.39487 24.92368 133.3996  49.5  ?              ?        0.90 
1 1 1 -3  15 18 o 58.33038 13.85064 156.0056  347.8 -29.14885      27.70129 0.95 
1 1 1 -3  15 19 o 46.97001 14.19958 75.92477  0.8   -6.267490      28.39917 0.85 
1 1 1 -3  15 20 o 64.37045 15.19983 129.9846  83.5  -23.47395      30.39967 0.94 
1 1 1 -3  15 21 o 68.22624 15.03513 156.9743  132.3 ?              ?        0.96 
1 1 1 -3  17 1  o 168.0368 4.424219 308.8842  181.8 9.050323       8.848438 0.99 
1 1 1 -3  17 2  o 88.27959 7.264758 164.3978  121.8 -13.27813      14.52952 0.98 
1 1 1 -3  17 3  o 60.60086 9.620751 89.70803  110.8 -20.46957      19.24150 0.93 
1 1 1 -3  17 4  o 38.55338 10.24785 106.3301  276.8 1.169956       20.49570 0.90 
1 1 1 -3  17 5  o 35.43107 9.719538 37.81316  307.9 3.764851       19.43908 0.66 
1 1 1 -3  17 6  o 164.6589 4.059005 296.5160  152.6 -36.67604      8.118010 0.99 
1 1 1 -3  17 7  o 71.93302 7.799355 137.0403  179.0 -27.05462      15.59871 0.97 
1 1 1 -3  17 8  o 107.6423 4.675325 175.3291  302.1 14.89961       9.350650 0.99 
1 1 1 -3  17 9  o 36.95174 9.110404 47.08274  287.5 19.58676       18.22081 0.77 
1 1 1 -3  17 10 o 32.24100 8.205016 44.84724  257.1 -0.6773853     16.41003 0.74 
1 1 1 -3  17 11 o 52.65477 12.54523 117.4531  118.3 -39.85473      25.09047 0.93 
1 1 1 -3  17 12 o 53.07859 14.53308 73.16100  184.0 -8.117138      29.06615 0.87 
1 1 1 -3  17 13 o 61.64823 15.29326 99.87571  239.4 -22.58817      30.58653 0.92 
1 1 1 -3  17 14 o 51.58496 15.91915 23.75814  154.4 ?              ?        0.52 
1 1 1 -3  17 15 o 66.61892 14.34242 107.5716  148.3 ?              ?        0.94 
1 1 1 -2  0  1  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 -2  0  2  x ?        ?        9181.074  180.0 ?              ?        0.00 
1 1 1 -2  0  3  o 582.1653 10.70281 2813.398  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  4  o 961.1251 16.40911 4230.656  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  5  x ?        ?        52.34723  0.0   ?              ?        0.00 
1 1 1 -2  0  6  o 675.4581 8.970953 2181.628  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  7  o 643.6533 8.557144 995.6337  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  8  o 45.19682 3.586526 606.5338  0.0   -0.000000      0.000000 0.19 
1 1 1 -2  0  9  o 506.5756 7.149276 890.0959  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  10 o 66.17615 3.242312 429.1033  180.0 -0.000000      0.000000 0.59 
1 1 1 -2  0  11 o 87.35769 3.370850 139.6346  0.0   -0.000000      0.000000 0.01 
1 1 1 -2  0  12 o 62.12881 4.190427 121.8805  0.0   -0.000000      0.000000 0.05 
1 1 1 -2  0  13 o 76.78719 3.842923 420.7590  180.0 -0.000000      0.000000 0.71 
1 1 1 -2  0  14 o 444.4907 6.406304 1143.973  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  15 o 97.29827 4.037256 181.0799  180.0 -0.000000      0.000000 0.24 
1 1 1 -2  0  16 o 751.7132 9.670505 1020.726  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  17 o 244.5050 5.572160 471.6031  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  18 o 550.5714 7.191684 649.5764  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  19 o 360.5563 5.503975 396.7361  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  20 f 180.6754 4.288269 340.1571  0.0   -0.000000      0.000000 0.00 
1 1 1 -2  0  21 o 47.06241 12.04452 86.23916  0.0   -0.000000      0.000000 0.25 
1 1 1 -2  0  22 o 127.6639 4.822258 277.9010  360.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  23 o 197.2105 4.379621 359.1189  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  24 o 48.76945 15.22711 52.76605  180.0 -0.000000      0.000000 0.29 
1 1 1 -2  0  25 o 174.6745 7.824512 141.6723  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  26 o 176.2973 5.257241 129.8093  180.0 -0.000000      0.000000 1.00 
1 1 1 -2  0  27 o 59.64734 14.65138 18.59682  0.0   -0.000000      0.000000 0.29 
1 1 1 -2  0  28 o 41.77122 20.69171 24.87540  180.0 -0.000000      0.000000 0.33 
1 1 1 -2  0  29 o 54.44221 19.00212 101.3013  180.0 -0.000000      0.000000 0.90 
1 1 1 -2  0  30 o 34.51771 19.10953 71.03757  0.0   -0.000000      0.000000 0.56 
1 1 1 -2  0  31 o 89.98871 11.65361 128.9525  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  32 o 22.22754 15.09956 92.76684  180.0 -0.000000      0.000000 0.71 
1 1 1 -2  0  33 o 114.1681 10.77345 108.8290  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  34 o 88.69079 15.28027 122.2344  0.0   -0.000000      0.000000 1.00 
1 1 1 -2  0  35 o 28.41141 18.86761 36.59647  0.0   ?              ?        0.52 
1 1 1 -2  2  1  o 724.0447 7.751762 2397.592  256.5 -0.6270752     15.50352 0.99 
1 1 1 -2  2  2  o 440.9426 8.593017 1076.788  326.8 ?              ?        0.98 
1 1 1 -2  2  3  o 389.4142 4.834960 1493.716  228.3 -106.2509      9.669919 0.98 
1 1 1 -2  2  4  o 444.8074 4.082722 1814.859  325.6 -38.14407      8.165444 0.98 
1 1 1 -2  2  5  o 799.0764 6.752864 1499.689  103.7 14.92395       13.50573 0.99 
1 1 1 -2  2  6  o 544.3480 7.222106 426.6368  187.6 ?              ?        0.98 
1 1 1 -2  2  7  o 1109.388 9.222004 2063.951  199.8 -89.47009      18.44401 1.00 
1 1 1 -2  2  8  o 373.4593 3.758611 332.2578  29.8  -46.39554      7.517221 0.96 
1 1 1 -2  2  9  o 129.4417 2.112197 117.5939  323.0 31.32247       4.224394 0.63 
1 1 1 -2  2  10 o 474.1063 4.655724 839.3434  189.5 -28.78082      9.311447 0.98 
1 1 1 -2  2  11 o 117.0620 2.372509 213.6200  66.2  41.62268       4.745017 0.59 
1 1 1 -2  2  12 f 532.7315 4.934298 815.6898  127.3 -15.92358      9.868595 0.00 
1 1 1 -2  2  13 o 366.0688 3.762127 222.5268  88.5  11.26132       7.524254 0.93 
1 1 1 -2  2  14 o 258.5843 2.993148 449.8943  211.0 12.45052       5.986295 0.93 
1 1 1 -2  2  15 o 266.6038 3.050726 318.8388  90.6  61.05157       6.101452 0.92 
1 1 1 -2  2  16 o 432.6441 4.281370 401.9473  151.8 4.421143       8.562740 0.96 
1 1 1 -2  2  17 o 167.8861 2.957506 351.0217  250.2 -14.40192      5.915011 0.88 
1 1 1 -2  2  18 o 38.67577 7.522604 68.06860  71.0  8.059883       15.04521 0.15 
1 1 1 -2  2  19 o 294.5692 3.187994 375.2646  350.8 29.42358       6.375988 0.95 
1 1 1 -2  2  20 o 169.2943 3.070583 202.1456  178.9 10.56248       6.141165 0.88 
1 1 1 -2  2  21 o 59.23942 6.592224 58.18240  23.7  30.93758       13.18445 0.32 
1 1 1 -2  2  22 o 204.8080 3.919239 242.8900  333.6 -13.15520      7.838478 0.96 
1 1 1 -2  2  23 o 176.3501 3.977133 157.6061  187.0 -33.44237      7.954265 0.94 
1 1 1 -2  2  24 o 59.17675 7.790096 191.2618  110.8 -47.31184      15.58019 0.85 
1 1 1 -2  2  25 o 151.3788 4.071793 205.9250  38.5  -0.4125977E-01 8.143586 0.96 
1 1 1 -2  2  26 o 125.3521 4.593077 124.5538  357.9 -10.55862      9.186154 0.93 
1 1 1 -2  2  27 o 157.3101 4.228271 267.3841  101.3 22.39897       8.456542 0.98 
1 1 1 -2  2  28 o 42.64794 10.91001 55.90360  234.7 14.46282       21.82003 0.63 
1 1 1 -2  2  29 o 99.29134 6.196292 153.7688  283.1 10.96749       12.39258 0.94 
1 1 1 -2  2  30 o 92.57701 10.01867 114.2729  54.6  -18.13171      20.03734 0.91 
1 1 1 -2  2  31 o 87.66024 8.849646 95.50219  208.9 28.63997       17.69929 0.91 
1 1 1 -2  2  32 o 55.07374 12.30068 68.54963  124.1 -8.463036      24.60136 0.83 
1 1 1 -2  2  33 o 135.4287 7.899073 150.9561  262.8 -0.5778046     15.79815 0.98 
1 1 1 -2  2  34 f 47.03884 12.87453 51.73115  183.9 10.44111       25.74906 0.00 
1 1 1 -2  2  35 o 51.07319 13.16885 53.02426  210.4 ?              ?        0.82 
1 1 1 -2  4  1  o 381.1322 3.653636 740.6067  175.5 22.33783       7.307271 0.97 
1 1 1 -2  4  2  o 461.6334 5.580244 807.3795  6.0   -84.58972      11.16049 0.98 
1 1 1 -2  4  3  o 1117.038 18.82339 1370.804  88.8  ?              ?        1.00 
1 1 1 -2  4  4  o 191.5215 4.783414 245.9816  220.7 ?              ?        0.92 
1 1 1 -2  4  5  o 238.4495 3.945890 211.3508  19.7  -54.11205      7.891780 0.94 
1 1 1 -2  4  6  o 405.0876 5.831559 565.4695  82.6  37.36459       11.66312 0.98 
1 1 1 -2  4  7  o 73.69993 1.402444 372.0146  87.0  28.11457       2.804889 0.62 
1 1 1 -2  4  8  o 100.7736 2.383060 238.8370  18.7  ?              ?        0.39 
1 1 1 -2  4  9  o 430.5287 5.598676 477.6676  43.5  ?              ?        0.97 
1 1 1 -2  4  10 o 267.4122 2.761603 311.6907  169.0 75.58052       5.523205 0.90 
1 1 1 -2  4  11 o 34.14034 4.352186 429.4002  109.1 24.49172       8.704372 0.36 
1 1 1 -2  4  12 o 585.2282 6.011773 1044.600  301.9 50.75867       12.02355 0.99 
1 1 1 -2  4  13 o 538.4278 4.719504 769.3240  326.2 6.642822       9.439009 0.98 
1 1 1 -2  4  14 o 201.0349 3.116311 311.5736  97.1  69.57854       6.232623 0.90 
1 1 1 -2  4  15 o 174.2646 2.715501 130.0987  156.4 -4.905426      5.431003 0.73 
1 1 1 -2  4  16 o 546.0138 4.820776 1063.090  192.3 -8.159485      9.641553 0.99 
1 1 1 -2  4  17 o 181.5402 3.153867 191.4166  271.4 -48.91461      6.307735 0.79 
1 1 1 -2  4  18 o 295.0711 3.822352 409.1511  229.6 8.612915       7.644703 0.96 
1 1 1 -2  4  19 o 199.0058 2.818762 273.7135  235.4 -39.12158      5.637523 0.93 
1 1 1 -2  4  20 o 265.5707 3.125846 389.8571  235.7 -14.74258      6.251692 0.98 
1 1 1 -2  4  21 o 308.6187 3.515183 381.0957  115.1 -6.226532      7.030367 0.99 
1 1 1 -2  4  22 o 119.4080 5.387026 190.1902  156.5 -1.264114      10.77405 0.92 
1 1 1 -2  4  23 o 270.0366 3.491028 467.2371  272.7 -25.30719      6.982056 0.99 
1 1 1 -2  4  24 o 172.7429 3.859336 329.3510  64.5  27.38585       7.718673 0.98 
1 1 1 -2  4  25 o 100.8305 5.317657 107.3740  4.8   -22.85709      10.63531 0.90 
1 1 1 -2  4  26 o 97.74549 6.259579 192.4441  324.2 -56.51660      12.51916 0.95 
1 1 1 -2  4  27 o 43.60350 9.657372 58.69516  148.6 28.86774       19.31474 0.69 
1 1 1 -2  4  28 o 46.12430 10.91784 58.05727  244.6 -4.275494      21.83569 0.60 
1 1 1 -2  4  29 o 30.68217 9.817154 51.16963  328.2 0.3049469E-01  19.63431 0.41 
1 1 1 -2  4  30 o 68.69724 10.41080 81.53818  103.4 23.26052       20.82161 0.85 
1 1 1 -2  4  31 o 52.85908 12.18788 18.95124  243.6 11.65185       24.37576 0.38 
1 1 1 -2  4  32 o 151.9053 5.547544 208.7999  162.6 5.082138       11.09509 0.99 
1 1 1 -2  4  33 o 41.23267 11.79505 85.50783  221.1 -10.01185      23.59010 0.85 
1 1 1 -2  4  34 o 43.06248 12.29189 48.36929  243.0 -16.78345      24.58377 0.75 
1 1 1 -2  6  1  o 207.2455 2.556400 259.1788  316.7 38.55666       5.112800 0.86 
1 1 1 -2  6  2  o 121.1629 2.053641 343.8674  167.0 -14.60567      4.107282 0.70 
1 1 1 -2  6  3  o 469.5602 4.279695 360.8680  309.7 11.77060       8.559389 0.97 
1 1 1 -2  6  4  o 441.8170 3.954855 834.1395  336.5 -44.05127      7.909711 0.98 
1 1 1 -2  6  5  o 340.2755 7.031367 712.6222  96.5  ?              ?        0.96 
1 1 1 -2  6  6  o 229.3136 4.048217 592.3293  72.3  -6.830170      8.096434 0.93 
1 1 1 -2  6  7  o 402.2463 5.660597 840.4243  56.1  -11.31284      11.32119 0.98 
1 1 1 -2  6  8  o 414.3380 5.395551 616.0851  89.3  12.89819       10.79110 0.97 
1 1 1 -2  6  9  o 671.2164 8.378201 728.1385  50.7  49.57025       16.75640 0.99 
1 1 1 -2  6  10 o 600.8130 5.936032 968.0756  151.5 73.98816       11.87206 0.99 
1 1 1 -2  6  11 o 372.4564 3.068508 552.7773  10.5  19.34360       6.137016 0.97 
1 1 1 -2  6  12 o 487.9180 4.246359 759.3658  24.7  62.12418       8.492719 0.98 
1 1 1 -2  6  13 o 387.1483 3.565885 471.4887  245.8 6.613647       7.131770 0.96 
1 1 1 -2  6  14 f 881.2070 7.190413 1571.788  96.8  -22.17468      14.38083 0.00 
1 1 1 -2  6  15 o 603.1741 5.307381 934.6688  96.8  -10.11249      10.61476 0.99 
1 1 1 -2  6  16 o 433.4129 4.019491 636.7912  204.8 -7.258667      8.038982 0.98 
1 1 1 -2  6  17 o 208.6104 2.818585 160.4684  269.8 32.88246       5.637169 0.90 
1 1 1 -2  6  18 o 209.6360 3.016315 273.2459  342.1 -6.746201      6.032630 0.96 
1 1 1 -2  6  19 o 128.9104 3.029203 168.4979  195.0 -24.39258      6.058405 0.92 
1 1 1 -2  6  20 o 143.6489 3.167959 147.0821  272.2 -18.30959      6.335918 0.92 
1 1 1 -2  6  21 o 86.02123 4.804393 102.6792  45.7  -36.00374      9.608786 0.79 
1 1 1 -2  6  22 o 51.46789 8.660455 172.0730  222.3 10.98126       17.32091 0.84 
1 1 1 -2  6  23 o 110.7545 4.629251 152.0500  96.9  5.913528       9.258501 0.94 
1 1 1 -2  6  24 o 173.4399 3.326161 257.2788  101.8 -8.088074      6.652322 0.98 
1 1 1 -2  6  25 o 98.11636 5.646430 218.2594  184.6 17.94016       11.29286 0.97 
1 1 1 -2  6  26 o 139.6512 4.789584 244.9018  140.1 33.00891       9.579167 0.98 
1 1 1 -2  6  27 o 204.2926 4.797745 221.0892  255.0 9.088364       9.595490 0.98 
1 1 1 -2  6  28 o 112.6829 6.422352 171.3154  265.6 -9.759918      12.84470 0.96 
1 1 1 -2  6  29 o 85.77708 9.408488 189.6618  243.3 40.22799       18.81698 0.96 
1 1 1 -2  6  30 o 150.4135 5.227125 171.2140  187.6 31.52365       10.45425 0.98 
1 1 1 -2  6  31 o 147.7279 5.851177 190.8260  178.5 16.10439       11.70235 0.99 
1 1 1 -2  6  32 o 42.87693 11.65955 18.93522  186.8 26.47352       23.31910 0.40 
1 1 1 -2  6  33 o 66.42784 12.57730 114.3730  26.2  0.8132629      25.15460 0.94 
1 1 1 -2  8  1  o 188.0143 2.552447 315.6971  68.9  30.21764       5.104894 0.84 
1 1 1 -2  8  2  o 466.7788 4.424222 773.7584  300.8 -37.67200      8.848445 0.98 
1 1 1 -2  8  3  o 532.9114 4.784183 851.7835  9.5   -59.76852      9.568365 0.99 
1 1 1 -2  8  4  o 379.9159 3.633583 553.0861  147.7 11.59485       7.267167 0.97 
1 1 1 -2  8  5  o 368.9664 3.435135 676.5428  50.5  17.81180       6.870269 0.97 
1 1 1 -2  8  6  o 293.6070 2.806205 197.9522  71.1  11.71216       5.612410 0.91 
1 1 1 -2  8  7  o 507.4872 6.134244 872.0212  160.9 ?              ?        0.99 
1 1 1 -2  8  8  o 295.8059 4.491299 447.0104  190.8 59.54962       8.982597 0.95 
1 1 1 -2  8  9  o 221.7249 4.125504 339.4032  202.0 35.83078       8.251007 0.90 
1 1 1 -2  8  10 f 90.17682 6.461340 347.2831  170.8 30.12542       12.92268 0.00 
1 1 1 -2  8  11 o 49.68839 9.988536 95.84217  26.0  -11.28875      19.97707 0.24 
1 1 1 -2  8  12 o 376.0219 5.461385 650.9763  341.8 -91.14853      10.92277 0.98 
1 1 1 -2  8  13 o 103.1275 5.949582 216.7785  104.0 -6.160851      11.89916 0.81 
1 1 1 -2  8  14 o 291.2479 4.191258 453.4533  172.1 -1.570740      8.382516 0.98 
1 1 1 -2  8  15 o 64.18551 3.381484 107.3704  318.9 -13.08737      6.762969 0.61 
1 1 1 -2  8  16 o 166.0848 2.380665 327.8019  349.9 -32.95671      4.761330 0.97 
1 1 1 -2  8  17 o 187.0927 2.511067 400.9480  296.3 3.055191       5.022134 0.98 
1 1 1 -2  8  18 o 94.06566 3.883616 98.96608  156.7 27.92430       7.767231 0.83 
1 1 1 -2  8  19 o 196.2270 2.883639 226.3889  78.8  8.419083       5.767279 0.97 
1 1 1 -2  8  20 o 246.9284 3.288731 374.8123  109.2 -19.91905      6.577462 0.99 
1 1 1 -2  8  21 o 89.55580 4.563246 122.5721  160.1 -24.35281      9.126493 0.91 
1 1 1 -2  8  22 o 211.7113 3.285671 310.0093  7.9   6.871201       6.571341 0.99 
1 1 1 -2  8  23 o 141.9989 3.839259 258.4651  268.1 0.1895447      7.678519 0.98 
1 1 1 -2  8  24 o 59.63387 9.036616 118.5148  239.3 -11.80529      18.07323 0.90 
1 1 1 -2  8  25 o 27.02880 8.794513 68.17680  348.2 5.713305       17.58903 0.47 
1 1 1 -2  8  26 f 116.7187 5.614819 62.02316  127.2 2.919525       11.22964 0.00 
1 1 1 -2  8  27 o 39.99472 10.46682 88.14436  257.8 -20.49170      20.93365 0.76 
1 1 1 -2  8  28 o 61.45269 10.02748 110.8121  159.6 38.72633       20.05496 0.91 
1 1 1 -2  8  29 o 50.43929 12.03104 97.53062  352.7 -2.905289      24.06209 0.90 
1 1 1 -2  8  30 o 31.24588 10.13944 32.93673  359.8 -4.241262      20.27888 0.52 
1 1 1 -2  8  31 o 53.59359 12.44048 91.89024  182.9 -14.63085      24.88096 0.90 
1 1 1 -2  8  32 o 37.64581 11.56337 59.63235  160.0 ?              ?        0.81 
1 1 1 -2  10 1  o 300.8159 3.272823 639.0470  100.3 14.71704       6.545645 0.97 
1 1 1 -2  10 2  o 331.7525 3.421910 422.9917  194.9 -0.1893005     6.843820 0.97 
1 1 1 -2  10 3  o 571.5925 5.215987 697.1995  210.1 -2.816589      10.43197 0.99 
1 1 1 -2  10 4  o 89.25980 4.172832 87.19134  259.5 -38.29126      8.345665 0.30 
1 1 1 -2  10 5  o 222.2000 2.745811 286.9443  124.8 -28.12166      5.491621 0.94 
1 1 1 -2  10 6  o 90.90364 2.811832 227.5383  167.1 -2.760445      5.623664 0.79 
1 1 1 -2  10 7  o 128.4211 2.103221 151.8016  295.3 13.14725       4.206442 0.80 
1 1 1 -2  10 8  o 152.9231 3.416333 327.1101  314.0 22.27589       6.832667 0.94 
1 1 1 -2  10 9  o 252.0087 4.728305 502.7104  153.8 -88.51418      9.456611 0.98 
1 1 1 -2  10 10 o 277.0590 4.721035 489.1984  106.1 -12.01077      9.442069 0.98 
1 1 1 -2  10 11 o 378.4877 5.794355 731.6285  132.3 -10.53506      11.58871 0.99 
1 1 1 -2  10 12 o 252.2584 4.550102 470.6125  195.5 -0.7023926     9.100204 0.99 
1 1 1 -2  10 13 o 73.59657 8.986808 109.3018  225.9 -33.71125      17.97362 0.79 
1 1 1 -2  10 14 o 54.40622 12.13872 78.97248  33.3  11.04844       24.27744 0.54 
1 1 1 -2  10 15 o 65.16323 10.74905 140.0165  218.1 0.7658997      21.49810 0.83 
1 1 1 -2  10 16 o 246.7153 4.946350 385.5758  279.7 6.205750       9.892699 0.99 
1 1 1 -2  10 17 o 170.6085 5.871412 281.5211  336.1 -38.12059      11.74282 0.98 
1 1 1 -2  10 18 o 104.9226 8.686009 142.6243  62.5  -10.43266      17.37202 0.94 
1 1 1 -2  10 19 f 83.39095 5.598844 151.7031  204.7 -11.17928      11.19769 0.00 
1 1 1 -2  10 20 o 78.57436 7.738260 43.15327  300.5 1.234131       15.47652 0.77 
1 1 1 -2  10 21 o 77.26924 5.629134 110.5075  319.7 10.17876       11.25827 0.93 
1 1 1 -2  10 22 o 83.16145 5.253366 130.6497  347.5 -17.69209      10.50673 0.93 
1 1 1 -2  10 23 o 59.98920 8.323294 107.0257  110.3 22.27139       16.64659 0.86 
1 1 1 -2  10 24 o 186.0616 3.541696 270.9038  346.1 -10.63474      7.083392 0.99 
1 1 1 -2  10 25 o 183.3664 3.717818 304.0051  320.8 2.403030       7.435636 0.99 
1 1 1 -2  10 26 o 123.7610 5.112694 193.8293  278.7 8.775406       10.22539 0.98 
1 1 1 -2  10 27 o 79.39650 8.941319 167.9521  322.1 11.70840       17.88264 0.97 
1 1 1 -2  10 28 o 37.61276 10.92534 64.67692  38.9  -2.925014      21.85067 0.80 
1 1 1 -2  10 29 o 54.29786 10.73114 105.5799  61.4  -24.37637      21.46228 0.93 
1 1 1 -2  10 30 o 50.63522 11.23275 67.84187  328.9 ?              ?        0.89 
1 1 1 -2  12 1  o 119.8684 3.224317 304.4249  79.1  11.43196       6.448633 0.96 
1 1 1 -2  12 2  o 95.33410 4.344768 124.4269  12.4  -16.57532      8.689535 0.88 
1 1 1 -2  12 3  o 173.5578 2.881179 383.6845  313.6 -4.402908      5.762358 0.98 
1 1 1 -2  12 4  o 255.2952 3.166863 397.2554  305.4 -15.40877      6.333726 0.99 
1 1 1 -2  12 5  o 77.25865 3.786346 163.2728  261.4 6.941742       7.572691 0.88 
1 1 1 -2  12 6  o 108.2476 3.130141 86.65005  195.9 -10.86123      6.260283 0.81 
1 1 1 -2  12 7  o 145.8421 2.476846 327.5316  176.5 15.55275       4.953692 0.97 
1 1 1 -2  12 8  o 96.92999 2.932545 119.4717  15.1  -2.691170      5.865090 0.89 
1 1 1 -2  12 9  o 230.3312 4.093118 384.8818  330.9 29.96880       8.186236 0.99 
1 1 1 -2  12 10 o 186.6017 5.057931 347.8412  305.6 8.056244       10.11586 0.98 
1 1 1 -2  12 11 o 129.1713 8.676064 241.6141  263.2 ?              ?        0.97 
1 1 1 -2  12 12 o 97.95331 8.442842 260.0304  66.8  -2.143883      16.88568 0.96 
1 1 1 -2  12 13 o 76.02222 10.92640 162.6569  156.2 3.221489       21.85279 0.92 
1 1 1 -2  12 14 o 149.3639 6.624139 318.4297  250.1 22.17278       13.24828 0.98 
1 1 1 -2  12 15 o 149.3359 6.456994 244.7052  194.2 15.10359       12.91399 0.98 
1 1 1 -2  12 16 o 140.3489 7.476657 280.7061  151.5 -17.74031      14.95331 0.99 
1 1 1 -2  12 17 o 134.1092 8.073671 208.1241  127.6 -18.86599      16.14734 0.98 
1 1 1 -2  12 18 o 111.7309 11.10343 173.5206  64.2  -61.14905      22.20686 0.96 
1 1 1 -2  12 19 o 41.93102 12.40653 26.79310  84.1  6.810829       24.81306 0.32 
1 1 1 -2  12 20 o 50.06529 13.21410 93.51008  148.8 31.77190       26.42821 0.81 
1 1 1 -2  12 21 o 53.46599 14.12285 57.15916  160.2 26.96911       28.24570 0.71 
1 1 1 -2  12 22 o 78.40570 15.50613 185.0331  249.1 16.43457       31.01225 0.95 
1 1 1 -2  12 23 o 56.51034 14.91116 130.2291  269.9 28.87301       29.82231 0.92 
1 1 1 -2  12 24 o 46.84432 14.13685 94.16434  278.0 -0.8347244     28.27370 0.88 
1 1 1 -2  12 25 o 52.22319 14.58478 79.79189  296.7 -15.25613      29.16955 0.87 
1 1 1 -2  12 26 o 51.39678 10.03316 64.51276  290.0 4.139332       20.06631 0.88 
1 1 1 -2  12 27 o 40.03815 10.86215 37.50466  263.7 ?              ?        0.72 
1 1 1 -2  14 1  o 101.9580 4.459526 221.0477  111.9 -7.877426      8.919052 0.97 
1 1 1 -2  14 2  o 119.1214 4.062696 160.7322  223.3 -5.444450      8.125391 0.96 
1 1 1 -2  14 3  o 103.7280 4.162249 159.0653  166.9 -3.124733      8.324498 0.96 
1 1 1 -2  14 4  o 99.27550 4.165938 192.1755  334.5 -3.619514      8.331877 0.96 
1 1 1 -2  14 5  o 209.3425 3.320361 388.7206  8.8   -31.34677      6.640722 0.99 
1 1 1 -2  14 6  o 152.0274 3.326229 171.5813  29.5  -20.85982      6.652457 0.98 
1 1 1 -2  14 7  o 87.13187 3.826586 108.9207  192.4 39.98690       7.653172 0.94 
1 1 1 -2  14 8  o 238.3590 2.931872 412.9543  306.0 -9.757187      5.863745 0.99 
1 1 1 -2  14 9  o 133.7399 2.989974 247.0964  319.0 -35.80389      5.979949 0.99 
1 1 1 -2  14 10 o 45.25838 12.95200 53.40296  355.9 26.50972       25.90400 0.67 
1 1 1 -2  14 11 o 124.8696 8.003242 181.0831  267.5 9.549133       16.00648 0.97 
1 1 1 -2  14 12 o 99.32266 10.72517 229.6566  240.4 -10.12426      21.45035 0.97 
1 1 1 -2  14 13 o 127.8183 12.59516 180.2799  203.3 ?              ?        0.96 
1 1 1 -2  14 14 o 118.1871 9.236048 267.8880  78.1  22.36785       18.47210 0.98 
1 1 1 -2  14 15 o 175.2699 7.198491 336.4622  15.6  -17.71809      14.39698 0.99 
1 1 1 -2  14 16 o 64.25102 13.95744 118.3130  359.6 37.12764       27.91488 0.90 
1 1 1 -2  14 17 o 54.02155 14.41907 53.59470  315.8 11.77811       28.83813 0.74 
1 1 1 -2  14 18 f 155.0359 11.58877 181.9386  258.7 ?              ?        0.00 
1 1 1 -2  14 19 o 72.94876 14.42123 133.6239  191.3 9.244400       28.84246 0.95 
1 1 1 -2  14 20 o 127.1060 10.74038 207.9090  48.3  9.589073       21.48076 0.99 
1 1 1 -2  14 21 o 52.59272 12.74356 94.36983  263.3 -38.30669      25.48711 0.91 
1 1 1 -2  14 22 o 66.91661 12.79415 166.5913  237.6 -56.30405      25.58829 0.96 
1 1 1 -2  14 23 o 41.05999 13.48092 80.25248  256.9 ?              ?        0.86 
1 1 1 -2  16 1  o 93.81493 6.158313 109.2929  285.2 3.453285       12.31663 0.94 
1 1 1 -2  16 2  o 140.3045 4.441921 192.4882  303.6 -1.827148      8.883842 0.98 
1 1 1 -2  16 3  o 38.62245 10.25628 67.46448  144.5 9.763046       20.51255 0.71 
1 1 1 -2  16 4  o 101.8134 4.701303 230.6513  102.7 3.797821       9.402607 0.98 
1 1 1 -2  16 5  o 95.68298 5.160163 138.3451  114.2 30.57892       10.32033 0.96 
1 1 1 -2  16 6  o 67.81221 7.374357 202.6998  194.3 -14.52718      14.74871 0.96 
1 1 1 -2  16 7  o 58.24741 8.059144 184.4705  230.6 -6.982029      16.11829 0.95 
1 1 1 -2  16 8  o 83.00316 5.629295 140.4247  86.1  -4.603951      11.25859 0.96 
1 1 1 -2  16 9  o 183.2018 3.324466 383.4982  70.0  -1.132614      6.648932 0.99 
1 1 1 -2  16 10 o 20.15595 6.582555 67.28432  356.6 -4.171000      13.16511 0.65 
1 1 1 -2  16 11 o 126.4219 10.01360 273.7246  228.1 -0.4445343     20.02721 0.99 
1 1 1 -2  16 12 o 56.25827 12.33104 121.3985  240.4 -39.73502      24.66208 0.93 
1 1 1 -2  16 13 o 44.27787 13.85171 126.7589  349.1 12.02525       27.70343 0.92 
1 1 1 -2  16 14 o 42.67642 13.99402 33.67635  231.6 13.12441       27.98804 0.61 
1 1 1 -2  16 15 o 77.96767 14.10195 177.0527  191.7 -26.41169      28.20390 0.97 
1 1 1 -2  16 16 o 67.50518 15.80578 131.8286  174.0 29.93517       31.61157 0.94 
1 1 1 -2  16 17 o 42.63576 13.57742 81.74291  175.4 -1.550213      27.15483 0.87 
1 1 1 -2  16 18 o 57.13326 15.64712 62.10200  234.1 ?              ?        0.85 
1 1 1 -2  18 1  o 137.1771 5.466149 287.7561  237.8 -4.161331      10.93230 0.99 
1 1 1 -2  18 2  o 96.96359 10.83987 260.5051  249.7 1.498848       21.67974 0.99 
1 1 1 -2  18 3  o 29.22894 9.329318 36.59708  66.3  2.067587       18.65864 0.63 
1 1 1 -2  18 4  o 53.77435 10.15527 100.9101  70.6  -9.216499      20.31054 0.93 
1 1 1 -2  18 5  o 41.20637 10.17114 88.37979  243.2 2.069904       20.34228 0.90 
1 1 1 -2  18 6  o 94.23897 6.164351 218.0525  224.9 8.301636       12.32870 0.99 
1 1 1 -2  18 7  o 38.91008 9.959130 32.08254  30.7  9.846779       19.91826 0.69 
1 1 1 -2  18 8  o 85.71230 7.000821 198.9451  33.7  ?              ?        0.98 
1 1 1 -2  18 9  o 33.73960 9.450677 119.9852  29.0  ?              ?        0.92 
1 1 1 -2  18 10 x ?        ?        46.18176  229.8 ?              ?        0.00 
1 1 1 -1  1  1  o 62.55515 2.559337 1372.477  95.8  ?              ?        0.52 
1 1 1 -1  1  2  o 610.6104 7.946063 1929.503  335.5 156.9810       15.89213 0.99 
1 1 1 -1  1  3  o 334.9823 4.593486 1301.311  76.5  ?              ?        0.98 
1 1 1 -1  1  4  o 585.4624 5.289322 387.4024  142.2 111.4640       10.57864 0.99 
1 1 1 -1  1  5  o 295.5742 3.170690 931.7498  356.2 2.253845       6.341379 0.96 
1 1 1 -1  1  6  o 871.1153 7.637722 1703.153  7.0   80.57776       15.27544 1.00 
1 1 1 -1  1  7  o 164.8363 2.398469 360.5107  269.3 53.24580       4.796939 0.90 
1 1 1 -1  1  8  o 301.3246 3.423850 256.3921  47.1  -12.83725      6.847700 0.93 
1 1 1 -1  1  9  o 166.7657 2.450222 54.66201  167.2 -70.04234      4.900443 0.45 
1 1 1 -1  1  10 o 506.2035 5.056151 930.5760  182.8 -17.30463      10.11230 0.98 
1 1 1 -1  1  11 o 52.38300 3.322544 155.7014  109.5 38.85835       6.645088 0.18 
1 1 1 -1  1  12 o 463.1354 4.495165 692.6890  347.4 6.786316       8.990330 0.97 
1 1 1 -1  1  13 o 427.0938 4.278868 844.2678  154.8 -86.49243      8.557736 0.97 
1 1 1 -1  1  14 o 807.5555 7.117567 788.1355  161.5 -63.95209      14.23513 0.99 
1 1 1 -1  1  15 o 129.6689 2.692060 60.69045  200.2 -1.850159      5.384119 0.37 
1 1 1 -1  1  16 o 567.0811 5.336788 722.9666  130.8 0.8666382      10.67358 0.98 
1 1 1 -1  1  17 o 455.7782 4.380200 561.9463  218.8 19.87534       8.760401 0.97 
1 1 1 -1  1  18 o 91.20676 6.622490 252.8530  213.8 -54.15041      13.24498 0.66 
1 1 1 -1  1  19 o 340.5150 3.638756 421.6049  333.2 18.39749       7.277511 0.96 
1 1 1 -1  1  20 o 112.8179 3.544964 274.4804  146.3 0.2191544      7.089928 0.86 
1 1 1 -1  1  21 o 94.61395 4.203291 113.9531  137.3 7.435547       8.406582 0.70 
1 1 1 -1  1  22 o 227.3267 3.967584 241.6770  342.2 1.237045       7.935167 0.97 
1 1 1 -1  1  23 o 155.1833 3.694221 322.2841  66.5  -1.247253      7.388442 0.97 
1 1 1 -1  1  24 o 71.52357 6.912975 106.7830  53.1  -29.67155      13.82595 0.76 
1 1 1 -1  1  25 o 163.4729 3.914015 216.8065  358.1 20.58348       7.828029 0.97 
1 1 1 -1  1  26 o 142.5016 3.989891 184.5916  112.7 17.60077       7.979782 0.96 
1 1 1 -1  1  27 o 136.3792 5.893962 169.5716  185.9 15.48233       11.78792 0.96 
1 1 1 -1  1  28 o 47.61810 9.204586 73.56914  287.6 44.03286       18.40917 0.77 
1 1 1 -1  1  29 o 71.10361 9.556045 139.4987  117.3 -39.99681      19.11209 0.90 
1 1 1 -1  1  30 o 71.80470 10.00678 103.6679  170.5 38.59446       20.01356 0.87 
1 1 1 -1  1  31 o 90.36254 8.438409 146.6504  154.0 15.95590       16.87682 0.95 
1 1 1 -1  1  32 o 44.36680 11.67081 53.19742  102.0 -23.49665      23.34162 0.71 
1 1 1 -1  1  33 o 138.4411 6.391683 162.7126  314.1 -21.36396      12.78337 0.98 
1 1 1 -1  1  34 o 95.04576 10.26500 134.0669  55.7  -8.006119      20.52999 0.96 
1 1 1 -1  1  35 o 33.03732 10.78655 56.78937  119.0 ?              ?        0.75 
1 1 1 -1  3  1  o 672.3488 7.339571 1402.215  14.9  -35.16956      14.67914 0.99 
1 1 1 -1  3  2  o 455.6705 5.522778 565.7438  222.7 -100.6752      11.04556 0.98 
1 1 1 -1  3  3  o 917.7338 9.649169 1862.537  277.3 -63.10486      19.29834 0.99 
1 1 1 -1  3  4  o 414.5114 5.937160 580.3534  260.2 39.80371       11.87432 0.97 
1 1 1 -1  3  5  o 945.9975 16.37858 1413.912  74.8  ?              ?        1.00 
1 1 1 -1  3  6  o 496.3646 4.388163 1214.630  56.3  64.36035       8.776326 0.98 
1 1 1 -1  3  7  f 354.9955 3.525590 455.6292  123.6 2.828674       7.051179 0.00 
1 1 1 -1  3  8  o 242.6299 2.617040 261.6708  226.4 14.35730       5.234080 0.95 
1 1 1 -1  3  9  o 379.7177 3.724937 701.5590  43.5  27.38654       7.449875 0.98 
1 1 1 -1  3  10 f 444.6875 4.209090 871.8323  189.3 48.94312       8.418180 0.00 
1 1 1 -1  3  11 o 237.3175 2.645916 357.2467  190.4 42.78027       5.291831 0.93 
1 1 1 -1  3  12 o 587.6503 5.217351 776.1810  323.3 18.95776       10.43470 0.99 
1 1 1 -1  3  13 o 694.2749 5.941412 1229.067  8.1   28.41461       11.88282 0.99 
1 1 1 -1  3  14 o 258.4264 2.812828 373.4060  312.6 6.747818       5.625655 0.91 
1 1 1 -1  3  15 o 493.5089 4.463486 674.5375  127.4 65.37717       8.926971 0.98 
1 1 1 -1  3  16 o 385.9398 4.652693 463.4952  190.0 6.532227       9.305387 0.96 
1 1 1 -1  3  17 o 179.8849 3.418236 430.2797  263.9 -12.84891      6.836471 0.92 
1 1 1 -1  3  18 o 164.2797 3.005357 367.8850  15.7  27.22809       6.010714 0.91 
1 1 1 -1  3  19 o 348.9311 3.568196 481.8083  148.0 39.99207       7.136392 0.97 
1 1 1 -1  3  20 o 274.9103 3.305548 355.0553  167.0 15.37152       6.611097 0.97 
1 1 1 -1  3  21 o 257.5822 4.454430 380.2849  22.2  ?              ?        0.98 
1 1 1 -1  3  22 o 415.5543 4.214855 596.1632  49.6  20.97299       8.429710 0.99 
1 1 1 -1  3  23 o 247.4667 4.826115 320.5040  123.3 19.56180       9.652230 0.98 
1 1 1 -1  3  24 o 260.3041 3.601199 377.2913  51.5  18.22633       7.202398 0.99 
1 1 1 -1  3  25 o 257.8735 3.573431 341.4191  10.6  5.786896       7.146861 0.99 
1 1 1 -1  3  26 o 77.27480 7.293934 90.90089  76.4  -11.89310      14.58787 0.85 
1 1 1 -1  3  27 o 91.86460 6.563127 85.72263  55.7  12.58356       13.12625 0.91 
1 1 1 -1  3  28 o 265.6334 4.289430 295.0569  33.2  -1.156647      8.578860 0.99 
1 1 1 -1  3  29 o 300.2140 4.476632 359.0139  45.4  11.78098       8.953263 0.99 
1 1 1 -1  3  30 o 51.72308 11.79776 44.19712  96.6  6.763481       23.59552 0.56 
1 1 1 -1  3  31 o 131.1325 6.814575 135.8936  163.3 -18.87093      13.62915 0.97 
1 1 1 -1  3  32 o 76.78922 12.32417 156.1075  110.4 53.95914       24.64833 0.96 
1 1 1 -1  3  33 o 149.1203 6.602996 169.8879  277.8 6.679062       13.20599 0.98 
1 1 1 -1  3  34 o 64.82448 12.47544 73.31416  149.0 0.4845657      24.95088 0.90 
1 1 1 -1  3  35 x ?        ?        62.37813  105.0 ?              ?        0.00 
1 1 1 -1  5  1  o 244.1744 2.705879 388.4296  92.8  -12.12750      5.411758 0.93 
1 1 1 -1  5  2  o 178.6671 2.239447 201.9639  23.4  -18.51572      4.478895 0.73 
1 1 1 -1  5  3  o 93.52736 3.708891 256.3934  331.8 ?              ?        0.52 
1 1 1 -1  5  4  o 54.24517 3.008118 285.2515  213.3 15.75760       6.016236 0.51 
1 1 1 -1  5  5  o 467.9065 8.763145 679.5222  56.2  ?              ?        0.98 
1 1 1 -1  5  6  o 143.4921 3.346059 376.1117  165.3 19.92154       6.692118 0.84 
1 1 1 -1  5  7  o 190.1646 3.752831 282.4776  290.6 -9.152969      7.505662 0.68 
1 1 1 -1  5  8  o 331.4558 3.957282 470.1043  234.8 -31.87219      7.914563 0.93 
1 1 1 -1  5  9  o 339.6033 3.021682 508.8143  128.2 -71.07114      6.043365 0.97 
1 1 1 -1  5  10 o 280.6531 2.766540 406.2056  233.0 23.95175       5.533081 0.94 
1 1 1 -1  5  11 o 163.3579 2.229624 435.0014  281.9 34.40504       4.459248 0.78 
1 1 1 -1  5  12 o 442.2917 3.972341 672.3618  6.4   100.7470       7.944681 0.98 
1 1 1 -1  5  13 o 526.1470 4.715090 721.1782  129.1 -55.81564      9.430180 0.98 
1 1 1 -1  5  14 o 499.3917 4.458435 593.1493  127.2 16.37393       8.916870 0.98 
1 1 1 -1  5  15 o 314.7106 4.244219 341.8036  326.1 42.89502       8.488439 0.94 
1 1 1 -1  5  16 o 646.9049 5.686935 1108.409  197.5 -18.89392      11.37387 0.99 
1 1 1 -1  5  17 o 196.5878 2.959618 239.2433  27.7  4.839508       5.919235 0.87 
1 1 1 -1  5  18 o 228.9162 3.008135 205.7775  14.4  17.57976       6.016270 0.93 
1 1 1 -1  5  19 o 164.5073 2.829214 203.9040  61.4  -22.40703      5.658428 0.92 
1 1 1 -1  5  20 o 77.12442 5.460855 86.67982  35.7  -5.129616      10.92171 0.72 
1 1 1 -1  5  21 o 142.2741 3.495473 242.4518  116.6 -8.715378      6.990945 0.95 
1 1 1 -1  5  22 o 133.2229 3.594412 224.1905  207.7 -4.897903      7.188823 0.95 
1 1 1 -1  5  23 o 87.09703 7.869288 45.29101  214.6 12.64821       15.73858 0.62 
1 1 1 -1  5  24 o 138.4557 4.113164 236.1425  154.8 13.49216       8.226329 0.97 
1 1 1 -1  5  25 o 99.40008 5.695899 154.7225  126.6 5.849350       11.39180 0.94 
1 1 1 -1  5  26 o 309.2734 4.067019 368.9844  114.6 -6.059509      8.134037 0.99 
1 1 1 -1  5  27 o 109.1491 6.141022 133.4367  121.7 5.440826       12.28204 0.95 
1 1 1 -1  5  28 o 68.96141 9.697721 97.45470  346.3 39.00129       19.39544 0.85 
1 1 1 -1  5  29 o 53.94375 11.57827 88.51044  227.8 -17.50870      23.15654 0.80 
1 1 1 -1  5  30 o 60.02607 11.67290 57.41349  133.6 -2.060394      23.34581 0.78 
1 1 1 -1  5  31 o 92.70891 12.23256 121.9499  206.8 -25.54408      24.46513 0.95 
1 1 1 -1  5  32 o 87.39161 10.36870 170.4409  189.4 23.62018       20.73741 0.97 
1 1 1 -1  5  33 o 35.13171 11.08299 32.79289  192.0 2.808144       22.16597 0.55 
1 1 1 -1  5  34 o 40.49886 12.17926 58.52760  85.1  ?              ?        0.81 
1 1 1 -1  7  1  o 248.1891 2.813696 467.0269  322.2 -17.34117      5.627392 0.93 
1 1 1 -1  7  2  o 359.2081 3.546654 642.2950  116.4 -7.009918      7.093307 0.97 
1 1 1 -1  7  3  o 396.3015 3.848560 848.1998  344.8 -12.45038      7.697120 0.98 
1 1 1 -1  7  4  o 318.7181 4.269755 720.2709  219.5 ?              ?        0.96 
1 1 1 -1  7  5  o 895.5073 10.27991 1294.495  184.4 ?              ?        0.99 
1 1 1 -1  7  6  o 772.8711 7.948999 1155.014  73.8  -13.14038      15.89800 0.99 
1 1 1 -1  7  7  o 814.4657 9.804531 1244.588  128.6 -13.12866      19.60906 0.99 
1 1 1 -1  7  8  o 381.1503 5.016891 444.0161  226.8 12.60577       10.03378 0.96 
1 1 1 -1  7  9  o 428.9965 5.951970 517.9937  323.1 -19.83212      11.90394 0.98 
1 1 1 -1  7  10 o 102.9850 6.321490 245.1736  131.9 -20.38244      12.64298 0.55 
1 1 1 -1  7  11 o 255.1245 3.079975 612.5407  152.0 45.52815       6.159949 0.96 
1 1 1 -1  7  12 o 346.3337 3.832093 434.1201  339.0 -13.74915      7.664186 0.96 
1 1 1 -1  7  13 f 317.4226 2.863592 380.0771  311.1 -15.43796      5.727183 0.00 
1 1 1 -1  7  14 o 338.9071 2.984546 506.2445  52.4  8.946716       5.969092 0.97 
1 1 1 -1  7  15 o 425.6828 3.617570 804.6146  12.8  -18.06396      7.235139 0.99 
1 1 1 -1  7  16 o 343.3576 3.093027 571.2543  5.4   -17.33115      6.186055 0.99 
1 1 1 -1  7  17 o 60.24287 5.350348 39.34348  32.6  -15.74030      10.70070 0.33 
1 1 1 -1  7  18 o 161.6765 2.938629 174.5220  114.7 38.43753       5.877258 0.94 
1 1 1 -1  7  19 o 65.36560 5.640159 67.29433  243.7 -16.48162      11.28032 0.58 
1 1 1 -1  7  20 o 103.0266 4.596074 201.3182  247.8 31.82185       9.192147 0.93 
1 1 1 -1  7  21 o 35.91892 8.702742 138.9869  315.5 -1.336349      17.40548 0.72 
1 1 1 -1  7  22 o 71.19989 6.321772 169.1962  85.9  -8.898979      12.64354 0.91 
1 1 1 -1  7  23 o 223.9245 3.623171 385.4512  89.9  -1.532211      7.246342 0.99 
1 1 1 -1  7  24 o 80.96201 6.616696 102.9379  13.6  -3.489914      13.23339 0.91 
1 1 1 -1  7  25 o 134.5898 4.511415 183.8160  338.0 5.603897       9.022830 0.97 
1 1 1 -1  7  26 o 141.7547 4.887283 183.8505  115.7 5.403976       9.774566 0.97 
1 1 1 -1  7  27 o 94.14676 7.979835 149.8635  217.0 48.18027       15.95967 0.94 
1 1 1 -1  7  28 o 144.6392 5.847156 196.1829  225.1 9.842209       11.69431 0.98 
1 1 1 -1  7  29 o 103.5194 7.677488 105.7877  255.1 26.61165       15.35498 0.95 
1 1 1 -1  7  30 o 43.31333 11.91947 36.30327  336.3 -10.41005      23.83893 0.65 
1 1 1 -1  7  31 o 148.1766 5.608970 168.4686  194.7 12.88174       11.21794 0.98 
1 1 1 -1  7  32 o 48.78669 13.01227 82.31506  201.0 -9.558418      26.02454 0.88 
1 1 1 -1  9  1  o 110.8570 3.277843 171.8737  191.3 -12.93144      6.555686 0.49 
1 1 1 -1  9  2  o 110.5605 2.729247 40.76137  251.9 -2.984856      5.458494 0.31 
1 1 1 -1  9  3  o 192.0262 2.478790 336.5812  219.1 41.34554       4.957581 0.91 
1 1 1 -1  9  4  o 264.4709 2.816738 506.9677  233.4 19.82251       5.633477 0.95 
1 1 1 -1  9  5  o 172.1716 2.460243 270.5650  111.8 -60.58125      4.920485 0.88 
1 1 1 -1  9  6  o 397.9487 3.634330 828.6810  110.6 -34.52487      7.268659 0.98 
1 1 1 -1  9  7  o 469.8538 5.444566 756.2921  41.0  -24.29263      10.88913 0.98 
1 1 1 -1  9  8  f 270.9194 4.628300 530.5465  223.7 22.70047       9.256600 0.00 
1 1 1 -1  9  9  o 480.6469 6.737439 752.0834  209.2 37.46283       13.47488 0.99 
1 1 1 -1  9  10 o 204.0395 4.024273 298.5529  254.1 -0.5401459     8.048547 0.93 
1 1 1 -1  9  11 o 170.9084 4.880952 272.8906  61.0  -19.35966      9.761904 0.93 
1 1 1 -1  9  12 o 228.1408 4.614573 382.1150  159.2 18.42281       9.229145 0.97 
1 1 1 -1  9  13 o 187.3847 4.666256 300.9693  180.8 -18.52744      9.332513 0.96 
1 1 1 -1  9  14 o 139.2653 4.485094 269.1135  210.6 -5.850433      8.970187 0.96 
1 1 1 -1  9  15 o 70.80011 9.251171 95.63689  234.8 63.02987       18.50234 0.70 
1 1 1 -1  9  16 o 144.4731 3.662248 226.7259  319.4 20.63628       7.324496 0.95 
1 1 1 -1  9  17 o 249.0877 3.641860 354.4360  5.7   33.12860       7.283720 0.98 
1 1 1 -1  9  18 o 29.58744 7.603697 54.44372  205.7 -5.458038      15.20739 0.32 
1 1 1 -1  9  19 o 98.48770 3.863508 123.5592  89.6  -0.1175766     7.727016 0.92 
1 1 1 -1  9  20 o 173.5336 3.143247 373.5261  333.6 24.25093       6.286494 0.99 
1 1 1 -1  9  21 o 206.2364 3.169473 292.9285  293.1 10.29684       6.338947 0.99 
1 1 1 -1  9  22 o 47.50264 8.604630 22.84993  103.4 16.63689       17.20926 0.41 
1 1 1 -1  9  23 o 119.4248 4.119577 170.1824  85.7  -5.741829      8.239154 0.97 
1 1 1 -1  9  24 o 117.7211 4.933892 196.4740  355.7 25.32269       9.867784 0.96 
1 1 1 -1  9  25 o 99.16740 5.618971 132.2115  252.0 -1.413437      11.23794 0.94 
1 1 1 -1  9  26 o 167.3793 3.807719 244.1757  214.8 -19.75456      7.615437 0.99 
1 1 1 -1  9  27 o 91.70122 6.288728 142.1633  318.2 -17.07990      12.57746 0.96 
1 1 1 -1  9  28 o 39.23841 9.970267 53.52874  355.5 -22.82418      19.94053 0.77 
1 1 1 -1  9  29 o 74.62206 9.911148 121.1235  71.2  43.65628       19.82230 0.95 
1 1 1 -1  9  30 o 39.64404 11.63300 80.25591  38.3  5.192490       23.26601 0.86 
1 1 1 -1  9  31 o 30.81773 10.24298 65.22554  344.6 ?              ?        0.80 
1 1 1 -1  11 1  o 122.1847 3.116906 274.8751  348.2 -43.89835      6.233811 0.92 
1 1 1 -1  11 2  o 103.8732 3.181831 224.5096  268.6 -8.347633      6.363662 0.89 
1 1 1 -1  11 3  o 36.80843 7.919815 86.98784  209.5 -3.356197      15.83963 0.37 
1 1 1 -1  11 4  o 154.6635 2.521720 261.2900  1.4   7.563614       5.043440 0.95 
1 1 1 -1  11 5  o 201.2265 2.701915 274.6983  342.9 46.34840       5.403829 0.96 
1 1 1 -1  11 6  o 61.66879 4.681169 133.6513  79.2  -18.97751      9.362338 0.72 
1 1 1 -1  11 7  o 132.7672 2.767092 185.3774  173.6 4.569809       5.534183 0.94 
1 1 1 -1  11 8  o 76.54718 3.163413 98.24172  344.4 -0.2287064     6.326826 0.82 
1 1 1 -1  11 9  o 258.1511 4.906291 450.0246  312.8 17.98988       9.812581 0.99 
1 1 1 -1  11 10 o 135.3833 6.361515 256.7361  329.0 0.5541992      12.72303 0.96 
1 1 1 -1  11 11 o 75.29623 9.164586 110.7653  2.9   -0.4040680     18.32917 0.79 
1 1 1 -1  11 12 o 179.9282 4.892631 292.8821  86.4  9.308578       9.785262 0.97 
1 1 1 -1  11 13 o 43.13692 9.904340 101.2747  104.3 41.17408       19.80868 0.66 
1 1 1 -1  11 14 o 76.00433 10.62415 169.4810  224.4 24.04492       21.24829 0.92 
1 1 1 -1  11 15 o 185.5466 5.565783 285.4607  235.8 -40.38855      11.13157 0.98 
1 1 1 -1  11 16 o 205.0742 5.810109 353.6782  260.1 -33.07114      11.62022 0.99 
1 1 1 -1  11 17 o 88.28365 9.731652 156.4328  53.5  13.76625       19.46330 0.94 
1 1 1 -1  11 18 o 114.6201 6.670238 202.9415  45.5  -0.3753662     13.34048 0.97 
1 1 1 -1  11 19 o 38.73953 11.87639 90.24422  183.7 25.79189       23.75277 0.78 
1 1 1 -1  11 20 o 83.78412 11.72049 149.0486  140.5 -44.28127      23.44097 0.93 
1 1 1 -1  11 21 o 61.64418 11.72071 88.83313  159.8 -45.13195      23.44142 0.83 
1 1 1 -1  11 22 o 26.17772 8.966159 73.69090  219.6 -18.17077      17.93232 0.55 
1 1 1 -1  11 23 o 83.15004 7.475667 133.5688  74.5  -10.30634      14.95133 0.94 
1 1 1 -1  11 24 o 95.60465 6.357924 143.3025  16.5  10.72981       12.71585 0.97 
1 1 1 -1  11 25 o 68.75452 7.829931 84.77446  84.8  -5.610130      15.65986 0.93 
1 1 1 -1  11 26 o 62.50809 9.950810 81.71682  61.6  -10.00668      19.90162 0.92 
1 1 1 -1  11 27 o 33.82656 10.42221 54.84750  277.9 -8.177967      20.84442 0.74 
1 1 1 -1  11 28 o 70.66146 10.15548 91.03285  224.4 ?              ?        0.94 
1 1 1 -1  13 1  o 60.94170 5.982817 143.8897  44.7  0.1254158      11.96563 0.87 
1 1 1 -1  13 2  o 135.4510 3.177861 249.8597  321.7 -10.28011      6.355721 0.97 
1 1 1 -1  13 3  o 65.23994 5.388947 146.0577  98.6  -1.771561      10.77789 0.89 
1 1 1 -1  13 4  o 61.60220 5.162017 53.22139  8.1   7.011169       10.32403 0.66 
1 1 1 -1  13 5  o 46.45441 6.637607 89.11607  210.6 8.463379       13.27521 0.75 
1 1 1 -1  13 6  o 215.9118 2.896379 419.5422  208.1 -23.27502      5.792758 0.99 
1 1 1 -1  13 7  o 135.0439 2.950881 288.8339  145.6 18.32228       5.901762 0.98 
1 1 1 -1  13 8  o 174.8338 2.736567 283.9745  328.3 -27.00565      5.473133 0.98 
1 1 1 -1  13 9  o 203.5290 2.717389 344.1962  332.6 -33.29671      5.434778 0.99 
1 1 1 -1  13 10 o 71.13770 11.16290 152.8029  292.7 13.32035       22.32579 0.92 
1 1 1 -1  13 11 o 53.97377 12.69004 119.2769  242.4 -4.775772      25.38008 0.86 
1 1 1 -1  13 12 o 164.5825 6.488173 298.2796  38.3  -30.80928      12.97635 0.99 
1 1 1 -1  13 13 o 163.0882 6.129510 183.3150  342.5 -31.08566      12.25902 0.98 
1 1 1 -1  13 14 o 114.7363 11.24049 170.6647  311.8 ?              ?        0.97 
1 1 1 -1  13 15 o 140.7240 6.934955 260.4160  316.9 18.97531       13.86991 0.98 
1 1 1 -1  13 16 f 36.31114 11.74753 32.04242  340.9 11.98994       23.49506 0.00 
1 1 1 -1  13 17 o 103.1474 8.701659 211.7051  121.7 -11.16771      17.40332 0.97 
1 1 1 -1  13 18 o 60.60746 14.72148 133.3516  75.5  6.937756       29.44296 0.90 
1 1 1 -1  13 19 o 43.25251 12.98131 96.75677  191.2 16.95798       25.96263 0.82 
1 1 1 -1  13 20 o 108.7166 12.83782 169.9434  33.7  -33.62614      25.67565 0.97 
1 1 1 -1  13 21 o 42.07096 13.04698 73.15721  18.6  8.478378       26.09395 0.82 
1 1 1 -1  13 22 o 90.09917 14.25073 166.0720  8.8   13.64057       28.50146 0.97 
1 1 1 -1  13 23 o 123.8646 12.38914 220.2999  11.2  -52.08745      24.77828 0.98 
1 1 1 -1  13 24 o 76.68581 15.98584 155.7758  349.6 -26.06507      31.97168 0.96 
1 1 1 -1  13 25 o 47.93924 13.65465 77.90091  89.9  ?              ?        0.88 
1 1 1 -1  15 1  o 104.0312 6.597592 188.9065  161.6 -25.09020      13.19518 0.97 
1 1 1 -1  15 2  o 128.8199 4.044706 218.6748  215.5 15.76787       8.089412 0.98 
1 1 1 -1  15 3  o 81.01148 6.195714 125.9148  282.3 1.701309       12.39143 0.94 
1 1 1 -1  15 4  o 50.10029 8.773317 89.90317  106.5 -13.62844      17.54663 0.84 
1 1 1 -1  15 5  o 32.48347 8.810962 28.14012  238.1 4.896824       17.62192 0.33 
1 1 1 -1  15 6  o 79.69957 5.346783 150.3986  280.4 -4.091209      10.69357 0.94 
1 1 1 -1  15 7  o 39.03104 6.431999 80.96912  140.3 -35.11457      12.86400 0.74 
1 1 1 -1  15 8  o 68.84267 7.022435 108.2128  169.6 -35.73087      14.04487 0.90 
1 1 1 -1  15 9  o 33.48244 8.375303 73.33018  281.7 -8.128519      16.75061 0.67 
1 1 1 -1  15 10 o 138.7587 5.777576 244.2713  339.5 -5.970642      11.55515 0.98 
1 1 1 -1  15 11 o 108.7971 9.370582 145.8114  282.8 -7.334557      18.74116 0.96 
1 1 1 -1  15 12 o 45.93172 13.84433 140.8893  227.0 6.209919       27.68865 0.89 
1 1 1 -1  15 13 o 66.14812 12.62486 142.1005  185.0 33.82341       25.24973 0.93 
1 1 1 -1  15 14 o 160.0249 8.818199 328.3405  142.5 -17.75130      17.63640 0.99 
1 1 1 -1  15 15 o 53.54963 14.80087 112.3493  60.4  1.179874       29.60173 0.90 
1 1 1 -1  15 16 f 53.19339 14.43436 129.3524  92.8  20.44057       28.86873 0.00 
1 1 1 -1  15 17 o 46.24504 20.67714 95.98901  168.8 ?              ?        0.83 
1 1 1 -1  15 18 o 94.43969 13.44748 153.3387  293.9 14.78694       26.89495 0.97 
1 1 1 -1  15 19 o 55.95848 15.11501 117.3133  289.0 9.750317       30.23002 0.92 
1 1 1 -1  15 20 o 56.75326 15.92571 59.97889  19.3  11.67155       31.85143 0.84 
1 1 1 -1  15 21 o 44.12840 19.25623 33.24740  75.7  ?              ?        0.52 
1 1 1 -1  17 1  o 54.23741 9.822570 97.26604  122.6 -27.83916      19.64514 0.92 
1 1 1 -1  17 2  o 57.91614 9.672900 150.1758  202.6 9.089161       19.34580 0.95 
1 1 1 -1  17 3  o 63.12580 9.262672 135.3552  291.0 -36.16679      18.52534 0.95 
1 1 1 -1  17 4  o 86.65085 6.489971 205.2054  68.2  20.64858       12.97994 0.98 
1 1 1 -1  17 5  o 70.67496 8.672928 187.7955  43.4  -25.32335      17.34586 0.97 
1 1 1 -1  17 6  o 75.18549 8.096607 69.95051  12.0  -23.87928      16.19321 0.94 
1 1 1 -1  17 7  o 85.34071 6.081478 162.8337  174.9 0.8080597      12.16296 0.98 
1 1 1 -1  17 8  o 45.16765 7.382966 106.3176  201.6 -38.27081      14.76593 0.93 
1 1 1 -1  17 9  o 51.04533 8.465318 113.6330  0.8   -29.65014      16.93064 0.94 
1 1 1 -1  17 10 o 63.24040 7.137020 166.2489  4.1   -41.15433      14.27404 0.97 
1 1 1 -1  17 11 o 69.87583 16.06669 115.2686  56.8  -4.701859      32.13339 0.93 
1 1 1 -1  17 12 o 46.24398 14.14015 159.4601  77.5  -5.942223      28.28031 0.94 
1 1 1 -1  17 13 o 55.54762 15.59543 107.3209  105.0 23.89180       31.19086 0.91 
1 1 1 -1  17 14 o 46.12794 14.52590 61.19339  206.8 ?              ?        0.82 
1 1 1 -1  17 15 x ?        ?        31.32285  184.5 ?              ?        0.00 
1 1 1 0   0  1  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 0   0  2  o 731.5082 12.67822 8109.392  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  3  o 202.5283 4.748833 565.9796  0.0   0.000000       0.000000 0.89 
1 1 1 0   0  4  o 439.4429 6.176006 1467.084  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  5  o 205.4391 3.639309 311.6060  180.0 0.000000       0.000000 0.19 
1 1 1 0   0  6  o 995.5836 12.18992 2245.259  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  7  o 150.5927 3.488868 25.29645  180.0 0.000000       0.000000 0.91 
1 1 1 0   0  8  o 464.7272 6.720950 554.6413  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  9  o 92.43605 3.086670 303.4872  180.0 0.000000       0.000000 0.15 
1 1 1 0   0  10 o 66.73801 3.892540 88.38766  180.0 0.000000       0.000000 0.17 
1 1 1 0   0  11 o 188.2465 3.783315 820.4129  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  12 o 336.7414 5.312017 681.3087  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  13 o 83.96551 3.937932 248.8665  0.0   0.000000       0.000000 0.59 
1 1 1 0   0  14 o 325.7286 5.163785 701.2543  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  15 o 772.0248 9.738645 1102.308  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  16 o 634.8613 8.479462 652.1289  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  17 o 492.2506 6.760629 544.2816  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  18 o 469.8156 6.477415 717.8951  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  19 o 216.3376 4.279554 376.0455  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  20 o 105.3860 5.517895 148.1899  180.0 0.000000       0.000000 0.76 
1 1 1 0   0  21 o 43.30736 13.60711 265.5122  180.0 0.000000       0.000000 0.77 
1 1 1 0   0  22 f 219.3533 4.627106 298.1429  180.0 0.000000       0.000000 0.00 
1 1 1 0   0  23 o 246.7931 4.833498 434.6904  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  24 o 283.7498 5.364451 298.9650  0.0   0.000000       0.000000 1.00 
1 1 1 0   0  25 o 43.25746 16.74046 98.07302  180.0 0.000000       0.000000 0.72 
1 1 1 0   0  26 o 60.93985 14.10960 87.73842  0.0   0.000000       0.000000 0.86 
1 1 1 0   0  27 o 97.17400 8.737296 114.2339  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  28 o 28.68756 18.62617 34.52154  0.0   0.000000       0.000000 0.31 
1 1 1 0   0  29 o 253.6016 6.216113 344.7499  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  30 o 170.8487 7.580849 231.6950  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  31 o 23.56557 15.88172 28.56318  180.0 0.000000       0.000000 0.23 
1 1 1 0   0  32 o 99.00224 11.87473 87.91863  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  33 o 139.0604 9.820707 125.8652  180.0 0.000000       0.000000 1.00 
1 1 1 0   0  34 o 36.71218 21.33648 13.99323  0.0   0.000000       0.000000 0.24 
1 1 1 0   0  35 o 28.53617 18.99797 23.96621  0.0   ?              ?        0.37 
1 1 1 0   2  0  o 443.0753 8.069874 1799.954  171.7 ?              ?        0.93 
1 1 1 0   2  1  f 658.2523 7.207434 2110.772  78.6  -46.90637      14.41487 0.00 
1 1 1 0   2  2  o 956.5467 16.46761 2488.924  103.2 ?              ?        1.00 
1 1 1 0   2  3  o 262.9366 3.742903 670.9736  341.6 -101.0971      7.485806 0.95 
1 1 1 0   2  4  o 290.9893 4.126435 1012.598  77.1  ?              ?        0.98 
1 1 1 0   2  5  o 851.5524 7.352210 1381.030  4.1   18.48645       14.70442 0.99 
1 1 1 0   2  6  o 712.1946 6.278167 645.9144  72.7  -21.98401      12.55633 0.99 
1 1 1 0   2  7  o 172.6334 2.262001 561.0772  11.3  -42.90627      4.524003 0.88 
1 1 1 0   2  8  o 393.6351 4.028208 950.7635  274.7 46.18289       8.056417 0.97 
1 1 1 0   2  9  o 402.0252 4.095628 550.8906  2.9   31.82587       8.191256 0.97 
1 1 1 0   2  10 o 198.4130 2.488387 206.2604  0.7   -22.98625      4.976774 0.88 
1 1 1 0   2  11 o 285.2221 3.206390 845.5400  212.2 55.00818       6.412781 0.95 
1 1 1 0   2  12 o 667.2847 6.003626 1067.651  11.6  21.40240       12.00725 0.99 
1 1 1 0   2  13 o 159.7012 2.457114 255.1585  123.0 -24.55440      4.914228 0.76 
1 1 1 0   2  14 f 670.7079 5.904104 700.5849  204.9 -88.70483      11.80821 0.00 
1 1 1 0   2  15 o 261.7912 2.868163 197.2762  54.5  -23.18864      5.736327 0.83 
1 1 1 0   2  16 o 354.5893 3.602890 521.2894  116.4 67.73776       7.205780 0.96 
1 1 1 0   2  17 o 202.0620 3.816849 236.6437  224.8 6.678635       7.633698 0.86 
1 1 1 0   2  18 f 403.2622 3.888793 599.2477  221.1 -59.95276      7.777586 0.00 
1 1 1 0   2  19 o 247.7052 3.710847 421.4600  104.7 36.59190       7.421694 0.96 
1 1 1 0   2  20 o 59.47679 6.398705 165.0021  300.4 1.168690       12.79741 0.60 
1 1 1 0   2  21 f 154.8745 3.243315 252.8411  324.8 10.98662       6.486631 0.00 
1 1 1 0   2  22 o 151.8067 3.483266 266.9250  61.7  5.164703       6.966531 0.96 
1 1 1 0   2  23 f 185.3332 4.074307 336.7962  67.2  -23.91953      8.148614 0.00 
1 1 1 0   2  24 o 182.8743 3.611292 269.4552  263.2 -24.66638      7.222584 0.97 
1 1 1 0   2  25 o 49.55877 9.479227 97.57402  277.4 -7.279873      18.95845 0.73 
1 1 1 0   2  26 o 133.1976 4.562862 208.3190  93.1  15.15310       9.125725 0.96 
1 1 1 0   2  27 o 32.02275 9.802645 7.170747  146.8 -0.8994942     19.60529 0.07 
1 1 1 0   2  28 f 128.3059 4.823524 178.7869  61.2  20.81689       9.647048 0.00 
1 1 1 0   2  29 o 119.0929 6.398364 156.1003  70.0  -7.576141      12.79673 0.95 
1 1 1 0   2  30 o 202.8996 4.671910 260.1490  266.2 -1.782166      9.343821 0.99 
1 1 1 0   2  31 o 58.30253 12.48991 38.29211  187.4 -10.50499      24.97981 0.63 
1 1 1 0   2  32 f 156.0268 6.137259 158.7747  25.9  -6.522049      12.27452 0.00 
1 1 1 0   2  33 o 111.2990 8.923329 144.9313  328.6 -18.14367      17.84666 0.97 
1 1 1 0   2  34 o 75.63857 12.12117 79.75819  75.0  -2.014336      24.24234 0.92 
1 1 1 0   2  35 o 38.50422 12.07591 83.26638  63.6  ?              ?        0.87 
1 1 1 0   4  0  o 938.9563 11.24353 1784.558  91.0  -62.28772      22.48705 0.99 
1 1 1 0   4  1  o 534.5438 4.865123 1129.623  276.4 2.874329       9.730247 0.99 
1 1 1 0   4  2  o 854.9944 9.163825 1298.688  229.6 -64.23663      18.32765 0.99 
1 1 1 0   4  3  o 460.6616 5.309991 249.7548  211.6 -20.03265      10.61998 0.98 
1 1 1 0   4  4  o 168.8159 2.668999 695.8979  238.9 -24.40781      5.337998 0.87 
1 1 1 0   4  5  o 567.5931 5.958756 425.5575  163.4 2.774658       11.91751 0.98 
1 1 1 0   4  6  o 124.0142 2.361855 210.6675  79.5  -2.119766      4.723710 0.72 
1 1 1 0   4  7  o 511.2398 4.164373 1197.391  180.6 -22.71762      8.328746 0.98 
1 1 1 0   4  8  o 361.8530 4.891467 632.1497  256.3 ?              ?        0.97 
1 1 1 0   4  9  o 193.9354 3.164537 540.6970  175.4 ?              ?        0.87 
1 1 1 0   4  10 o 242.4722 2.658608 499.3800  242.1 -11.29393      5.317215 0.93 
1 1 1 0   4  11 f 557.4500 4.806427 635.3849  75.3  5.456787       9.612855 0.00 
1 1 1 0   4  12 o 745.1710 6.342884 1062.786  337.4 58.10522       12.68577 0.99 
1 1 1 0   4  13 o 393.4876 3.747344 553.5479  151.6 -16.86490      7.494689 0.97 
1 1 1 0   4  14 o 570.2297 6.228891 792.5186  178.9 7.429565       12.45778 0.98 
1 1 1 0   4  15 o 53.06084 5.695264 178.3789  52.6  25.59621       11.39053 0.23 
1 1 1 0   4  16 o 150.2113 2.793964 225.0256  6.0   15.92729       5.587927 0.79 
1 1 1 0   4  17 o 372.4154 3.666574 406.3307  24.1  -12.27606      7.333148 0.97 
1 1 1 0   4  18 o 140.0300 3.861635 124.4393  332.5 -3.330475      7.723270 0.72 
1 1 1 0   4  19 o 208.9686 2.947012 242.9463  273.2 20.90405       5.894024 0.93 
1 1 1 0   4  20 o 205.2833 2.864451 265.3856  156.0 -6.991226      5.728901 0.96 
1 1 1 0   4  21 o 306.4637 3.363565 388.5113  76.3  25.80417       6.727130 0.99 
1 1 1 0   4  22 o 229.0303 3.114284 368.7522  65.1  -51.12546      6.228568 0.98 
1 1 1 0   4  23 o 123.6490 4.003201 136.4898  250.6 3.573967       8.006401 0.92 
1 1 1 0   4  24 o 170.8593 4.657572 220.1802  291.1 7.155350       9.315144 0.97 
1 1 1 0   4  25 o 238.1342 3.494386 258.8610  328.6 25.75757       6.988771 0.98 
1 1 1 0   4  26 o 100.5124 6.391843 176.6093  181.9 -33.55066      12.78369 0.96 
1 1 1 0   4  27 o 71.08486 8.482050 120.7560  249.0 -7.098862      16.96410 0.91 
1 1 1 0   4  28 o 109.5336 6.193847 125.4070  60.5  -14.01759      12.38769 0.93 
1 1 1 0   4  29 o 116.3301 6.593155 180.6492  79.3  -40.80516      13.18631 0.96 
1 1 1 0   4  30 o 149.2661 5.730030 212.3364  322.6 41.59108       11.46006 0.98 
1 1 1 0   4  31 o 68.57685 11.32240 77.34042  159.4 -15.75363      22.64480 0.89 
1 1 1 0   4  32 o 60.91367 12.56128 69.91511  63.6  -21.15639      25.12257 0.88 
1 1 1 0   4  33 o 81.46997 11.49396 128.1919  353.1 18.50987       22.98792 0.95 
1 1 1 0   4  34 o 30.99763 10.50025 56.52969  140.9 ?              ?        0.74 
1 1 1 0   6  0  o 615.4339 7.793780 823.1747  52.4  -26.57031      15.58756 0.98 
1 1 1 0   6  1  o 165.7147 2.454810 280.9194  43.5  -27.47308      4.909619 0.87 
1 1 1 0   6  2  o 161.2444 2.170542 341.6944  64.2  -19.68970      4.341085 0.83 
1 1 1 0   6  3  o 170.9531 2.224948 481.2571  199.4 13.51517       4.449897 0.88 
1 1 1 0   6  4  o 330.9520 3.189812 728.5519  50.4  28.47488       6.379624 0.97 
1 1 1 0   6  5  o 178.1786 2.710495 286.8788  184.8 45.92781       5.420990 0.73 
1 1 1 0   6  6  o 253.4927 3.347980 333.4668  114.4 -51.76407      6.695960 0.88 
1 1 1 0   6  7  o 359.9528 5.162612 671.5296  54.6  -11.01993      10.32522 0.96 
1 1 1 0   6  8  o 120.5964 4.326075 137.6410  247.7 -68.79112      8.652150 0.62 
1 1 1 0   6  9  o 406.6208 4.417240 760.2681  75.0  33.92950       8.834480 0.97 
1 1 1 0   6  10 o 323.2697 3.606684 347.4059  75.9  -5.464447      7.213367 0.95 
1 1 1 0   6  11 o 257.4456 2.424816 173.2625  209.4 34.06992       4.849633 0.89 
1 1 1 0   6  12 o 326.4365 3.074706 523.6583  247.8 -47.56070      6.149411 0.96 
1 1 1 0   6  13 f 543.7991 4.436285 712.5531  254.6 -26.50720      8.872571 0.00 
1 1 1 0   6  14 o 216.7738 2.712127 281.1603  1.0   -9.427963      5.424253 0.90 
1 1 1 0   6  15 o 245.1907 2.880072 330.5147  15.7  14.40663       5.760144 0.93 
1 1 1 0   6  16 o 268.4101 3.010372 446.4576  118.8 13.37112       6.020745 0.97 
1 1 1 0   6  17 o 269.2071 3.024223 520.2751  51.3  -20.11911      6.048446 0.98 
1 1 1 0   6  18 o 172.3068 2.900870 266.4249  350.7 10.50822       5.801741 0.95 
1 1 1 0   6  19 o 112.6194 3.710990 188.3242  254.6 -9.280914      7.421979 0.92 
1 1 1 0   6  20 o 146.3369 3.282541 254.7982  74.4  22.10289       6.565082 0.96 
1 1 1 0   6  21 o 164.3946 3.218796 248.1666  31.8  -5.865250      6.437592 0.96 
1 1 1 0   6  22 f 305.5287 3.593630 578.6740  284.0 25.01111       7.187260 0.00 
1 1 1 0   6  23 o 114.7258 4.577739 105.9612  57.1  7.237862       9.155478 0.92 
1 1 1 0   6  24 o 78.78871 9.869949 95.12056  277.5 5.511116       19.73990 0.86 
1 1 1 0   6  25 o 80.48886 7.427362 131.4056  349.1 2.034485       14.85472 0.93 
1 1 1 0   6  26 o 244.9200 4.133641 305.9895  82.1  -9.963135      8.267282 0.99 
1 1 1 0   6  27 o 140.8204 5.255874 195.5470  89.1  -9.833969      10.51175 0.97 
1 1 1 0   6  28 o 34.36779 10.35465 67.34605  184.3 -6.173826      20.70929 0.58 
1 1 1 0   6  29 o 98.48556 8.901404 134.3415  17.9  33.82797       17.80281 0.95 
1 1 1 0   6  30 o 87.75798 8.748054 116.0966  345.7 0.7546616      17.49611 0.95 
1 1 1 0   6  31 f 80.27554 10.88692 95.37606  179.3 -12.09553      21.77385 0.00 
1 1 1 0   6  32 o 43.35934 11.91856 47.82943  330.7 7.179939       23.83713 0.74 
1 1 1 0   6  33 o 70.06274 13.15834 141.5946  279.9 ?              ?        0.96 
1 1 1 0   8  0  o 584.3643 7.559800 1015.549  143.6 -79.30060      15.11960 0.98 
1 1 1 0   8  1  o 335.4452 3.431051 469.1620  244.9 3.417206       6.862102 0.97 
1 1 1 0   8  2  o 563.7366 5.120586 1066.724  226.0 -54.09253      10.24117 0.99 
1 1 1 0   8  3  o 298.5549 3.088325 439.2373  171.4 -26.53745      6.176650 0.96 
1 1 1 0   8  4  o 490.9138 4.373230 837.6447  126.5 -64.47360      8.746459 0.98 
1 1 1 0   8  5  o 272.3181 2.768520 596.1492  84.5  -34.73824      5.537040 0.96 
1 1 1 0   8  6  o 94.72342 2.506556 87.16203  58.5  71.06924       5.013112 0.30 
1 1 1 0   8  7  o 321.4533 4.261093 507.1236  277.1 ?              ?        0.96 
1 1 1 0   8  8  o 488.4409 6.472440 789.7120  186.9 3.775726       12.94488 0.98 
1 1 1 0   8  9  o 393.0734 5.324703 734.8756  10.2  30.02264       10.64941 0.98 
1 1 1 0   8  10 o 161.4546 4.497297 180.2813  71.5  -58.36096      8.994595 0.78 
1 1 1 0   8  11 o 88.79384 5.262663 78.79266  246.8 14.38038       10.52533 0.22 
1 1 1 0   8  12 o 432.6921 6.259075 666.9512  57.4  -6.240875      12.51815 0.98 
1 1 1 0   8  13 o 248.2321 3.738088 282.4786  46.3  41.61592       7.476175 0.95 
1 1 1 0   8  14 o 65.81401 6.816318 272.1505  351.1 16.83767       13.63264 0.82 
1 1 1 0   8  15 o 87.33369 4.674130 172.9338  14.3  -33.35236      9.348261 0.83 
1 1 1 0   8  16 o 54.21247 4.880429 57.35567  189.8 -16.94862      9.760859 0.33 
1 1 1 0   8  17 o 273.4219 2.847838 430.9423  63.1  4.785889       5.695676 0.99 
1 1 1 0   8  18 o 82.84444 3.961061 142.6948  356.9 -10.58471      7.922121 0.86 
1 1 1 0   8  19 o 90.14580 4.324270 68.34165  169.7 24.66814       8.648540 0.75 
1 1 1 0   8  20 o 149.9116 3.264499 294.4484  217.8 32.00060       6.528999 0.98 
1 1 1 0   8  21 o 197.7623 3.230971 347.9633  94.5  16.71799       6.461942 0.99 
1 1 1 0   8  22 o 155.2994 3.374309 291.8253  66.2  0.3090973      6.748618 0.98 
1 1 1 0   8  23 o 105.3938 5.252207 130.2950  61.9  -3.484993      10.50441 0.95 
1 1 1 0   8  24 o 89.75171 6.398858 115.6412  309.5 -11.43444      12.79772 0.93 
1 1 1 0   8  25 o 64.94371 9.350146 121.2122  174.9 34.58603       18.70029 0.88 
1 1 1 0   8  26 o 53.60213 10.72949 59.50879  137.3 -17.75365      21.45899 0.69 
1 1 1 0   8  27 o 114.5839 9.469203 160.7907  314.7 -11.00777      18.93841 0.96 
1 1 1 0   8  28 o 55.42303 11.60372 51.00957  273.4 5.069717       23.20744 0.78 
1 1 1 0   8  29 o 30.88367 10.01717 42.07817  51.2  2.645208       20.03433 0.61 
1 1 1 0   8  30 o 93.65678 8.827816 136.9254  294.8 7.730751       17.65563 0.97 
1 1 1 0   8  31 o 107.3266 8.962681 131.3544  213.7 27.63424       17.92536 0.97 
1 1 1 0   8  32 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 0   10 0  o 641.0226 8.039435 975.2488  311.6 49.91614       16.07887 0.98 
1 1 1 0   10 1  o 144.0331 2.752918 274.0997  4.6   -29.37888      5.505836 0.87 
1 1 1 0   10 2  o 281.3396 3.185775 389.3298  55.0  1.636322       6.371551 0.96 
1 1 1 0   10 3  o 340.4727 3.554894 666.5668  327.3 -75.97134      7.109788 0.98 
1 1 1 0   10 4  o 127.0741 3.255758 201.9008  343.3 -37.74319      6.511516 0.82 
1 1 1 0   10 5  o 74.29028 3.809860 164.9304  233.2 -33.66027      7.619721 0.57 
1 1 1 0   10 6  o 157.8631 2.407398 167.1591  185.6 29.50330       4.814796 0.85 
1 1 1 0   10 7  o 349.4936 3.838735 590.1061  0.4   -56.05661      7.677470 0.98 
1 1 1 0   10 8  o 259.2856 3.890840 540.9370  330.1 -0.6320801     7.781679 0.98 
1 1 1 0   10 9  o 190.4588 4.349834 361.6767  302.4 -56.18373      8.699669 0.96 
1 1 1 0   10 10 o 186.3295 4.691135 229.6955  3.1   -11.33389      9.382270 0.96 
1 1 1 0   10 11 o 204.1868 4.605842 363.2263  352.8 19.49481       9.211684 0.98 
1 1 1 0   10 12 o 150.9904 5.036801 212.7733  63.3  -29.31712      10.07360 0.95 
1 1 1 0   10 13 f 120.9528 5.427104 183.5836  199.2 14.21956       10.85421 0.00 
1 1 1 0   10 14 o 34.64426 10.38403 155.8920  339.8 5.820789       20.76805 0.65 
1 1 1 0   10 15 o 66.50957 9.698371 159.9046  94.5  -58.23382      19.39674 0.87 
1 1 1 0   10 16 o 142.9946 6.170404 324.8532  152.3 -34.19582      12.34081 0.98 
1 1 1 0   10 17 o 210.7230 5.030736 353.9659  78.0  14.25339       10.06147 0.99 
1 1 1 0   10 18 o 203.6682 3.786113 300.1877  150.2 -16.56322      7.572226 0.99 
1 1 1 0   10 19 o 184.4573 3.843027 295.7707  154.8 20.69290       7.686053 0.99 
1 1 1 0   10 20 o 102.7750 6.296567 191.2482  9.6   13.23652       12.59313 0.97 
1 1 1 0   10 21 o 109.5719 6.319436 211.6125  343.8 35.98238       12.63887 0.97 
1 1 1 0   10 22 o 138.9905 4.209573 200.5668  207.3 26.30206       8.419147 0.97 
1 1 1 0   10 23 o 62.93269 7.212629 72.50985  211.7 -19.88711      14.42526 0.81 
1 1 1 0   10 24 o 86.81322 5.730388 130.2584  223.5 -10.76367      11.46078 0.94 
1 1 1 0   10 25 o 146.8497 4.767633 248.7644  175.0 -5.799545      9.535266 0.99 
1 1 1 0   10 26 o 70.98133 9.796669 98.97640  147.6 7.209595       19.59334 0.93 
1 1 1 0   10 27 o 32.64704 10.33165 84.47344  145.6 -14.23992      20.66331 0.83 
1 1 1 0   10 28 o 82.32860 8.547329 116.8914  236.0 6.806587       17.09466 0.96 
1 1 1 0   10 29 o 44.02935 11.85753 58.70569  260.5 -6.666252      23.71507 0.82 
1 1 1 0   12 0  o 355.9799 5.402821 653.8561  89.4  -30.28769      10.80564 0.99 
1 1 1 0   12 1  o 185.6091 2.897199 395.3994  109.3 6.888138       5.794398 0.98 
1 1 1 0   12 2  o 140.3127 3.475072 176.9112  161.5 -3.174606      6.950143 0.95 
1 1 1 0   12 3  o 111.7680 3.263231 111.6287  142.4 8.056953       6.526461 0.88 
1 1 1 0   12 4  o 104.5922 3.370036 133.6986  268.7 -7.472992      6.740073 0.90 
1 1 1 0   12 5  o 186.6684 2.776657 236.1509  12.2  17.27539       5.553314 0.97 
1 1 1 0   12 6  o 109.8214 3.122963 130.2240  328.0 4.652214       6.245926 0.90 
1 1 1 0   12 7  o 35.30552 6.590963 166.8727  331.3 21.01651       13.18193 0.71 
1 1 1 0   12 8  o 74.46863 3.718142 97.83395  177.6 12.18915       7.436285 0.81 
1 1 1 0   12 9  o 48.26323 8.046887 135.5086  146.0 19.20430       16.09377 0.80 
1 1 1 0   12 10 o 168.1539 5.509287 308.8472  166.1 -22.17155      11.01857 0.98 
1 1 1 0   12 11 o 42.13313 11.57632 68.22365  288.7 16.73097       23.15264 0.59 
1 1 1 0   12 12 o 197.1190 5.647552 355.6835  18.7  3.359619       11.29510 0.99 
1 1 1 0   12 13 f 126.8154 6.537687 180.3318  274.2 -20.16377      13.07537 0.00 
1 1 1 0   12 14 o 159.4228 6.233945 293.9999  221.5 4.662186       12.46789 0.98 
1 1 1 0   12 15 o 92.55481 9.688601 181.6364  334.9 6.793839       19.37720 0.96 
1 1 1 0   12 16 o 112.4864 8.472757 199.8016  243.7 -22.09959      16.94551 0.97 
1 1 1 0   12 17 o 126.6802 8.639548 214.8444  169.3 -8.739502      17.27910 0.98 
1 1 1 0   12 18 o 87.58849 12.29045 160.5161  265.4 -36.44648      24.58090 0.94 
1 1 1 0   12 19 o 57.36902 12.32374 37.70232  203.0 -38.92063      24.64748 0.55 
1 1 1 0   12 20 o 197.1015 6.616787 305.7274  21.9  -0.2339172     13.23357 0.99 
1 1 1 0   12 21 o 110.4050 11.67886 151.5057  31.6  -3.110390      23.35773 0.96 
1 1 1 0   12 22 o 62.55415 13.23123 161.6852  73.3  -37.40140      26.46246 0.94 
1 1 1 0   12 23 o 55.26377 14.01718 152.4682  78.7  -19.16967      28.03435 0.94 
1 1 1 0   12 24 o 95.67328 6.966932 147.0826  67.5  -0.7984848     13.93386 0.97 
1 1 1 0   12 25 o 70.03416 9.172425 159.6706  67.0  -15.18377      18.34485 0.97 
1 1 1 0   12 26 o 46.93200 11.88851 68.75588  91.5  -21.75911      23.77702 0.86 
1 1 1 0   12 27 o 57.54468 11.48240 102.6393  168.3 ?              ?        0.94 
1 1 1 0   14 0  o 117.6780 5.852593 181.4066  346.9 -3.450340      11.70519 0.93 
1 1 1 0   14 1  o 142.6592 3.644201 213.2746  236.1 -17.78203      7.288402 0.98 
1 1 1 0   14 2  o 119.9280 4.553249 201.9987  226.3 33.04829       9.106499 0.97 
1 1 1 0   14 3  o 178.0515 3.425120 295.7087  250.4 -29.07336      6.850240 0.99 
1 1 1 0   14 4  o 203.7824 3.319259 292.1852  136.4 -16.50478      6.638517 0.99 
1 1 1 0   14 5  o 165.9954 3.046590 260.9606  64.6  5.772430       6.093181 0.99 
1 1 1 0   14 6  o 118.6027 3.793032 236.9989  255.9 -36.88296      7.586063 0.98 
1 1 1 0   14 7  o 118.4266 3.745906 229.7521  133.2 -30.69719      7.491811 0.98 
1 1 1 0   14 8  o 140.5264 3.303546 240.7968  102.0 -27.44315      6.607092 0.99 
1 1 1 0   14 9  o 68.47652 4.922793 135.8769  205.1 -0.9793091     9.845586 0.95 
1 1 1 0   14 10 o 97.65822 9.574312 153.5846  38.3  16.24276       19.14862 0.96 
1 1 1 0   14 11 o 200.6044 5.628500 318.2268  43.6  -0.7066345     11.25700 0.99 
1 1 1 0   14 12 o 138.4506 7.269775 282.6572  345.8 10.15065       14.53955 0.98 
1 1 1 0   14 13 o 128.4759 12.39223 219.6597  266.7 ?              ?        0.97 
1 1 1 0   14 14 o 227.5107 6.472113 331.1573  163.9 -2.644104      12.94423 0.99 
1 1 1 0   14 15 o 47.42686 13.51334 91.27305  250.5 16.86885       27.02668 0.81 
1 1 1 0   14 16 o 58.71685 14.87523 73.56898  20.5  9.452545       29.75046 0.82 
1 1 1 0   14 17 o 48.47773 13.96850 67.42366  133.9 20.45785       27.93699 0.79 
1 1 1 0   14 18 o 50.95222 14.38181 45.99463  195.9 29.32415       28.76363 0.72 
1 1 1 0   14 19 o 86.72324 14.33528 144.5715  183.2 43.36725       28.67056 0.96 
1 1 1 0   14 20 o 105.7468 12.43396 136.0810  126.1 -21.39376      24.86793 0.97 
1 1 1 0   14 21 o 101.0180 13.54465 233.4338  37.7  -72.92776      27.08929 0.98 
1 1 1 0   14 22 o 51.07442 15.24230 105.9477  12.4  6.630833       30.48460 0.91 
1 1 1 0   14 23 o 56.35582 13.66404 49.46744  250.5 ?              ?        0.83 
1 1 1 0   16 0  o 148.0737 7.148041 379.5744  69.5  ?              ?        0.98 
1 1 1 0   16 1  o 134.7830 4.425037 246.7346  96.3  -11.48425      8.850075 0.98 
1 1 1 0   16 2  o 97.68330 5.974245 109.3918  261.1 4.236496       11.94849 0.95 
1 1 1 0   16 3  o 165.7167 3.994215 306.0288  281.6 1.378601       7.988431 0.99 
1 1 1 0   16 4  o 71.08340 6.696533 22.54763  321.0 20.93572       13.39307 0.58 
1 1 1 0   16 5  o 70.22095 8.100132 110.5663  111.8 -18.75913      16.20026 0.93 
1 1 1 0   16 6  o 58.88992 8.241844 39.66381  80.5  6.115112       16.48369 0.73 
1 1 1 0   16 7  o 166.1920 3.758713 306.3802  202.2 13.56587       7.517425 0.99 
1 1 1 0   16 8  o 201.6917 3.366100 319.1217  248.5 13.90086       6.732199 0.99 
1 1 1 0   16 9  o 51.14742 8.735591 50.46025  121.4 8.633030       17.47118 0.80 
1 1 1 0   16 10 o 118.7015 7.759827 243.8712  95.2  25.56830       15.51965 0.99 
1 1 1 0   16 11 o 68.74654 14.29078 160.4728  96.8  20.37408       28.58157 0.95 
1 1 1 0   16 12 o 52.69469 13.88665 104.8618  53.9  -33.63466      27.77330 0.91 
1 1 1 0   16 13 o 36.86366 12.40593 61.75752  71.9  8.108429       24.81186 0.79 
1 1 1 0   16 14 o 49.29522 14.82896 70.04221  153.2 -3.523781      29.65791 0.84 
1 1 1 0   16 15 o 36.00333 11.97900 80.15080  153.4 20.23663       23.95800 0.84 
1 1 1 0   16 16 o 51.14135 14.72857 75.68153  122.2 -9.091476      29.45715 0.87 
1 1 1 0   16 17 o 51.58772 15.46820 120.2061  36.3  2.601063       30.93640 0.92 
1 1 1 0   16 18 o 69.82594 14.14759 172.0110  3.7   ?              ?        0.96 
1 1 1 0   18 0  o 170.4527 7.648889 359.8598  66.0  -36.73837      15.29778 0.99 
1 1 1 0   18 1  o 77.60033 8.752498 167.1742  68.1  -19.39738      17.50500 0.98 
1 1 1 0   18 2  o 63.61806 10.24654 150.8113  292.0 -42.93013      20.49308 0.96 
1 1 1 0   18 3  o 104.2606 6.747681 242.6920  302.8 -15.88718      13.49536 0.99 
1 1 1 0   18 4  o 42.11976 12.06269 105.7627  74.3  7.753872       24.12537 0.91 
1 1 1 0   18 5  o 32.41921 9.768575 68.30867  75.6  6.090742       19.53715 0.83 
1 1 1 0   18 6  f 38.58916 10.01336 87.10999  191.2 -4.109264      20.02673 0.00 
1 1 1 0   18 7  o 85.48373 7.087798 196.4626  202.7 -9.287941      14.17560 0.98 
1 1 1 0   18 8  o 35.24622 8.980325 54.83066  204.2 ?              ?        0.83 
1 1 1 0   18 9  o 43.23342 10.33444 73.73910  322.9 ?              ?        0.90 
1 1 1 0   18 10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 1   1  0  x ?        ?        10514.87  20.0  ?              ?        0.00 
1 1 1 1   1  1  o 463.9492 8.857061 3280.943  230.9 ?              ?        0.99 
1 1 1 1   1  2  f 376.7676 5.051942 2908.530  284.9 ?              ?        0.00 
1 1 1 1   1  3  o 543.3672 7.005972 1796.657  14.5  ?              ?        0.99 
1 1 1 1   1  4  o 339.8105 3.461478 1331.652  267.7 -9.281555      6.922956 0.97 
1 1 1 1   1  5  o 484.8229 4.690505 1614.326  167.4 -4.116058      9.381009 0.98 
1 1 1 1   1  6  o 569.6984 5.331946 1086.646  237.5 -13.41382      10.66389 0.99 
1 1 1 1   1  7  o 258.0976 3.037997 208.7927  5.6   -80.36549      6.075995 0.94 
1 1 1 1   1  8  o 371.3270 3.912371 462.5256  322.2 -7.796204      7.824742 0.97 
1 1 1 1   1  9  o 48.64790 2.806707 140.8471  239.4 20.47605       5.613415 0.34 
1 1 1 1   1  10 o 50.32417 3.664510 150.6486  326.3 26.67982       7.329021 0.23 
1 1 1 1   1  11 o 245.6467 2.841378 485.8067  56.2  10.09204       5.682757 0.93 
1 1 1 1   1  12 o 707.7438 6.430847 978.1155  12.4  -44.60614      12.86169 0.99 
1 1 1 1   1  13 o 307.7614 3.366741 350.3935  106.4 43.21011       6.733482 0.93 
1 1 1 1   1  14 o 300.6984 3.601140 315.6322  121.0 -45.91214      7.202279 0.92 
1 1 1 1   1  15 o 539.4504 5.098217 903.2921  238.4 -34.06586      10.19643 0.99 
1 1 1 1   1  16 o 357.7884 3.731969 457.4868  346.9 -81.56213      7.463938 0.96 
1 1 1 1   1  17 o 309.5791 3.341928 328.6695  243.3 1.921967       6.683857 0.92 
1 1 1 1   1  18 o 519.0283 6.768996 691.0361  183.1 ?              ?        0.98 
1 1 1 1   1  19 o 379.0637 3.815883 426.4721  167.6 31.96381       7.631766 0.97 
1 1 1 1   1  20 o 110.7441 4.663341 167.5552  21.3  -22.26392      9.326682 0.80 
1 1 1 1   1  21 o 160.1557 3.204386 213.3302  11.9  10.43732       6.408771 0.93 
1 1 1 1   1  22 o 408.1704 5.310662 536.6344  144.8 43.97049       10.62132 0.99 
1 1 1 1   1  23 o 136.3589 3.887935 202.3035  260.7 39.30378       7.775871 0.94 
1 1 1 1   1  24 o 343.9828 4.104976 454.7839  252.6 -5.258118      8.209951 0.99 
1 1 1 1   1  25 o 169.5007 3.893678 371.9533  210.6 18.35699       7.787356 0.98 
1 1 1 1   1  26 o 29.02986 8.857731 59.39391  2.2   -7.978897      17.71546 0.39 
1 1 1 1   1  27 f 133.5695 6.220695 104.2315  295.2 -26.10240      12.44139 0.00 
1 1 1 1   1  28 o 102.0461 7.083570 139.9381  169.5 38.35990       14.16714 0.95 
1 1 1 1   1  29 o 72.01830 9.465159 153.0257  210.2 31.40443       18.93032 0.91 
1 1 1 1   1  30 f 74.29874 12.22663 38.73717  97.9  25.10283       24.45327 0.00 
1 1 1 1   1  31 o 94.88803 9.177576 113.7113  107.8 37.99613       18.35515 0.94 
1 1 1 1   1  32 o 37.20552 11.58627 79.38743  252.6 4.327160       23.17254 0.80 
1 1 1 1   1  33 o 45.81703 12.72374 16.72813  123.8 9.844467       25.44748 0.36 
1 1 1 1   1  34 o 42.94005 12.79950 22.23059  39.9  4.009922       25.59900 0.45 
1 1 1 1   1  35 x ?        ?        54.68008  99.0  ?              ?        0.00 
1 1 1 1   3  0  o 694.1179 6.052146 1611.126  26.5  -57.15576      12.10429 0.99 
1 1 1 1   3  1  o 589.5746 6.452986 893.5977  185.1 73.22803       12.90597 0.99 
1 1 1 1   3  2  o 132.9267 2.234996 333.3933  354.9 47.03734       4.469992 0.67 
1 1 1 1   3  3  o 276.8933 6.199590 536.7156  205.7 ?              ?        0.94 
1 1 1 1   3  4  o 271.5842 3.608431 973.0981  68.7  -59.71902      7.216862 0.97 
1 1 1 1   3  5  o 686.3563 5.765950 1234.546  240.6 -25.21655      11.53190 0.99 
1 1 1 1   3  6  o 185.3813 2.239054 408.4692  186.7 -3.789169      4.478108 0.93 
1 1 1 1   3  7  o 283.9993 3.041511 1176.631  134.3 -92.35400      6.083021 0.97 
1 1 1 1   3  8  o 339.8263 3.437581 616.2455  330.1 41.79306       6.875163 0.95 
1 1 1 1   3  9  o 145.8600 2.093872 325.8087  61.0  14.93703       4.187745 0.87 
1 1 1 1   3  10 o 266.3654 2.974828 536.0206  197.3 6.704163       5.949656 0.96 
1 1 1 1   3  11 o 550.7874 4.899062 685.9789  186.2 91.28592       9.798124 0.99 
1 1 1 1   3  12 o 657.0911 5.709919 1029.539  161.2 75.45740       11.41984 0.99 
1 1 1 1   3  13 o 530.3118 4.829719 793.8135  223.9 37.97153       9.659437 0.98 
1 1 1 1   3  14 o 590.8331 5.225683 725.8961  18.5  58.18726       10.45137 0.98 
1 1 1 1   3  15 o 276.0315 2.925705 449.2252  12.8  -24.28299      5.851410 0.94 
1 1 1 1   3  16 o 530.0308 4.757846 638.5402  169.4 -13.74731      9.515693 0.98 
1 1 1 1   3  17 o 96.64632 3.813963 256.4136  144.0 -5.707367      7.627927 0.70 
1 1 1 1   3  18 o 271.2287 3.108776 345.5074  219.5 9.903503       6.217552 0.94 
1 1 1 1   3  19 o 172.9000 2.839756 279.6473  180.5 5.508484       5.679513 0.93 
1 1 1 1   3  20 o 130.7190 4.169951 140.6183  193.2 -40.31094      8.339903 0.82 
1 1 1 1   3  21 o 306.7037 3.411101 492.2540  316.6 32.41599       6.822202 0.99 
1 1 1 1   3  22 f 395.9687 3.959782 527.5119  313.7 31.77512       7.919565 0.00 
1 1 1 1   3  23 o 79.29642 6.521108 180.4817  335.0 36.18769       13.04222 0.88 
1 1 1 1   3  24 o 283.1991 3.496220 389.7842  255.3 -10.83139      6.992440 0.99 
1 1 1 1   3  25 o 46.25311 10.43509 111.2773  175.7 4.278469       20.87017 0.76 
1 1 1 1   3  26 o 152.4832 4.522899 205.5845  128.7 -38.34685      9.045798 0.97 
1 1 1 1   3  27 o 284.5859 4.276628 305.5003  285.3 1.663971       8.553256 0.99 
1 1 1 1   3  28 o 107.1738 5.927453 168.2764  286.1 -23.48869      11.85491 0.95 
1 1 1 1   3  29 o 149.7920 4.988422 142.9575  180.4 31.96686       9.976845 0.96 
1 1 1 1   3  30 o 124.0959 6.083176 145.9448  257.5 -10.12071      12.16635 0.96 
1 1 1 1   3  31 o 43.82472 12.15306 47.34913  174.9 -9.835949      24.30612 0.65 
1 1 1 1   3  32 o 36.93505 11.99487 71.50137  339.2 -8.373360      23.98973 0.79 
1 1 1 1   3  33 o 63.27805 11.87983 72.41695  1.4   -44.79995      23.75966 0.89 
1 1 1 1   3  34 o 34.93098 11.37424 31.66809  169.5 ?              ?        0.55 
1 1 1 1   5  0  o 276.1274 2.971935 541.7750  97.2  14.59763       5.943870 0.96 
1 1 1 1   5  1  o 328.1981 3.374806 987.0797  189.7 66.91403       6.749611 0.97 
1 1 1 1   5  2  o 239.1774 2.714415 506.1543  183.4 60.07072       5.428831 0.92 
1 1 1 1   5  3  o 342.7669 3.383931 453.6637  232.0 22.03366       6.767862 0.96 
1 1 1 1   5  4  o 123.6767 2.717384 156.7222  288.4 -55.94608      5.434767 0.77 
1 1 1 1   5  5  o 407.5151 4.645882 671.1035  194.1 68.35690       9.291764 0.97 
1 1 1 1   5  6  f 320.7562 3.849459 755.5231  38.8  -18.95282      7.698919 0.00 
1 1 1 1   5  7  o 424.1694 5.176664 1027.512  323.3 -20.51685      10.35333 0.97 
1 1 1 1   5  8  o 359.4128 4.287539 638.3307  155.8 29.54239       8.575077 0.97 
1 1 1 1   5  9  o 436.1254 3.560956 367.5780  120.2 80.39594       7.121912 0.97 
1 1 1 1   5  10 o 653.5549 5.148341 1128.047  119.7 32.62982       10.29668 0.99 
1 1 1 1   5  11 o 315.6304 3.077114 361.0810  80.7  20.67343       6.154228 0.95 
1 1 1 1   5  12 o 321.5818 3.244001 597.1149  339.6 -26.80276      6.488003 0.96 
1 1 1 1   5  13 o 273.5347 3.601417 697.0468  137.3 79.53252       7.202834 0.96 
1 1 1 1   5  14 o 359.5500 3.445124 602.6072  74.0  64.44235       6.890248 0.97 
1 1 1 1   5  15 o 509.6310 5.736053 649.1665  17.4  3.304840       11.47211 0.98 
1 1 1 1   5  16 o 588.0140 5.098547 875.6953  332.5 -8.407166      10.19709 0.99 
1 1 1 1   5  17 o 224.6852 2.957220 231.5831  331.5 -53.42331      5.914441 0.91 
1 1 1 1   5  18 o 367.5264 3.627042 438.7441  184.6 17.19980       7.254084 0.98 
1 1 1 1   5  19 o 191.1392 3.042216 305.0409  172.1 -11.78342      6.084431 0.96 
1 1 1 1   5  20 o 32.58414 8.533087 110.1087  74.1  -10.58839      17.06617 0.43 
1 1 1 1   5  21 o 95.07964 4.799785 73.60922  68.6  4.107376       9.599569 0.73 
1 1 1 1   5  22 o 154.1522 3.954592 320.5158  287.9 37.77922       7.909184 0.97 
1 1 1 1   5  23 o 165.7141 3.459499 265.7995  10.8  -0.5030975     6.918999 0.98 
1 1 1 1   5  24 o 39.29358 9.751876 42.69116  252.4 -6.910187      19.50375 0.38 
1 1 1 1   5  25 o 96.40079 7.281882 139.2447  285.4 23.42159       14.56376 0.94 
1 1 1 1   5  26 o 212.2273 3.925991 286.8757  299.9 7.568604       7.851983 0.99 
1 1 1 1   5  27 o 37.24323 9.999757 24.86782  131.5 22.39633       19.99951 0.25 
1 1 1 1   5  28 o 50.23300 10.68713 108.2208  91.9  -24.30728      21.37425 0.81 
1 1 1 1   5  29 o 120.0827 6.429622 133.1712  24.4  -5.939934      12.85924 0.96 
1 1 1 1   5  30 o 51.76914 11.47840 56.08403  351.8 18.28390       22.95680 0.76 
1 1 1 1   5  31 o 38.57426 11.66493 97.35859  147.0 -9.991318      23.32986 0.87 
1 1 1 1   5  32 o 123.5460 7.304708 169.3041  343.2 18.34888       14.60942 0.98 
1 1 1 1   5  33 o 93.12601 9.831610 98.48026  249.8 1.084160       19.66322 0.96 
1 1 1 1   7  0  o 110.3863 2.091323 120.7435  332.0 -15.55058      4.182645 0.46 
1 1 1 1   7  1  o 280.5183 2.989140 369.2389  219.6 29.08636       5.978281 0.93 
1 1 1 1   7  2  o 648.9040 5.636909 1127.427  267.9 49.07507       11.27382 0.99 
1 1 1 1   7  3  o 335.0731 3.291782 633.5956  52.8  28.28085       6.583564 0.96 
1 1 1 1   7  4  o 682.3275 5.869862 855.4954  110.2 32.44604       11.73972 0.99 
1 1 1 1   7  5  o 322.2529 3.141902 734.6120  298.9 8.855316       6.283804 0.97 
1 1 1 1   7  6  o 748.6658 7.925647 1034.938  226.9 -13.08533      15.85129 0.99 
1 1 1 1   7  7  o 175.4097 2.938600 258.6630  84.4  -46.34604      5.877199 0.70 
1 1 1 1   7  8  o 263.7765 5.867206 367.9099  138.0 ?              ?        0.93 
1 1 1 1   7  9  o 400.1581 4.285713 525.2397  210.7 -14.89740      8.571425 0.97 
1 1 1 1   7  10 o 412.2220 4.370089 388.3120  317.5 52.99667       8.740177 0.97 
1 1 1 1   7  11 o 506.1119 5.392679 906.4410  345.3 27.81943       10.78536 0.99 
1 1 1 1   7  12 f 235.1878 3.252267 399.4049  146.7 3.225342       6.504534 0.00 
1 1 1 1   7  13 o 291.1418 2.839493 529.2307  150.8 30.29242       5.678985 0.96 
1 1 1 1   7  14 o 453.0278 3.815566 654.9106  191.6 -21.01294      7.631132 0.98 
1 1 1 1   7  15 o 384.5829 3.449383 653.3849  220.5 8.936462       6.898766 0.99 
1 1 1 1   7  16 o 25.94753 7.221426 58.61381  201.2 -5.561871      14.44285 0.16 
1 1 1 1   7  17 o 356.8276 3.361223 599.2016  47.3  -18.12393      6.722446 0.99 
1 1 1 1   7  18 o 39.65550 7.186296 101.0661  281.9 10.09423       14.37259 0.51 
1 1 1 1   7  19 o 320.5432 3.424393 582.4963  160.1 33.20300       6.848787 0.99 
1 1 1 1   7  20 o 291.6244 3.580124 514.4628  156.0 18.02332       7.160248 0.99 
1 1 1 1   7  21 o 139.2640 3.971785 201.0993  250.9 -9.668945      7.943569 0.96 
1 1 1 1   7  22 o 349.5975 3.886344 544.0526  287.4 5.278015       7.772688 1.00 
1 1 1 1   7  23 o 135.9820 4.474952 211.7346  143.8 6.924469       8.949903 0.97 
1 1 1 1   7  24 o 68.69814 8.529920 113.8614  227.7 27.10022       17.05984 0.91 
1 1 1 1   7  25 o 75.66889 11.54170 106.9056  260.5 -19.31870      23.08341 0.89 
1 1 1 1   7  26 o 39.59650 11.00902 32.83762  121.4 -9.602303      22.01803 0.34 
1 1 1 1   7  27 o 54.97556 11.49969 59.91956  31.6  -0.8062172     22.99939 0.70 
1 1 1 1   7  28 o 43.77004 11.60792 30.23582  65.4  12.29977       23.21583 0.45 
1 1 1 1   7  29 o 120.3560 6.748396 142.1649  50.7  6.503281       13.49679 0.97 
1 1 1 1   7  30 o 68.03969 12.01714 98.58542  251.1 7.422142       24.03427 0.93 
1 1 1 1   7  31 o 80.07268 11.62497 133.5069  120.2 1.198853       23.24995 0.96 
1 1 1 1   7  32 o 36.32232 11.69276 51.55384  21.7  ?              ?        0.74 
1 1 1 1   9  0  o 267.1649 3.148732 553.1010  119.9 -37.52924      6.297465 0.96 
1 1 1 1   9  1  o 148.7392 2.519341 390.9461  105.0 -26.66408      5.038683 0.88 
1 1 1 1   9  2  o 209.4426 2.713489 273.8340  230.2 -35.53050      5.426979 0.89 
1 1 1 1   9  3  f 437.9420 4.063515 810.0909  352.6 -15.87863      8.127029 0.00 
1 1 1 1   9  4  o 302.4042 3.149608 591.0850  99.9  -21.80914      6.299216 0.97 
1 1 1 1   9  5  o 453.7480 4.219226 735.4031  203.6 -24.23340      8.438452 0.98 
1 1 1 1   9  6  o 374.1890 3.490571 478.7929  236.3 -71.55606      6.981143 0.97 
1 1 1 1   9  7  o 384.1135 3.609457 431.8031  334.2 -21.04861      7.218914 0.97 
1 1 1 1   9  8  o 153.4827 3.064472 247.7507  13.7  -7.580551      6.128945 0.86 
1 1 1 1   9  9  o 425.0053 5.934967 835.8457  44.3  16.27072       11.86993 0.99 
1 1 1 1   9  10 o 200.1562 4.139980 294.1436  23.6  26.54402       8.279960 0.93 
1 1 1 1   9  11 o 268.7839 4.990530 407.8608  307.8 30.82027       9.981061 0.97 
1 1 1 1   9  12 o 233.4692 4.808245 322.0803  39.0  5.773117       9.616490 0.97 
1 1 1 1   9  13 o 106.4187 6.104437 224.5075  32.9  11.02293       12.20887 0.91 
1 1 1 1   9  14 o 191.7087 3.481209 237.9562  334.3 10.69244       6.962418 0.97 
1 1 1 1   9  15 o 49.79597 7.572795 55.39006  302.9 -6.931545      15.14559 0.44 
1 1 1 1   9  16 o 195.6356 4.104429 426.1585  145.7 -11.42839      8.208858 0.98 
1 1 1 1   9  17 o 216.2483 4.366220 368.3865  97.8  33.13045       8.732440 0.98 
1 1 1 1   9  18 o 146.9034 3.514336 239.9348  156.3 -18.52217      7.028672 0.97 
1 1 1 1   9  19 o 215.3436 3.460080 341.1970  208.0 11.45596       6.920160 0.99 
1 1 1 1   9  20 f 175.1119 3.195791 290.5243  304.6 -3.589584      6.391582 0.00 
1 1 1 1   9  21 f 187.5626 3.501334 276.6126  32.9  11.41853       7.002669 0.00 
1 1 1 1   9  22 f 85.44743 6.006398 80.40051  323.2 6.475586       12.01280 0.00 
1 1 1 1   9  23 o 186.1269 3.491531 279.1228  305.7 4.766708       6.983061 0.99 
1 1 1 1   9  24 o 36.36000 9.798485 22.44376  198.4 -24.77557      19.59697 0.24 
1 1 1 1   9  25 o 71.14208 8.885752 120.3373  191.6 5.294144       17.77150 0.91 
1 1 1 1   9  26 o 43.86388 10.42343 26.14881  318.3 11.58993       20.84687 0.43 
1 1 1 1   9  27 o 64.62184 10.18143 72.61580  132.8 -29.96737      20.36287 0.89 
1 1 1 1   9  28 o 56.15643 12.64948 67.08040  325.3 -6.429722      25.29895 0.87 
1 1 1 1   9  29 o 64.73283 11.18994 110.1661  276.1 0.5201111      22.37988 0.94 
1 1 1 1   9  30 o 83.43553 11.13881 108.8698  231.9 ?              ?        0.96 
1 1 1 1   11 0  o 190.3953 2.857332 366.6882  71.7  -1.538757      5.714663 0.96 
1 1 1 1   11 1  o 120.7676 2.854131 311.2659  100.9 1.582855       5.708262 0.94 
1 1 1 1   11 2  o 224.2614 2.964549 389.6687  299.5 -26.90828      5.929098 0.97 
1 1 1 1   11 3  o 64.24781 4.539480 97.08134  280.6 23.35329       9.078960 0.56 
1 1 1 1   11 4  o 169.8109 2.624038 187.3327  199.8 -6.363510      5.248076 0.93 
1 1 1 1   11 5  o 127.0368 2.941114 304.0590  311.6 -56.62056      5.882228 0.95 
1 1 1 1   11 6  o 141.4576 2.717075 262.6485  3.7   -51.14807      5.434149 0.95 
1 1 1 1   11 7  o 218.9126 2.994497 381.8741  318.9 -37.16034      5.988993 0.98 
1 1 1 1   11 8  o 61.09386 3.971300 115.4388  326.8 -10.45800      7.942600 0.77 
1 1 1 1   11 9  o 185.4443 3.886653 317.7046  138.5 28.80074       7.773306 0.98 
1 1 1 1   11 10 o 58.46132 8.521147 132.3141  168.6 61.98670       17.04229 0.78 
1 1 1 1   11 11 o 196.8913 4.918706 338.9602  261.7 -7.571365      9.837413 0.98 
1 1 1 1   11 12 o 61.09378 10.92481 162.7851  9.7   -12.64821      21.84962 0.85 
1 1 1 1   11 13 o 98.90260 9.016757 226.3595  94.8  -45.47382      18.03351 0.95 
1 1 1 1   11 14 o 271.5222 5.541039 514.6830  99.0  -30.96225      11.08208 0.99 
1 1 1 1   11 15 o 229.4011 5.223179 433.6311  14.8  -14.29886      10.44636 0.99 
1 1 1 1   11 16 o 158.4276 6.069888 192.2051  320.2 28.32587       12.13978 0.97 
1 1 1 1   11 17 o 89.14146 9.484662 86.67383  170.3 20.76744       18.96932 0.90 
1 1 1 1   11 18 o 164.1204 5.763533 224.8097  243.4 13.54337       11.52707 0.98 
1 1 1 1   11 19 o 91.78850 11.54794 194.5051  3.0   -10.20199      23.09588 0.96 
1 1 1 1   11 20 o 124.0848 4.929237 218.1969  12.8  -27.48932      9.858475 0.97 
1 1 1 1   11 21 o 84.70523 9.989693 168.3963  67.2  15.13980       19.97939 0.94 
1 1 1 1   11 22 o 65.54646 10.16445 111.8938  131.2 -11.74938      20.32889 0.90 
1 1 1 1   11 23 o 32.08564 8.728959 70.91293  329.5 9.823143       17.45792 0.70 
1 1 1 1   11 24 o 39.25246 11.45620 49.67573  270.5 -13.98190      22.91240 0.68 
1 1 1 1   11 25 o 86.02910 8.672602 156.4151  212.0 2.561508       17.34520 0.97 
1 1 1 1   11 26 o 84.21019 8.051263 116.2491  157.4 -17.95245      16.10253 0.96 
1 1 1 1   11 27 o 63.56359 13.06431 146.3376  108.3 10.35909       26.12861 0.95 
1 1 1 1   11 28 o 23.92193 8.328110 21.81865  269.1 ?              ?        0.38 
1 1 1 1   13 0  o 139.7831 3.394766 131.6279  316.3 11.35867       6.789531 0.94 
1 1 1 1   13 1  o 179.8707 3.316746 291.7680  285.5 -7.522781      6.633491 0.98 
1 1 1 1   13 2  o 85.53267 4.606531 172.8673  8.6   -10.83291      9.213062 0.93 
1 1 1 1   13 3  o 197.5674 3.039432 261.0033  28.5  17.98718       6.078864 0.98 
1 1 1 1   13 4  o 160.2702 3.176698 298.3099  111.7 -2.099792      6.353396 0.98 
1 1 1 1   13 5  o 142.8430 3.047067 224.0757  101.2 -14.42888      6.094135 0.97 
1 1 1 1   13 6  o 78.39734 4.024785 118.6914  353.4 25.34933       8.049569 0.91 
1 1 1 1   13 7  o 157.2127 2.912422 251.5035  328.9 1.886337       5.824844 0.98 
1 1 1 1   13 8  o 29.50693 7.586730 90.92029  201.7 13.41391       15.17346 0.62 
1 1 1 1   13 9  o 168.9414 2.733140 298.0104  122.6 -40.37527      5.466279 0.98 
1 1 1 1   13 10 o 67.85257 11.35883 91.09676  289.3 40.37858       22.71766 0.85 
1 1 1 1   13 11 o 175.4586 5.589544 304.4656  195.7 -23.74474      11.17909 0.99 
1 1 1 1   13 12 o 163.8116 7.121894 334.9907  196.1 -38.91644      14.24379 0.99 
1 1 1 1   13 13 o 138.7059 7.566434 270.9372  222.3 -50.81320      15.13287 0.99 
1 1 1 1   13 14 o 64.05529 15.31926 88.04202  282.9 ?              ?        0.85 
1 1 1 1   13 15 o 84.04758 11.23376 180.1715  273.4 31.78013       22.46751 0.95 
1 1 1 1   13 16 o 140.2719 7.874545 253.9628  181.4 -29.90491      15.74909 0.98 
1 1 1 1   13 17 o 180.7224 7.327284 286.7227  147.3 -39.67757      14.65457 0.99 
1 1 1 1   13 18 o 60.03979 13.43820 82.86489  251.8 38.75439       26.87639 0.84 
1 1 1 1   13 19 o 83.65393 14.15367 134.7461  292.9 15.85435       28.30735 0.94 
1 1 1 1   13 20 f 56.56485 14.73615 112.5440  233.7 -8.775192      29.47230 0.00 
1 1 1 1   13 21 o 40.86948 13.15579 26.30164  138.9 2.903965       26.31158 0.49 
1 1 1 1   13 22 o 84.63547 14.92910 152.5145  174.8 -12.09702      29.85819 0.96 
1 1 1 1   13 23 o 65.11690 17.60746 95.74281  228.4 ?              ?        0.90 
1 1 1 1   13 24 o 37.17335 12.61967 100.9595  276.2 3.046223       25.23935 0.88 
1 1 1 1   13 25 o 57.04265 14.22549 74.39634  335.0 ?              ?        0.89 
1 1 1 1   15 0  o 125.5512 4.435897 268.4403  2.7   -21.28944      8.871794 0.98 
1 1 1 1   15 1  o 82.28159 7.541598 135.4594  246.3 2.875587       15.08320 0.95 
1 1 1 1   15 2  o 88.11829 5.925352 174.3821  164.4 -7.474983      11.85070 0.96 
1 1 1 1   15 3  o 36.30177 8.346351 64.29756  158.3 -22.34355      16.69270 0.68 
1 1 1 1   15 4  o 86.63361 5.672593 197.6541  116.6 -1.621384      11.34519 0.96 
1 1 1 1   15 5  o 120.0068 4.357639 220.5873  150.3 -14.03608      8.715279 0.98 
1 1 1 1   15 6  o 200.0516 3.498768 346.0764  288.3 -42.75935      6.997536 0.99 
1 1 1 1   15 7  o 151.1567 3.644527 233.2105  308.5 -32.66463      7.289054 0.98 
1 1 1 1   15 8  o 45.52599 8.407448 35.97112  41.9  -20.44447      16.81490 0.51 
1 1 1 1   15 9  o 40.84242 9.068237 109.3476  76.1  1.732635       18.13647 0.83 
1 1 1 1   15 10 o 49.98444 10.82810 95.01779  88.2  -15.55727      21.65619 0.84 
1 1 1 1   15 11 o 97.50569 11.27614 198.6194  19.2  -14.15634      22.55229 0.97 
1 1 1 1   15 12 o 144.2861 8.531877 356.3523  357.8 -54.75656      17.06375 0.99 
1 1 1 1   15 13 o 81.80540 14.66747 208.8778  303.7 -15.55618      29.33495 0.96 
1 1 1 1   15 14 f 56.10743 15.11753 45.90289  275.6 19.86698       30.23505 0.00 
1 1 1 1   15 15 o 48.44217 14.39424 41.86508  123.6 12.25168       28.78849 0.69 
1 1 1 1   15 16 o 46.73854 14.30318 53.90299  339.7 7.666275       28.60636 0.78 
1 1 1 1   15 17 o 55.92308 22.02116 70.50347  207.5 ?              ?        0.78 
1 1 1 1   15 18 o 78.48076 14.77214 187.8096  176.8 -28.95135      29.54427 0.97 
1 1 1 1   15 19 o 43.70845 13.95385 43.20200  133.4 -0.5028229     27.90769 0.71 
1 1 1 1   15 20 o 41.22791 13.04934 143.1549  26.3  ?              ?        0.93 
1 1 1 1   15 21 x ?        ?        127.6863  44.2  ?              ?        0.00 
1 1 1 1   17 0  f 150.2020 5.109283 319.5077  4.3   -15.47198      10.21857 0.00 
1 1 1 1   17 1  o 90.68608 9.187624 162.6622  19.2  -30.70226      18.37525 0.97 
1 1 1 1   17 2  o 47.40414 10.50670 98.33092  203.2 6.907093       21.01340 0.91 
1 1 1 1   17 3  o 124.0188 5.202240 153.9075  313.7 -5.539291      10.40448 0.98 
1 1 1 1   17 4  o 46.78941 10.15791 66.98499  296.8 17.64214       20.31582 0.87 
1 1 1 1   17 5  o 46.15942 10.19249 86.66410  186.0 10.25476       20.38498 0.90 
1 1 1 1   17 6  o 91.62466 6.371592 192.2175  97.1  -22.83086      12.74318 0.98 
1 1 1 1   17 7  o 30.55009 9.120342 87.93951  109.5 5.889591       18.24068 0.86 
1 1 1 1   17 8  o 71.46938 7.572843 99.60323  258.8 -2.732323      15.14569 0.96 
1 1 1 1   17 9  o 48.01145 9.773408 150.0798  254.0 -7.313366      19.54682 0.95 
1 1 1 1   17 10 o 77.91492 5.650425 123.3322  202.1 4.459373       11.30085 0.97 
1 1 1 1   17 11 o 71.77180 15.51645 165.5497  296.5 -28.19556      31.03290 0.96 
1 1 1 1   17 12 o 57.85405 15.79526 130.5972  322.2 4.249802       31.59053 0.93 
1 1 1 1   17 13 f 79.17884 12.31089 121.4670  117.2 -67.13055      24.62177 0.00 
1 1 1 1   17 14 o 44.42648 14.01635 27.60033  50.0  ?              ?        0.58 
1 1 1 2   0  0  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 2   0  1  x ?        ?        930.6591  0.0   ?              ?        0.00 
1 1 1 2   0  2  o 620.0995 11.33987 119.3336  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  3  o 923.3742 16.10691 5285.470  180.0 0.000000       0.000000 1.00 
1 1 1 2   0  4  o 343.8500 5.098344 1211.921  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  5  o 547.9531 7.469877 678.7345  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  6  o 203.1165 3.900500 354.8182  180.0 0.000000       0.000000 0.95 
1 1 1 2   0  7  o 109.0361 3.105347 676.3411  0.0   0.000000       0.000000 0.98 
1 1 1 2   0  8  o 41.41065 3.931834 142.8880  180.0 0.000000       0.000000 0.24 
1 1 1 2   0  9  f 141.1485 3.280703 268.3229  0.0   0.000000       0.000000 0.00 
1 1 1 2   0  10 o 87.89101 3.145957 44.74717  180.0 0.000000       0.000000 0.06 
1 1 1 2   0  11 o 109.8222 3.327292 226.7441  180.0 0.000000       0.000000 0.72 
1 1 1 2   0  12 o 371.5218 5.341211 622.2994  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  13 o 1496.406 17.37322 2285.334  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  14 o 390.2691 5.837293 959.5400  180.0 0.000000       0.000000 1.00 
1 1 1 2   0  15 o 548.8051 7.279769 572.9500  180.0 0.000000       0.000000 1.00 
1 1 1 2   0  16 o 176.8326 6.203427 94.18791  180.0 0.000000       0.000000 0.71 
1 1 1 2   0  17 o 78.67115 5.946412 27.32875  180.0 0.000000       0.000000 0.08 
1 1 1 2   0  18 o 398.2520 5.652970 378.0406  180.0 0.000000       0.000000 1.00 
1 1 1 2   0  19 o 286.1697 4.851748 190.7451  180.0 0.000000       0.000000 0.98 
1 1 1 2   0  20 o 62.95255 7.993954 3.316226  180.0 0.000000       0.000000 0.01 
1 1 1 2   0  21 o 548.1369 7.629840 739.2451  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  22 o 208.2170 4.832820 235.3331  180.0 0.000000       0.000000 1.00 
1 1 1 2   0  23 o 278.3997 5.179645 453.9227  180.0 0.000000       0.000000 1.00 
1 1 1 2   0  24 o 111.1440 6.284097 70.68710  180.0 0.000000       0.000000 0.89 
1 1 1 2   0  25 o 176.8608 5.797088 254.4017  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  26 o 46.49021 16.60175 40.53665  180.0 0.000000       0.000000 0.42 
1 1 1 2   0  27 o 59.01089 16.06848 75.17075  180.0 0.000000       0.000000 0.89 
1 1 1 2   0  28 o 48.36620 22.34846 23.54370  0.0   0.000000       0.000000 0.30 
1 1 1 2   0  29 o 230.2201 6.540885 248.4136  0.0   0.000000       0.000000 1.00 
1 1 1 2   0  30 o 23.96196 16.14950 1.916266  180.0 0.000000       0.000000 0.01 
1 1 1 2   0  31 o 21.29260 14.78877 30.56899  180.0 0.000000       0.000000 0.25 
1 1 1 2   0  32 o 53.50485 22.55183 61.03762  0.0   0.000000       0.000000 0.88 
1 1 1 2   0  33 o 53.19020 23.28168 61.66047  180.0 0.000000       0.000000 0.89 
1 1 1 2   0  34 o 34.51762 20.82193 99.04539  180.0 0.000000       0.000000 0.94 
1 1 1 2   0  35 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 2   2  0  x ?        ?        1698.078  303.1 ?              ?        0.00 
1 1 1 2   2  1  o 598.4255 6.659057 1683.484  97.1  34.06732       13.31811 0.99 
1 1 1 2   2  2  o 147.7281 2.495816 1045.521  7.5   115.3431       4.991632 0.85 
1 1 1 2   2  3  o 367.1038 3.306023 1210.543  109.7 -29.23001      6.612046 0.97 
1 1 1 2   2  4  o 420.1042 3.634056 1416.964  247.4 -1.681519      7.268111 0.98 
1 1 1 2   2  5  o 205.1324 2.489488 1471.153  98.5  58.82266       4.978976 0.93 
1 1 1 2   2  6  o 606.4937 5.480080 997.3195  173.8 -25.93250      10.96016 0.99 
1 1 1 2   2  7  o 155.6424 2.314075 521.9171  160.8 -62.21378      4.628149 0.72 
1 1 1 2   2  8  o 119.2546 2.080442 344.3823  30.6  14.08999       4.160883 0.64 
1 1 1 2   2  9  o 327.8831 3.522969 619.2937  263.4 -76.55356      7.045937 0.97 
1 1 1 2   2  10 o 132.1303 2.190477 104.7745  238.3 44.00144       4.380953 0.83 
1 1 1 2   2  11 o 280.5980 3.204169 391.3787  209.9 15.98276       6.408338 0.94 
1 1 1 2   2  12 o 67.72651 3.213034 326.6034  90.7  32.17059       6.426067 0.48 
1 1 1 2   2  13 o 407.6128 4.019222 512.9317  222.8 -8.656158      8.038445 0.97 
1 1 1 2   2  14 o 806.7279 6.981551 1055.192  25.4  54.43073       13.96310 0.99 
1 1 1 2   2  15 f 313.4368 3.302184 516.3773  282.3 72.93463       6.604367 0.00 
1 1 1 2   2  16 o 268.4099 3.028732 328.0865  210.7 68.22435       6.057465 0.92 
1 1 1 2   2  17 o 310.1497 3.375409 523.6808  184.8 18.00870       6.750818 0.96 
1 1 1 2   2  18 f 136.1971 2.724013 274.3052  215.9 6.917435       5.448026 0.00 
1 1 1 2   2  19 o 417.8839 4.221320 465.7183  170.7 -13.04861      8.442639 0.98 
1 1 1 2   2  20 f 290.5911 3.290577 427.1246  342.6 7.468353       6.581154 0.00 
1 1 1 2   2  21 o 251.5995 4.150264 422.0277  304.7 18.66095       8.300529 0.98 
1 1 1 2   2  22 o 372.1859 4.006685 523.4698  205.8 43.03516       8.013371 0.99 
1 1 1 2   2  23 o 134.4027 4.630430 189.3600  232.8 41.37004       9.260859 0.93 
1 1 1 2   2  24 o 41.14859 9.354439 60.08184  310.5 12.18233       18.70888 0.44 
1 1 1 2   2  25 o 40.36410 10.22608 74.36874  101.1 4.402008       20.45215 0.57 
1 1 1 2   2  26 f 264.5239 3.931279 310.6793  217.8 24.16994       7.862558 0.00 
1 1 1 2   2  27 o 109.6562 5.712031 112.2648  281.2 18.39245       11.42406 0.95 
1 1 1 2   2  28 o 97.69131 7.102717 121.9684  323.4 -24.44894      14.20543 0.93 
1 1 1 2   2  29 o 49.73708 11.12709 79.59661  109.6 -7.521530      22.25418 0.72 
1 1 1 2   2  30 o 142.4084 6.122133 201.4759  105.9 7.910446       12.24427 0.97 
1 1 1 2   2  31 o 80.04034 10.21558 114.2829  280.2 -8.474403      20.43116 0.93 
1 1 1 2   2  32 o 133.4194 6.442647 148.6746  206.2 -11.16012      12.88529 0.98 
1 1 1 2   2  33 o 93.87396 9.347057 108.3710  141.9 -5.325661      18.69411 0.96 
1 1 1 2   2  34 o 44.36996 13.07717 64.96260  266.1 3.659889       26.15433 0.82 
1 1 1 2   4  0  o 336.6559 3.433091 524.1107  264.8 60.85464       6.866181 0.97 
1 1 1 2   4  1  f 562.8236 5.220458 812.9647  296.4 67.12292       10.44092 0.00 
1 1 1 2   4  2  o 198.1156 2.462404 520.4224  84.8  -27.51620      4.924808 0.61 
1 1 1 2   4  3  o 590.2484 6.646426 1510.011  280.7 -7.694275      13.29285 0.99 
1 1 1 2   4  4  o 289.3952 3.920740 950.1199  119.4 -26.67255      7.841479 0.95 
1 1 1 2   4  5  o 157.4427 2.604061 355.2243  237.3 -19.43118      5.208121 0.72 
1 1 1 2   4  6  o 114.7379 2.378674 523.8658  121.8 62.09829       4.757348 0.66 
1 1 1 2   4  7  o 128.6616 1.804854 373.1998  63.3  -25.56113      3.609707 0.88 
1 1 1 2   4  8  f 368.5131 3.343134 669.7937  70.8  -98.58841      6.686267 0.00 
1 1 1 2   4  9  o 93.36242 1.921190 323.3928  36.3  43.34616       3.842381 0.56 
1 1 1 2   4  10 o 139.6197 2.200935 386.1029  237.0 32.03483       4.401870 0.81 
1 1 1 2   4  11 o 410.5876 3.822470 564.3673  266.0 51.77567       7.644940 0.97 
1 1 1 2   4  12 o 475.6208 4.366076 637.9708  79.9  14.32806       8.732151 0.98 
1 1 1 2   4  13 o 297.6582 2.984663 249.0748  102.2 37.77838       5.969327 0.92 
1 1 1 2   4  14 o 910.2151 10.86623 1190.912  84.2  ?              ?        0.99 
1 1 1 2   4  15 o 231.8342 2.806914 335.4987  65.4  13.42075       5.613828 0.90 
1 1 1 2   4  16 o 348.9452 3.513683 611.5749  300.7 26.68903       7.027367 0.97 
1 1 1 2   4  17 f 100.5467 3.557951 29.98017  77.5  26.89037       7.115903 0.00 
1 1 1 2   4  18 o 395.6193 3.843082 473.5822  121.2 -5.769714      7.686164 0.98 
1 1 1 2   4  19 o 277.1035 3.277304 407.5467  170.2 -25.03625      6.554608 0.97 
1 1 1 2   4  20 o 407.5174 4.144681 574.7516  250.5 -14.15146      8.289363 0.99 
1 1 1 2   4  21 o 206.5302 3.259604 331.5777  341.3 -4.057755      6.519207 0.98 
1 1 1 2   4  22 o 109.0723 4.508352 192.8203  314.4 12.61049       9.016705 0.92 
1 1 1 2   4  23 o 155.2837 3.691177 172.6745  118.0 -7.575073      7.382354 0.95 
1 1 1 2   4  24 o 106.1146 5.389050 182.6957  93.3  -12.64510      10.77810 0.95 
1 1 1 2   4  25 o 202.9254 3.976790 212.2120  121.6 22.07462       7.953580 0.98 
1 1 1 2   4  26 o 61.67171 9.120399 111.6024  91.7  -45.73229      18.24080 0.89 
1 1 1 2   4  27 o 86.70091 7.238949 125.4040  296.1 0.7483826      14.47790 0.93 
1 1 1 2   4  28 o 142.0093 5.270141 176.5561  210.2 18.98460       10.54028 0.96 
1 1 1 2   4  29 o 179.9221 5.068684 204.2800  178.6 -0.1064301     10.13737 0.98 
1 1 1 2   4  30 o 54.70542 11.55056 98.14671  126.4 -18.71235      23.10113 0.87 
1 1 1 2   4  31 o 133.1443 6.828321 171.7413  213.6 0.3172455      13.65664 0.98 
1 1 1 2   4  32 o 114.1297 7.891998 134.9619  292.8 11.74853       15.78400 0.97 
1 1 1 2   4  33 o 72.73747 13.03398 123.0911  229.8 -1.010323      26.06796 0.95 
1 1 1 2   4  34 o 79.25957 16.03776 146.6879  237.1 ?              ?        0.96 
1 1 1 2   6  0  o 387.3307 5.304546 626.1462  268.6 ?              ?        0.98 
1 1 1 2   6  1  o 212.2876 2.602154 553.9510  298.8 28.45857       5.204308 0.92 
1 1 1 2   6  2  o 63.16978 2.147078 313.0061  239.2 12.24701       4.294156 0.49 
1 1 1 2   6  3  o 108.4326 2.051740 89.28919  297.2 56.16821       4.103481 0.65 
1 1 1 2   6  4  o 176.7578 2.223561 263.7248  235.9 -30.58548      4.447122 0.86 
1 1 1 2   6  5  o 122.7905 2.767709 529.0408  93.4  17.11294       5.535419 0.82 
1 1 1 2   6  6  o 153.9450 2.704518 676.2885  96.1  -4.942627      5.409035 0.91 
1 1 1 2   6  7  o 610.6028 6.257741 966.4193  284.8 20.13965       12.51548 0.99 
1 1 1 2   6  8  o 231.8653 2.998805 505.0291  33.7  1.339050       5.997609 0.92 
1 1 1 2   6  9  o 47.52641 3.368649 180.0138  38.7  ?              ?        0.14 
1 1 1 2   6  10 o 525.9163 5.519017 728.8441  243.9 -27.82843      11.03803 0.98 
1 1 1 2   6  11 o 158.8658 2.469593 264.6552  321.1 54.91521       4.939186 0.87 
1 1 1 2   6  12 f 340.8946 4.069110 406.2401  99.0  27.26559       8.138220 0.00 
1 1 1 2   6  13 o 175.6007 2.403647 254.1886  73.1  -6.313873      4.807293 0.88 
1 1 1 2   6  14 f 434.8454 3.871286 714.6960  245.4 2.391541       7.742572 0.00 
1 1 1 2   6  15 o 574.0094 4.695105 649.6081  248.7 -21.83972      9.390210 0.99 
1 1 1 2   6  16 o 126.9106 3.067344 284.9888  31.0  30.61844       6.134689 0.89 
1 1 1 2   6  17 o 272.1590 3.167533 258.6169  58.1  18.70703       6.335065 0.96 
1 1 1 2   6  18 o 142.1981 3.063158 305.2482  197.7 16.94449       6.126317 0.95 
1 1 1 2   6  19 o 103.7673 4.742184 107.6970  174.6 -17.42759      9.484367 0.83 
1 1 1 2   6  20 f 348.0982 3.758986 520.5167  99.3  21.71017       7.517972 0.00 
1 1 1 2   6  21 o 110.5994 4.445742 211.6044  171.0 -10.59986      8.891484 0.94 
1 1 1 2   6  22 o 225.1282 3.422601 272.2282  274.8 2.833313       6.845201 0.98 
1 1 1 2   6  23 o 39.97493 9.296642 6.269651  353.5 -17.84310      18.59328 0.06 
1 1 1 2   6  24 o 143.8529 4.329487 317.1657  208.6 21.35506       8.658974 0.98 
1 1 1 2   6  25 o 272.9969 3.893036 366.2514  176.2 17.58942       7.786072 0.99 
1 1 1 2   6  26 o 139.2639 5.848057 180.1940  316.6 -27.01076      11.69611 0.97 
1 1 1 2   6  27 o 109.3624 6.385847 114.9109  205.9 14.48647       12.77169 0.93 
1 1 1 2   6  28 o 161.0641 5.050442 219.5157  148.4 17.28239       10.10088 0.98 
1 1 1 2   6  29 o 99.11908 8.091640 66.12025  54.6  2.736580       16.18328 0.91 
1 1 1 2   6  30 o 94.97989 8.161389 77.26864  176.4 -0.9910583E-01 16.32278 0.94 
1 1 1 2   6  31 o 100.7241 8.453556 146.0608  91.0  -3.309044      16.90711 0.97 
1 1 1 2   6  32 o 39.88758 12.02570 44.49819  244.4 -5.279167      24.05141 0.70 
1 1 1 2   6  33 x ?        ?        20.59140  127.4 ?              ?        0.00 
1 1 1 2   8  0  o 357.5744 4.974870 326.7001  17.6  ?              ?        0.94 
1 1 1 2   8  1  o 448.0153 4.281606 767.8417  262.9 -3.785675      8.563211 0.98 
1 1 1 2   8  2  o 308.9508 3.215506 753.1844  133.6 -14.78653      6.431011 0.97 
1 1 1 2   8  3  o 290.5245 2.987277 412.4695  36.8  -6.118530      5.974553 0.94 
1 1 1 2   8  4  o 344.6144 3.273679 501.9578  336.8 -69.82410      6.547358 0.95 
1 1 1 2   8  5  o 236.7568 2.576714 417.3283  219.5 2.553299       5.153428 0.92 
1 1 1 2   8  6  o 578.7624 4.906509 818.5613  254.6 -4.714355      9.813018 0.99 
1 1 1 2   8  7  o 392.6905 4.631284 542.7168  267.2 20.93829       9.262568 0.97 
1 1 1 2   8  8  o 298.4586 3.893054 423.6369  330.4 37.42328       7.786107 0.95 
1 1 1 2   8  9  o 59.10410 6.773810 81.48722  18.9  19.87663       13.54762 0.33 
1 1 1 2   8  10 o 239.9341 3.665028 296.0908  296.7 -0.2153931     7.330056 0.92 
1 1 1 2   8  11 f 123.1014 3.106770 215.6645  268.5 -5.851166      6.213541 0.00 
1 1 1 2   8  12 o 192.1251 3.386919 443.7574  189.8 11.52080       6.773839 0.95 
1 1 1 2   8  13 o 259.8551 3.694687 331.2687  350.6 28.08168       7.389374 0.96 
1 1 1 2   8  14 o 150.5962 3.956023 257.8916  355.2 36.10909       7.912045 0.93 
1 1 1 2   8  15 o 118.6812 4.064602 109.6059  240.1 13.75655       8.129204 0.85 
1 1 1 2   8  16 o 69.40881 4.709316 88.11393  22.2  1.382591       9.418633 0.68 
1 1 1 2   8  17 o 170.8483 2.863696 325.2234  244.0 -13.51421      5.727393 0.97 
1 1 1 2   8  18 o 129.2200 3.139187 195.8204  218.4 -32.31893      6.278375 0.94 
1 1 1 2   8  19 o 208.9986 2.908550 324.8175  176.7 -36.64151      5.817100 0.98 
1 1 1 2   8  20 o 253.6130 2.971719 451.4593  277.9 6.800140       5.943438 0.99 
1 1 1 2   8  21 o 143.5515 3.654644 206.1665  327.4 32.32446       7.309289 0.97 
1 1 1 2   8  22 o 36.10295 8.691487 6.620931  98.9  -25.89417      17.38297 0.08 
1 1 1 2   8  23 o 113.1579 5.107957 190.4751  311.6 38.06314       10.21591 0.97 
1 1 1 2   8  24 o 125.5286 5.144028 187.4265  326.5 33.38599       10.28806 0.97 
1 1 1 2   8  25 o 41.15832 10.30052 55.10960  151.3 -3.107208      20.60103 0.55 
1 1 1 2   8  26 o 84.08109 8.455988 110.3263  216.7 -13.18948      16.91198 0.92 
1 1 1 2   8  27 o 31.33787 9.982631 28.69818  45.0  -5.157961      19.96526 0.35 
1 1 1 2   8  28 o 92.08240 7.988776 146.0475  75.6  5.163795       15.97755 0.97 
1 1 1 2   8  29 o 72.42999 11.43325 111.4101  98.9  5.707977       22.86651 0.94 
1 1 1 2   8  30 o 34.48188 11.15754 40.81631  245.3 -6.112564      22.31507 0.62 
1 1 1 2   8  31 o 34.95087 11.21309 31.84190  68.3  ?              ?        0.58 
1 1 1 2   10 0  o 182.9668 3.479342 272.5779  83.4  -5.278748      6.958683 0.90 
1 1 1 2   10 1  o 349.5609 3.558868 696.4135  220.6 31.36670       7.117735 0.98 
1 1 1 2   10 2  o 565.8297 5.073801 966.8122  186.9 -13.20917      10.14760 0.99 
1 1 1 2   10 3  o 700.6254 6.027894 1100.782  96.6  6.828003       12.05579 0.99 
1 1 1 2   10 4  o 232.3514 3.278588 343.8023  78.8  -47.73181      6.557176 0.95 
1 1 1 2   10 5  o 107.0750 2.747514 95.21362  111.4 -1.343964      5.495028 0.53 
1 1 1 2   10 6  o 369.6210 3.599911 523.0333  91.8  -2.085449      7.199823 0.98 
1 1 1 2   10 7  f 208.2329 2.626991 347.3413  132.9 -52.80902      5.253983 0.00 
1 1 1 2   10 8  o 77.65385 3.007441 161.8975  172.1 -37.31165      6.014882 0.73 
1 1 1 2   10 9  o 82.74988 4.857438 114.8383  169.5 0.8282471      9.714875 0.69 
1 1 1 2   10 10 o 155.3417 5.227149 321.8534  268.9 -31.89433      10.45430 0.96 
1 1 1 2   10 11 o 190.0511 4.735491 312.0697  8.6   -0.3801880     9.470982 0.98 
1 1 1 2   10 12 o 195.3051 4.880264 381.5383  114.9 -31.27644      9.760528 0.98 
1 1 1 2   10 13 f 55.99403 11.86570 310.8080  257.8 7.973057       23.73141 0.00 
1 1 1 2   10 14 o 98.37927 8.082157 190.0082  286.9 -30.43879      16.16431 0.92 
1 1 1 2   10 15 o 161.2598 5.678119 253.6130  312.1 -27.67702      11.35624 0.97 
1 1 1 2   10 16 f 138.2129 4.080030 264.1660  36.0  -14.50523      8.160060 0.00 
1 1 1 2   10 17 o 274.1359 4.163384 458.1474  91.6  11.26959       8.326769 0.99 
1 1 1 2   10 18 o 31.43616 8.059932 11.58623  95.2  2.944931       16.11986 0.10 
1 1 1 2   10 19 o 208.4800 4.076394 319.4317  276.4 0.4104309      8.152787 0.99 
1 1 1 2   10 20 o 71.61459 9.371309 163.8347  41.8  5.053856       18.74262 0.95 
1 1 1 2   10 21 o 185.2239 4.467860 277.4799  60.5  5.664810       8.935719 0.99 
1 1 1 2   10 22 o 33.71224 9.742044 91.30870  68.0  -5.259972      19.48409 0.67 
1 1 1 2   10 23 o 114.9962 4.688925 178.3883  336.9 -23.89452      9.377850 0.96 
1 1 1 2   10 24 o 57.05711 9.754272 136.9786  303.7 12.05121       19.50854 0.91 
1 1 1 2   10 25 o 153.9856 4.712371 195.9451  265.0 -9.304077      9.424743 0.98 
1 1 1 2   10 26 o 42.06796 10.99424 58.42646  57.5  -17.11216      21.98847 0.79 
1 1 1 2   10 27 o 78.75832 9.769535 140.6528  67.2  -9.793045      19.53907 0.96 
1 1 1 2   10 28 o 63.42604 11.45972 118.5222  40.3  9.494530       22.91943 0.94 
1 1 1 2   10 29 o 42.81960 11.77689 39.50179  233.5 ?              ?        0.73 
1 1 1 2   12 0  o 210.5109 3.047604 358.3353  310.4 -29.30399      6.095207 0.98 
1 1 1 2   12 1  o 155.6360 2.971753 397.1823  263.3 -2.013138      5.943506 0.98 
1 1 1 2   12 2  o 226.1741 2.965124 405.2921  193.2 4.495010       5.930248 0.99 
1 1 1 2   12 3  o 42.63791 6.976974 39.53533  87.3  6.131958       13.95395 0.27 
1 1 1 2   12 4  o 55.44198 6.402269 166.6495  308.8 -39.55788      12.80454 0.83 
1 1 1 2   12 5  o 158.9969 2.814264 316.0503  183.6 31.92940       5.628529 0.97 
1 1 1 2   12 6  o 76.19626 4.582749 136.2397  76.4  7.901031       9.165499 0.85 
1 1 1 2   12 7  o 110.8394 3.152125 198.3251  303.7 -1.861526      6.304249 0.94 
1 1 1 2   12 8  o 213.2478 2.846235 333.6134  347.1 -20.39255      5.692470 0.98 
1 1 1 2   12 9  o 206.6778 2.631321 305.1736  66.2  -34.05376      5.262643 0.98 
1 1 1 2   12 10 o 97.96801 7.786651 119.8427  240.0 11.24799       15.57330 0.91 
1 1 1 2   12 11 f 45.65143 10.84774 49.23829  133.1 24.30910       21.69547 0.00 
1 1 1 2   12 12 o 145.7891 5.798843 217.7096  38.1  -0.6747131     11.59769 0.97 
1 1 1 2   12 13 o 142.2036 6.468731 288.2804  206.1 -31.44810      12.93746 0.98 
1 1 1 2   12 14 o 135.7809 6.957085 222.8271  192.9 10.05141       13.91417 0.98 
1 1 1 2   12 15 o 143.9503 7.500206 272.1257  38.6  -15.49861      15.00041 0.98 
1 1 1 2   12 16 o 228.7623 5.716569 428.2346  61.6  12.07770       11.43314 0.99 
1 1 1 2   12 17 o 109.8488 8.727509 166.2302  339.1 1.100380       17.45502 0.96 
1 1 1 2   12 18 o 216.0525 6.215667 330.4085  231.7 -41.67207      12.43133 0.99 
1 1 1 2   12 19 o 65.32254 14.60841 67.92934  232.6 -2.154251      29.21683 0.78 
1 1 1 2   12 20 o 146.6842 7.933384 185.3700  295.4 -10.43626      15.86677 0.98 
1 1 1 2   12 21 o 53.58349 14.05677 141.6628  349.1 -21.11013      28.11354 0.91 
1 1 1 2   12 22 o 63.51699 13.12292 116.7306  234.1 52.56968       26.24584 0.92 
1 1 1 2   12 23 o 99.86079 6.733079 153.9276  229.6 -3.116531      13.46616 0.98 
1 1 1 2   12 24 o 59.56377 11.54279 95.42638  165.4 -8.893021      23.08558 0.92 
1 1 1 2   12 25 o 33.92730 10.46578 39.12749  355.0 -7.427679      20.93156 0.64 
1 1 1 2   12 26 o 36.47041 11.23093 37.42075  209.4 ?              ?        0.67 
1 1 1 2   14 0  o 143.5411 3.545737 227.7417  346.0 -5.171555      7.091474 0.98 
1 1 1 2   14 1  o 81.72830 5.456912 50.89623  283.1 9.319008       10.91382 0.80 
1 1 1 2   14 2  o 76.38383 6.783968 129.7716  144.7 2.718491       13.56794 0.92 
1 1 1 2   14 3  o 54.83371 7.658220 21.60358  87.6  5.053486       15.31644 0.38 
1 1 1 2   14 4  f 46.89127 7.517454 101.9240  326.1 -20.69169      15.03491 0.00 
1 1 1 2   14 5  o 87.40698 4.228738 158.4438  215.1 18.76348       8.457477 0.95 
1 1 1 2   14 6  o 35.83095 7.362943 83.22913  280.7 -22.62637      14.72589 0.76 
1 1 1 2   14 7  o 139.1751 3.452217 338.4228  342.9 -10.04155      6.904434 0.99 
1 1 1 2   14 8  o 36.73611 8.372606 87.87135  153.9 -16.58768      16.74521 0.81 
1 1 1 2   14 9  o 38.64372 8.636683 112.7210  146.3 2.818153       17.27337 0.86 
1 1 1 2   14 10 o 51.26549 9.330058 105.3482  341.6 9.655293       18.66012 0.87 
1 1 1 2   14 11 f 120.3976 10.27083 212.0383  176.3 15.65765       20.54165 0.00 
1 1 1 2   14 12 o 72.30078 12.59352 34.95992  155.7 -2.054253      25.18704 0.60 
1 1 1 2   14 13 o 41.20362 18.69277 61.10732  312.7 ?              ?        0.54 
1 1 1 2   14 14 o 163.8980 7.446193 264.0317  3.0   2.023270       14.89239 0.98 
1 1 1 2   14 15 o 104.8769 10.47560 171.4716  71.7  -5.484810      20.95120 0.96 
1 1 1 2   14 16 o 106.7016 10.56587 169.4874  320.4 4.587166       21.13173 0.97 
1 1 1 2   14 17 o 95.94667 13.07096 113.2026  286.8 ?              ?        0.95 
1 1 1 2   14 18 o 38.67206 12.39789 84.48560  96.3  12.76468       24.79578 0.84 
1 1 1 2   14 19 o 44.80733 13.60026 14.20031  263.0 23.90899       27.20052 0.33 
1 1 1 2   14 20 o 43.46595 13.56947 38.57980  243.4 11.00681       27.13894 0.67 
1 1 1 2   14 21 o 49.49913 14.30155 49.06775  128.7 6.455921       28.60310 0.77 
1 1 1 2   14 22 o 59.86524 16.30251 103.1088  114.8 -0.4484749     32.60502 0.91 
1 1 1 2   14 23 o 47.70381 14.99996 48.70254  46.9  ?              ?        0.78 
1 1 1 2   16 0  o 124.8826 6.696595 193.8310  339.7 7.325226       13.39319 0.98 
1 1 1 2   16 1  o 107.7937 5.149604 157.1572  20.1  6.953705       10.29921 0.97 
1 1 1 2   16 2  o 82.45036 7.508230 136.0923  14.3  -20.87109      15.01646 0.95 
1 1 1 2   16 3  o 169.6281 3.985759 361.7357  51.3  -13.53822      7.971519 0.99 
1 1 1 2   16 4  o 35.61937 9.526097 123.1792  337.3 2.829037       19.05219 0.85 
1 1 1 2   16 5  o 38.87630 9.174947 71.43140  246.9 -2.587605      18.34989 0.76 
1 1 1 2   16 6  o 97.70718 5.424325 140.1079  34.3  -22.68387      10.84865 0.96 
1 1 1 2   16 7  f 86.89440 5.841577 170.1054  324.4 -9.612488      11.68315 0.00 
1 1 1 2   16 8  o 122.8547 4.382025 211.7688  273.7 -11.14288      8.764050 0.98 
1 1 1 2   16 9  o 46.78387 9.335170 82.74185  313.4 0.5749435      18.67034 0.88 
1 1 1 2   16 10 o 27.20142 8.110463 20.33508  346.7 -6.849388      16.22093 0.33 
1 1 1 2   16 11 o 42.86060 13.58235 34.84126  209.3 13.78798       27.16470 0.61 
1 1 1 2   16 12 o 65.45929 16.09810 56.20061  270.5 -0.2829361     32.19621 0.84 
1 1 1 2   16 13 o 54.42897 14.98458 33.15415  280.5 -17.37093      29.96917 0.67 
1 1 1 2   16 14 o 42.43194 13.29758 96.65685  106.6 -7.734333      26.59517 0.88 
1 1 1 2   16 15 o 56.35542 15.50111 23.58718  352.9 10.99955       31.00221 0.54 
1 1 1 2   16 16 o 46.55245 14.59777 36.44126  296.6 6.113182       29.19554 0.67 
1 1 1 2   16 17 o 40.50443 13.21982 19.61119  53.9  ?              ?        0.44 
1 1 1 2   16 18 x ?        ?        40.58859  315.3 ?              ?        0.00 
1 1 1 2   18 0  o 39.47158 10.36073 21.48112  103.9 -5.527996      20.72146 0.51 
1 1 1 2   18 1  o 65.84772 9.850264 111.6338  85.5  -24.24163      19.70053 0.95 
1 1 1 2   18 2  o 30.26831 10.06159 11.37269  225.6 8.500071       20.12317 0.24 
1 1 1 2   18 3  o 28.71413 9.371230 66.50436  130.3 16.67726       18.74246 0.80 
1 1 1 2   18 4  f 35.53372 11.09800 67.29842  166.7 -7.560375      22.19600 0.00 
1 1 1 2   18 5  o 44.89711 10.55449 36.29782  176.0 3.449242       21.10898 0.75 
1 1 1 2   18 6  o 73.99284 8.853119 155.5776  40.9  -15.05549      17.70624 0.97 
1 1 1 2   18 7  o 35.75122 9.321586 56.37392  351.6 ?              ?        0.83 
1 1 1 2   18 8  o 42.77647 9.906909 93.44463  337.2 ?              ?        0.92 
1 1 1 2   18 9  o 37.11424 10.11349 122.6270  325.7 ?              ?        0.93 
1 1 1 3   1  0  o 515.7147 9.296027 4744.623  137.9 ?              ?        0.99 
1 1 1 3   1  1  o 235.6117 3.295378 525.7605  145.7 7.681946       6.590755 0.91 
1 1 1 3   1  2  x ?        ?        3933.746  211.5 ?              ?        0.00 
1 1 1 3   1  3  o 518.9789 4.502320 1012.689  352.0 -29.30554      9.004641 0.98 
1 1 1 3   1  4  x ?        ?        800.9869  338.9 ?              ?        0.00 
1 1 1 3   1  5  o 1066.353 9.064284 1378.431  14.8  64.26880       18.12857 1.00 
1 1 1 3   1  6  o 701.5615 6.506409 1523.440  98.2  -62.75629      13.01282 0.99 
1 1 1 3   1  7  o 383.5050 4.089309 1083.168  292.9 -104.8267      8.178617 0.96 
1 1 1 3   1  8  o 54.28929 2.713873 734.6535  86.2  -19.33147      5.427746 0.50 
1 1 1 3   1  9  o 169.7463 2.616047 452.3140  266.4 -98.43291      5.232095 0.87 
1 1 1 3   1  10 o 373.3291 4.008853 427.3353  258.6 85.93808       8.017706 0.96 
1 1 1 3   1  11 o 317.7444 3.603094 293.3695  163.4 -2.721252      7.206189 0.89 
1 1 1 3   1  12 o 451.4149 4.564246 853.4941  134.7 -102.7258      9.128492 0.97 
1 1 1 3   1  13 o 362.0468 3.803126 533.4845  72.6  57.88837       7.606252 0.94 
1 1 1 3   1  14 o 765.5194 6.802636 885.2780  255.6 -1.908447      13.60527 0.99 
1 1 1 3   1  15 o 274.2135 3.196152 167.0996  295.7 77.64413       6.392304 0.89 
1 1 1 3   1  16 o 340.6981 3.538761 336.2510  328.2 49.46252       7.077523 0.94 
1 1 1 3   1  17 o 299.1605 4.133865 429.3221  235.8 -65.33347      8.267730 0.95 
1 1 1 3   1  18 o 684.0976 6.021721 818.1068  276.0 7.061523       12.04344 0.99 
1 1 1 3   1  19 f 390.8676 3.960518 449.5741  332.0 15.10971       7.921035 0.00 
1 1 1 3   1  20 o 47.17049 8.018133 139.7898  179.4 2.677517       16.03627 0.51 
1 1 1 3   1  21 o 234.4064 3.340295 258.2224  357.4 72.58221       6.680590 0.97 
1 1 1 3   1  22 f 82.07849 6.851826 114.4498  30.8  10.41753       13.70365 0.00 
1 1 1 3   1  23 o 192.2001 3.715680 311.3161  353.8 -5.513000      7.431361 0.97 
1 1 1 3   1  24 o 176.1077 3.640321 227.0442  19.1  13.45317       7.280642 0.97 
1 1 1 3   1  25 o 119.6153 6.220010 78.01447  199.6 -36.82037      12.44002 0.88 
1 1 1 3   1  26 o 320.8374 4.047486 366.7307  220.9 10.01392       8.094973 0.99 
1 1 1 3   1  27 o 98.49836 8.207533 123.0017  312.5 13.39497       16.41507 0.94 
1 1 1 3   1  28 o 127.2316 5.470182 149.9135  285.3 18.13107       10.94036 0.95 
1 1 1 3   1  29 o 114.9325 6.309944 169.4870  343.4 -10.04105      12.61989 0.95 
1 1 1 3   1  30 o 57.27362 13.12378 92.74709  113.7 -1.309307      26.24756 0.83 
1 1 1 3   1  31 o 69.78181 11.54674 48.11637  335.4 -21.24684      23.09349 0.79 
1 1 1 3   1  32 o 80.57744 10.93074 93.11771  133.4 -4.635490      21.86148 0.94 
1 1 1 3   1  33 o 42.49169 12.38581 59.79692  213.9 17.65947       24.77162 0.77 
1 1 1 3   1  34 o 36.72524 11.76460 7.202865  239.3 ?              ?        0.15 
1 1 1 3   3  0  o 445.5163 4.181935 1652.636  72.9  -51.21936      8.363870 0.98 
1 1 1 3   3  1  o 662.6814 5.921649 1213.502  107.0 77.50745       11.84330 0.99 
1 1 1 3   3  2  o 218.1659 3.314853 142.6193  27.9  -26.83350      6.629706 0.95 
1 1 1 3   3  3  o 410.4628 4.962662 712.7244  6.1   74.20688       9.925323 0.98 
1 1 1 3   3  4  o 477.0585 5.733196 875.7001  336.2 -91.11218      11.46639 0.99 
1 1 1 3   3  5  o 132.3062 2.039099 175.3594  337.3 112.7835       4.078197 0.79 
1 1 1 3   3  6  o 283.0827 2.759238 660.6906  263.1 -21.98199      5.518476 0.95 
1 1 1 3   3  7  o 295.8929 3.060480 330.1539  168.1 31.80975       6.120960 0.95 
1 1 1 3   3  8  o 109.8784 2.134971 417.4684  244.0 69.83195       4.269943 0.32 
1 1 1 3   3  9  o 271.4292 2.919791 488.0019  114.2 94.94106       5.839583 0.94 
1 1 1 3   3  10 o 214.7229 2.619180 393.2653  36.1  -20.78125      5.238361 0.91 
1 1 1 3   3  11 f 441.6459 4.242371 589.8046  265.4 26.93661       8.484742 0.00 
1 1 1 3   3  12 o 174.9033 3.508886 404.3491  87.5  ?              ?        0.87 
1 1 1 3   3  13 o 505.3496 4.601172 806.9792  102.3 68.76801       9.202345 0.98 
1 1 1 3   3  14 o 214.3311 2.710103 225.9061  104.8 72.22156       5.420207 0.84 
1 1 1 3   3  15 f 497.3975 5.527132 761.1202  12.4  31.79080       11.05426 0.00 
1 1 1 3   3  16 o 289.4810 3.055959 319.6006  340.9 11.86298       6.111917 0.93 
1 1 1 3   3  17 o 323.7015 3.350766 442.9817  172.2 40.63394       6.701532 0.96 
1 1 1 3   3  18 f 287.0026 3.258548 349.9043  219.5 49.55286       6.517097 0.00 
1 1 1 3   3  19 o 60.06674 5.544031 123.8354  147.7 11.38741       11.08806 0.47 
1 1 1 3   3  20 o 246.3746 4.012634 343.9119  36.3  -24.38936      8.025268 0.97 
1 1 1 3   3  21 o 163.4109 3.193038 165.0761  319.6 -35.66248      6.386076 0.93 
1 1 1 3   3  22 f 219.2633 4.127002 227.9922  241.1 0.8637390      8.254004 0.00 
1 1 1 3   3  23 o 44.50827 9.203907 65.26186  210.6 -11.90354      18.40781 0.44 
1 1 1 3   3  24 o 185.5896 3.608001 280.5564  80.4  11.42189       7.216003 0.98 
1 1 1 3   3  25 o 320.9353 4.078736 553.2362  91.1  42.24182       8.157473 0.99 
1 1 1 3   3  26 o 30.13211 9.442983 82.77697  102.7 -0.5796375     18.88597 0.61 
1 1 1 3   3  27 o 131.8057 5.151234 102.1451  97.6  -10.12078      10.30247 0.95 
1 1 1 3   3  28 o 82.78592 8.938906 55.95143  354.8 -12.00201      17.87781 0.76 
1 1 1 3   3  29 f 43.90768 11.87035 78.49142  284.2 14.39787       23.74069 0.00 
1 1 1 3   3  30 o 136.2585 6.011151 182.6434  110.7 -23.65286      12.02230 0.97 
1 1 1 3   3  31 o 66.88113 10.87985 96.88728  228.9 -37.58561      21.75970 0.91 
1 1 1 3   3  32 o 141.2529 7.388928 162.1035  221.4 -30.98177      14.77786 0.98 
1 1 1 3   3  33 o 76.67511 13.38972 63.89193  197.0 -34.87014      26.77943 0.89 
1 1 1 3   3  34 o 32.51158 10.80597 38.41029  38.8  ?              ?        0.62 
1 1 1 3   5  0  o 285.7561 3.078446 101.2861  349.2 54.48822       6.156892 0.93 
1 1 1 3   5  1  o 376.7471 3.750024 834.5605  257.3 -4.080811      7.500048 0.97 
1 1 1 3   5  2  o 321.1871 3.351128 199.2834  155.0 118.6557       6.702255 0.95 
1 1 1 3   5  3  o 135.0990 1.930795 202.7505  46.2  -10.92406      3.861590 0.74 
1 1 1 3   5  4  o 284.6600 3.030407 858.0423  262.2 41.41269       6.060813 0.96 
1 1 1 3   5  5  o 122.7152 2.741422 249.0028  17.3  -0.1103058     5.482845 0.17 
1 1 1 3   5  6  o 217.7714 3.254579 366.0072  325.5 -77.10083      6.509158 0.89 
1 1 1 3   5  7  o 495.8190 5.292295 998.1998  284.9 118.7635       10.58459 0.98 
1 1 1 3   5  8  f 453.4993 5.156187 864.2819  12.4  -26.41846      10.31237 0.00 
1 1 1 3   5  9  o 159.6054 2.082307 82.86042  97.1  -4.395737      4.164614 0.78 
1 1 1 3   5  10 f 755.8176 7.287563 1321.831  210.8 40.54492       14.57513 0.00 
1 1 1 3   5  11 o 401.8186 4.599216 592.2297  246.3 17.79660       9.198431 0.97 
1 1 1 3   5  12 f 234.7124 2.497709 455.7516  44.3  -9.757523      4.995419 0.00 
1 1 1 3   5  13 o 630.9728 5.435258 782.2671  282.7 53.37738       10.87052 0.99 
1 1 1 3   5  14 o 448.2772 4.127421 785.6862  137.3 -17.00552      8.254843 0.98 
1 1 1 3   5  15 o 194.4498 3.298995 293.1409  292.9 1.067322       6.597989 0.88 
1 1 1 3   5  16 o 473.8996 4.362358 726.2207  24.9  17.85535       8.724715 0.99 
1 1 1 3   5  17 o 200.9764 2.798798 187.3409  290.9 44.52425       5.597597 0.91 
1 1 1 3   5  18 o 203.9989 2.809325 328.3252  191.6 45.03006       5.618651 0.96 
1 1 1 3   5  19 o 236.4547 2.898918 384.9571  182.2 10.43878       5.797836 0.98 
1 1 1 3   5  20 o 129.7081 3.631303 221.1620  70.6  -27.88834      7.262606 0.94 
1 1 1 3   5  21 o 173.6963 3.476098 373.9574  97.2  -4.136597      6.952197 0.97 
1 1 1 3   5  22 o 50.69348 9.359966 47.38885  69.2  -3.967274      18.71993 0.44 
1 1 1 3   5  23 o 96.15558 5.437791 115.1407  152.9 -12.48601      10.87558 0.90 
1 1 1 3   5  24 o 176.1406 3.897468 324.4527  113.6 -15.31523      7.794936 0.98 
1 1 1 3   5  25 o 265.8077 3.956999 432.2241  121.1 27.75415       7.913999 0.99 
1 1 1 3   5  26 o 115.9064 5.648132 131.1606  201.7 7.102455       11.29626 0.95 
1 1 1 3   5  27 o 100.1267 7.273966 126.3023  233.8 -10.13500      14.54793 0.92 
1 1 1 3   5  28 o 156.8951 5.329222 173.8204  129.7 9.565765       10.65844 0.97 
1 1 1 3   5  29 o 43.68432 11.90692 20.09361  133.2 -5.089222      23.81384 0.30 
1 1 1 3   5  30 o 32.08782 10.44636 52.23900  197.0 1.902725       20.89272 0.62 
1 1 1 3   5  31 o 36.85373 11.63254 45.17762  80.0  -5.044140      23.26507 0.66 
1 1 1 3   5  32 o 49.61570 11.54708 69.33255  122.7 32.70121       23.09416 0.85 
1 1 1 3   5  33 o 30.15092 10.29360 23.34417  36.7  ?              ?        0.42 
1 1 1 3   7  0  o 299.6229 3.228843 461.4653  83.1  36.64163       6.457686 0.93 
1 1 1 3   7  1  o 356.2734 3.671119 680.9380  217.2 -22.45520      7.342238 0.97 
1 1 1 3   7  2  o 486.0602 4.536151 757.6949  133.3 48.82083       9.072303 0.98 
1 1 1 3   7  3  o 115.0695 2.231896 181.4633  31.8  -43.05054      4.463792 0.66 
1 1 1 3   7  4  o 384.0673 3.682971 443.5187  323.6 -55.97827      7.365943 0.97 
1 1 1 3   7  5  o 686.3798 7.381294 895.9677  42.6  25.47424       14.76259 0.99 
1 1 1 3   7  6  o 505.5196 4.517917 845.0639  54.1  9.157013       9.035834 0.98 
1 1 1 3   7  7  o 807.8940 8.279292 1134.920  293.2 -16.97748      16.55858 0.99 
1 1 1 3   7  8  o 187.3318 2.837917 524.2662  295.1 -13.55156      5.675834 0.92 
1 1 1 3   7  9  o 471.5643 4.802222 869.8183  125.4 -29.92233      9.604445 0.98 
1 1 1 3   7  10 o 389.2350 4.518836 493.9305  316.5 -6.780487      9.037673 0.97 
1 1 1 3   7  11 o 991.1576 9.679585 1461.443  308.4 13.75189       19.35917 1.00 
1 1 1 3   7  12 o 715.9832 7.402848 1080.961  351.2 -2.412354      14.80570 0.99 
1 1 1 3   7  13 o 287.8987 2.924269 416.7580  58.8  31.69846       5.848539 0.96 
1 1 1 3   7  14 o 214.2323 2.669101 277.1811  321.8 -24.71805      5.338203 0.93 
1 1 1 3   7  15 o 253.6160 2.909201 516.0105  325.1 25.96542       5.818402 0.98 
1 1 1 3   7  16 f 43.22797 6.245752 121.4121  294.9 -28.26270      12.49150 0.00 
1 1 1 3   7  17 o 108.6734 3.589860 186.4527  285.8 -59.93984      7.179721 0.92 
1 1 1 3   7  18 o 303.0259 3.251673 464.3750  342.0 31.54453       6.503347 0.99 
1 1 1 3   7  19 o 263.2711 3.014246 377.5043  350.4 17.11446       6.028493 0.98 
1 1 1 3   7  20 o 91.74376 4.978306 119.6137  340.4 19.28004       9.956613 0.88 
1 1 1 3   7  21 o 93.18448 4.558082 167.6856  291.8 -8.122932      9.116163 0.93 
1 1 1 3   7  22 o 55.26570 8.417267 67.83244  316.3 -15.39419      16.83453 0.69 
1 1 1 3   7  23 o 150.9214 4.194398 218.8790  294.0 8.557236       8.388796 0.98 
1 1 1 3   7  24 o 43.12456 9.464589 81.27650  244.6 30.59785       18.92918 0.78 
1 1 1 3   7  25 o 163.7603 4.531654 202.8824  141.4 4.124283       9.063308 0.98 
1 1 1 3   7  26 o 45.66189 10.98053 125.2287  180.8 -9.966949      21.96106 0.83 
1 1 1 3   7  27 o 163.0790 5.886236 246.5307  209.5 -19.77382      11.77247 0.98 
1 1 1 3   7  28 o 133.2533 5.845671 198.1501  119.2 18.53159       11.69134 0.98 
1 1 1 3   7  29 o 62.15719 11.31574 65.80788  68.4  18.95800       22.63149 0.87 
1 1 1 3   7  30 o 94.52893 12.49591 130.8099  172.1 -16.70603      24.99183 0.96 
1 1 1 3   7  31 o 75.49765 12.31375 135.9210  88.0  -22.84769      24.62749 0.96 
1 1 1 3   7  32 o 80.52344 12.27404 112.9257  114.5 ?              ?        0.96 
1 1 1 3   9  0  o 569.4929 5.162913 666.1560  274.0 -5.588440      10.32583 0.98 
1 1 1 3   9  1  o 224.9633 2.724453 447.2135  133.9 14.85762       5.448905 0.93 
1 1 1 3   9  2  o 663.1047 5.752580 930.9576  138.0 14.00250       11.50516 0.99 
1 1 1 3   9  3  o 371.2057 4.641878 497.7559  319.8 57.64151       9.283755 0.97 
1 1 1 3   9  4  o 396.4286 3.735437 542.5742  339.6 -26.72079      7.470874 0.97 
1 1 1 3   9  5  f 300.2655 3.464920 552.4449  200.6 38.42706       6.929840 0.00 
1 1 1 3   9  6  o 440.0558 3.994363 548.2471  214.4 10.58759       7.988726 0.98 
1 1 1 3   9  7  o 233.0178 2.673809 428.4344  146.1 32.31664       5.347618 0.94 
1 1 1 3   9  8  o 351.6068 4.689217 431.7219  105.7 -26.40887      9.378434 0.97 
1 1 1 3   9  9  o 78.60187 5.596757 191.9304  9.0   15.43948       11.19351 0.64 
1 1 1 3   9  10 o 71.06736 6.814420 190.5619  306.3 22.25432       13.62884 0.69 
1 1 1 3   9  11 o 320.3295 4.133967 472.0012  165.2 51.95901       8.267934 0.98 
1 1 1 3   9  12 o 192.8443 3.638077 216.6546  173.8 9.593765       7.276154 0.95 
1 1 1 3   9  13 o 83.85812 4.837471 217.2964  34.4  -6.177818      9.674941 0.90 
1 1 1 3   9  14 o 157.1970 3.707864 204.3715  101.2 -0.1314545     7.415727 0.95 
1 1 1 3   9  15 o 125.3404 4.228618 202.8394  10.4  37.31834       8.457235 0.94 
1 1 1 3   9  16 o 179.2957 3.860872 275.6712  340.3 -3.543396      7.721745 0.97 
1 1 1 3   9  17 o 38.23242 8.703255 142.3024  275.1 8.997482       17.40651 0.72 
1 1 1 3   9  18 o 60.86221 8.913050 168.7544  210.8 29.65963       17.82610 0.90 
1 1 1 3   9  19 o 164.5445 3.285777 312.4575  185.2 -0.3092651     6.571554 0.98 
1 1 1 3   9  20 o 42.78857 8.621655 138.8693  59.4  14.12788       17.24331 0.84 
1 1 1 3   9  21 o 158.5092 3.968938 223.5723  98.6  -18.20490      7.937877 0.98 
1 1 1 3   9  22 o 113.1617 4.664184 172.9236  128.7 -0.8124466     9.328368 0.97 
1 1 1 3   9  23 o 130.8864 4.521546 210.4455  278.8 -0.9376068     9.043092 0.97 
1 1 1 3   9  24 o 55.30238 10.09391 122.8382  271.3 2.148422       20.18783 0.87 
1 1 1 3   9  25 o 104.4795 5.681194 132.6078  119.4 -25.32648      11.36239 0.95 
1 1 1 3   9  26 o 82.51894 9.423658 118.8309  40.3  17.75999       18.84732 0.94 
1 1 1 3   9  27 o 44.83995 11.82922 38.91226  21.7  -10.82310      23.65844 0.67 
1 1 1 3   9  28 o 52.35332 12.40706 88.02214  106.7 2.219219       24.81411 0.89 
1 1 1 3   9  29 f 122.0577 7.099594 85.40655  78.5  -0.8090057     14.19919 0.00 
1 1 1 3   9  30 o 49.35986 10.69446 69.48950  51.9  ?              ?        0.89 
1 1 1 3   11 0  o 302.1270 3.433881 444.8703  142.0 29.58234       6.867761 0.98 
1 1 1 3   11 1  o 251.8862 2.983739 469.7520  187.8 10.65291       5.967479 0.98 
1 1 1 3   11 2  o 240.6413 3.067112 434.7456  149.2 -21.58543      6.134225 0.98 
1 1 1 3   11 3  o 258.7460 4.778144 474.2425  83.2  ?              ?        0.98 
1 1 1 3   11 4  o 227.1764 2.962195 343.2617  272.0 -7.856613      5.924390 0.97 
1 1 1 3   11 5  f 92.91060 3.188410 298.4595  175.5 5.224434       6.376820 0.00 
1 1 1 3   11 6  o 312.5437 3.339922 575.2844  96.3  -11.60403      6.679843 0.99 
1 1 1 3   11 7  o 240.6287 3.316237 350.2003  116.5 -30.04779      6.632475 0.98 
1 1 1 3   11 8  o 146.9960 2.681087 247.7441  261.4 -40.42691      5.362175 0.96 
1 1 1 3   11 9  o 143.2636 3.811777 302.7311  316.8 2.554337       7.623554 0.97 
1 1 1 3   11 10 o 102.2540 7.356046 98.75343  81.5  0.2815323      14.71209 0.85 
1 1 1 3   11 11 o 69.55826 10.65733 159.6241  67.7  1.867233       21.31465 0.85 
1 1 1 3   11 12 o 109.9697 6.899940 213.4824  257.9 2.219673       13.79988 0.95 
1 1 1 3   11 13 o 43.50110 11.31479 86.59418  262.9 23.02807       22.62958 0.65 
1 1 1 3   11 14 o 83.83586 9.823014 84.84148  113.5 -2.983345      19.64603 0.85 
1 1 1 3   11 15 o 39.99728 11.93803 107.5313  237.8 -6.364056      23.87606 0.74 
1 1 1 3   11 16 o 183.8566 5.671039 358.3978  40.3  19.99655       11.34208 0.99 
1 1 1 3   11 17 o 167.6123 5.739147 345.6768  197.6 7.350739       11.47829 0.99 
1 1 1 3   11 18 o 75.92546 6.920524 159.5632  157.7 -17.58053      13.84105 0.95 
1 1 1 3   11 19 o 85.55995 9.017013 134.1544  337.0 21.83918       18.03403 0.93 
1 1 1 3   11 20 o 99.00204 6.583287 161.8204  300.8 -3.101151      13.16657 0.95 
1 1 1 3   11 21 o 62.62853 10.22008 53.31531  305.0 16.63487       20.44016 0.72 
1 1 1 3   11 22 o 64.37464 9.810151 81.27040  161.3 -5.597290      19.62030 0.86 
1 1 1 3   11 23 o 107.7982 7.251632 155.4054  102.8 -18.88116      14.50326 0.97 
1 1 1 3   11 24 o 39.54413 11.32401 108.3030  66.5  -5.644222      22.64803 0.88 
1 1 1 3   11 25 o 63.41979 11.09539 72.20598  323.3 6.926495       22.19078 0.90 
1 1 1 3   11 26 o 54.15375 9.772348 53.96614  187.2 33.85241       19.54470 0.85 
1 1 1 3   11 27 o 38.81432 11.28306 104.2865  55.6  -24.85868      22.56613 0.90 
1 1 1 3   11 28 x ?        ?        124.8321  67.5  ?              ?        0.00 
1 1 1 3   13 0  o 112.9537 4.025274 193.6277  29.5  19.22556       8.050549 0.95 
1 1 1 3   13 1  o 137.5648 3.354064 251.2130  230.5 -0.5429840     6.708129 0.97 
1 1 1 3   13 2  o 243.2642 3.283539 440.9175  210.2 -23.77245      6.567077 0.99 
1 1 1 3   13 3  f 188.5402 3.836467 337.8642  73.7  6.542450       7.672935 0.00 
1 1 1 3   13 4  o 117.4251 3.742088 216.4566  348.3 -39.71191      7.484176 0.97 
1 1 1 3   13 5  o 201.5680 3.171173 386.7354  229.8 9.479614       6.342345 0.99 
1 1 1 3   13 6  o 187.1829 3.083070 282.1759  95.1  -12.27895      6.166140 0.98 
1 1 1 3   13 7  o 96.76984 3.848025 125.9583  166.9 -8.162712      7.696049 0.93 
1 1 1 3   13 8  o 174.2765 2.975148 333.7717  138.5 17.02879       5.950297 0.99 
1 1 1 3   13 9  f 108.1368 3.556466 223.2798  4.4   -21.85502      7.112931 0.00 
1 1 1 3   13 10 o 322.2430 4.841241 575.3632  358.7 -23.96564      9.682482 1.00 
1 1 1 3   13 11 o 204.6398 6.066103 363.3179  85.5  3.478592       12.13221 0.99 
1 1 1 3   13 12 o 84.72220 11.37334 161.1904  142.4 16.01763       22.74667 0.95 
1 1 1 3   13 13 o 52.81081 13.41542 65.11892  235.5 21.95886       26.83084 0.77 
1 1 1 3   13 14 o 118.0816 10.77139 231.6392  325.7 ?              ?        0.97 
1 1 1 3   13 15 o 61.61380 13.71749 62.14587  34.5  -9.281681      27.43497 0.73 
1 1 1 3   13 16 o 132.0791 7.998484 214.5947  349.7 -16.43138      15.99697 0.97 
1 1 1 3   13 17 o 95.90744 11.94731 245.8778  5.2   -5.280952      23.89462 0.97 
1 1 1 3   13 18 o 152.7963 8.623158 285.8931  89.1  6.286789       17.24632 0.99 
1 1 1 3   13 19 o 50.48889 14.01537 90.51347  53.1  27.99468       28.03075 0.85 
1 1 1 3   13 20 o 181.0992 7.578436 301.8233  23.6  -3.304596      15.15687 0.99 
1 1 1 3   13 21 o 36.75619 12.17937 40.01574  348.0 4.691177       24.35874 0.65 
1 1 1 3   13 22 o 36.97562 12.56709 53.26427  166.3 10.20607       25.13419 0.73 
1 1 1 3   13 23 o 48.00617 14.41270 71.75565  141.6 -5.643536      28.82540 0.85 
1 1 1 3   13 24 o 59.41855 16.35443 171.1968  136.7 ?              ?        0.95 
1 1 1 3   15 0  o 131.2490 4.135767 201.1335  356.6 -1.503784      8.271534 0.98 
1 1 1 3   15 1  o 75.70894 6.514872 73.31689  12.2  -4.023033      13.02974 0.89 
1 1 1 3   15 2  o 81.21293 6.972495 146.8354  226.0 -43.32126      13.94499 0.95 
1 1 1 3   15 3  o 150.4521 3.575136 302.7384  94.9  20.24818       7.150273 0.99 
1 1 1 3   15 4  o 45.82378 8.284939 35.44957  66.9  31.51889       16.56988 0.53 
1 1 1 3   15 5  o 106.6908 5.275560 233.6426  149.0 -34.66637      10.55112 0.97 
1 1 1 3   15 6  o 120.7407 4.395171 183.0268  111.7 -19.51905      8.790342 0.97 
1 1 1 3   15 7  o 52.08388 8.942418 128.3264  154.0 0.2584076E-01  17.88484 0.89 
1 1 1 3   15 8  o 80.97090 6.184202 105.6035  157.2 -24.34180      12.36840 0.92 
1 1 1 3   15 9  o 154.9489 3.491795 219.8367  145.2 -12.94658      6.983589 0.98 
1 1 1 3   15 10 o 72.29199 5.031466 184.5466  208.4 -9.821999      10.06293 0.96 
1 1 1 3   15 11 o 108.8354 10.51088 176.0553  191.9 21.04012       21.02175 0.97 
1 1 1 3   15 12 o 85.07630 14.18480 173.6021  219.2 5.145432       28.36960 0.95 
1 1 1 3   15 13 o 41.70031 12.94580 75.94147  255.2 -3.113773      25.89161 0.80 
1 1 1 3   15 14 o 96.44942 12.78240 222.8195  59.8  -24.85235      25.56480 0.98 
1 1 1 3   15 15 o 105.5018 10.02137 196.3147  56.7  1.091347       20.04274 0.98 
1 1 1 3   15 16 o 84.24626 13.54385 165.2616  335.7 -6.273827      27.08771 0.97 
1 1 1 3   15 17 o 50.76900 20.74703 105.1081  313.6 ?              ?        0.86 
1 1 1 3   15 18 o 70.11240 16.38288 166.1968  190.7 27.26976       32.76577 0.95 
1 1 1 3   15 19 o 35.78147 12.20739 109.1068  161.0 7.512825       24.41479 0.89 
1 1 1 3   15 20 o 46.66433 14.39940 49.90751  59.0  ?              ?        0.78 
1 1 1 3   17 0  o 71.52430 9.204921 128.6515  225.5 -17.18304      18.40984 0.96 
1 1 1 3   17 1  o 100.8796 7.921282 153.9547  322.3 21.08658       15.84256 0.98 
1 1 1 3   17 2  o 66.66426 8.867325 100.8541  305.5 1.482582       17.73465 0.94 
1 1 1 3   17 3  o 76.48568 7.673629 96.18634  94.3  8.136765       15.34726 0.95 
1 1 1 3   17 4  f 122.7854 5.120157 233.3711  310.5 -26.04581      10.24031 0.00 
1 1 1 3   17 5  o 124.2026 5.130110 234.8562  257.1 -5.201111      10.26022 0.99 
1 1 1 3   17 6  o 27.63986 8.801763 55.54813  197.3 1.238554       17.60353 0.75 
1 1 1 3   17 7  o 49.11985 9.650678 88.89794  4.3   -14.90900      19.30136 0.92 
1 1 1 3   17 8  o 54.31282 10.10476 92.15134  38.4  12.51292       20.20952 0.93 
1 1 1 3   17 9  o 73.21188 7.757882 148.6172  92.5  -29.11600      15.51576 0.97 
1 1 1 3   17 10 f 75.86678 5.928241 189.1103  77.3  4.347717       11.85648 0.00 
1 1 1 3   17 11 o 50.59613 15.17819 102.6581  44.1  9.755630       30.35638 0.90 
1 1 1 3   17 12 o 58.19004 15.17729 174.7552  258.4 -24.74714      30.35457 0.95 
1 1 1 3   17 13 o 66.28370 16.50026 112.4499  265.2 ?              ?        0.93 
1 1 1 3   17 14 o 39.12260 13.20875 106.0436  54.0  ?              ?        0.90 
1 1 1 4   0  0  o 678.5385 12.47533 7519.579  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  1  o 475.4995 6.662067 268.3718  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  2  o 79.06021 1.915028 1218.889  180.0 0.000000       0.000000 0.80 
1 1 1 4   0  3  o 281.7966 4.484529 566.7345  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  4  o 890.4193 10.81171 1650.971  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  5  o 173.8462 3.379583 180.7151  0.0   0.000000       0.000000 0.99 
1 1 1 4   0  6  o 1025.796 12.55081 1472.331  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  7  o 233.9455 4.147008 161.9909  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  8  o 155.9676 3.654211 307.4726  0.0   0.000000       0.000000 0.12 
1 1 1 4   0  9  o 389.6243 6.007018 793.6825  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  10 o 105.7078 3.203867 358.6745  0.0   0.000000       0.000000 0.94 
1 1 1 4   0  11 o 632.6934 8.593016 1255.157  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  12 o 369.3276 5.662428 350.9730  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  13 o 628.4390 8.240344 630.1813  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  14 o 787.2824 9.640124 1074.839  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  15 o 211.8456 4.033867 261.6901  0.0   0.000000       0.000000 0.98 
1 1 1 4   0  16 o 260.3629 4.512368 482.6368  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  17 o 195.3249 4.650588 355.1784  180.0 0.000000       0.000000 0.98 
1 1 1 4   0  18 o 325.3123 4.978709 260.2331  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  19 o 510.0391 6.891115 790.5568  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  20 o 203.0644 4.340717 343.3514  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  21 o 31.30919 15.07575 67.25119  180.0 0.000000       0.000000 0.24 
1 1 1 4   0  22 o 22.69877 13.62308 16.01120  180.0 0.000000       0.000000 0.04 
1 1 1 4   0  23 o 24.32721 14.93628 123.6658  180.0 0.000000       0.000000 0.42 
1 1 1 4   0  24 o 69.84440 9.986488 233.3308  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  25 o 164.0577 6.090407 112.9252  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  26 o 206.9645 5.811837 192.0270  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  27 o 70.53404 14.21436 51.67163  180.0 0.000000       0.000000 0.87 
1 1 1 4   0  28 o 97.50297 9.851546 78.18254  180.0 0.000000       0.000000 0.97 
1 1 1 4   0  29 o 160.5761 6.671803 225.2169  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  30 o 58.25123 21.72817 77.45110  0.0   0.000000       0.000000 0.87 
1 1 1 4   0  31 o 94.64134 11.66303 126.7607  0.0   0.000000       0.000000 1.00 
1 1 1 4   0  32 o 110.5515 11.82450 123.3317  180.0 0.000000       0.000000 1.00 
1 1 1 4   0  33 o 30.48915 20.78443 30.52559  0.0   0.000000       0.000000 0.41 
1 1 1 4   0  34 o 44.41887 22.84285 118.8055  0.0   ?              ?        0.99 
1 1 1 4   2  0  o 614.8790 5.580718 1778.240  0.2   -49.37146      11.16144 0.99 
1 1 1 4   2  1  o 662.6425 7.381191 1659.941  67.5  -30.62952      14.76238 0.99 
1 1 1 4   2  2  o 698.1714 7.841888 951.8187  278.1 -36.75256      15.68378 0.99 
1 1 1 4   2  3  o 1040.285 10.01977 1593.788  289.7 11.52039       20.03954 1.00 
1 1 1 4   2  4  o 433.6423 3.455214 472.7345  94.8  -47.29834      6.910428 0.98 
1 1 1 4   2  5  o 466.6633 4.181330 602.6819  193.7 -73.33020      8.362660 0.98 
1 1 1 4   2  6  o 211.7453 2.591439 750.4542  166.5 37.70868       5.182878 0.93 
1 1 1 4   2  7  o 370.1827 3.820786 618.8403  63.8  -25.10898      7.641571 0.97 
1 1 1 4   2  8  o 311.8669 3.387016 267.1052  200.1 -58.41605      6.774032 0.95 
1 1 1 4   2  9  o 154.5729 2.278482 787.6994  37.0  4.946442       4.556963 0.91 
1 1 1 4   2  10 o 282.8353 3.223060 377.4366  221.4 -30.76178      6.446119 0.95 
1 1 1 4   2  11 o 442.8963 4.309812 745.1146  203.1 5.527313       8.619623 0.97 
1 1 1 4   2  12 o 407.6570 4.006481 607.9199  239.4 45.08090       8.012961 0.96 
1 1 1 4   2  13 f 81.74910 4.189532 85.47431  272.8 20.88378       8.379065 0.00 
1 1 1 4   2  14 o 126.6034 3.181369 242.5196  150.8 -2.741486      6.362737 0.46 
1 1 1 4   2  15 o 561.1827 5.119771 566.7136  17.6  38.56708       10.23954 0.98 
1 1 1 4   2  16 o 334.6146 4.028049 407.5411  18.4  -13.52225      8.056097 0.95 
1 1 1 4   2  17 o 278.6332 3.261572 347.7729  277.4 -4.175262      6.523145 0.93 
1 1 1 4   2  18 o 277.7762 3.880011 421.8555  285.5 -16.05417      7.760022 0.96 
1 1 1 4   2  19 o 541.9766 6.506755 679.6716  333.8 15.46539       13.01351 0.99 
1 1 1 4   2  20 o 139.4420 3.226359 251.6360  262.2 -22.31804      6.452718 0.93 
1 1 1 4   2  21 o 145.9302 3.584691 242.0849  279.5 -8.663132      7.169381 0.95 
1 1 1 4   2  22 o 150.4261 3.448196 286.2719  18.2  40.47173       6.896392 0.96 
1 1 1 4   2  23 o 162.0858 3.621778 210.0013  3.9   22.54211       7.243556 0.96 
1 1 1 4   2  24 o 118.5875 4.342121 86.07338  80.1  16.57819       8.684242 0.89 
1 1 1 4   2  25 o 31.09646 9.176459 35.82247  34.0  -12.61306      18.35292 0.26 
1 1 1 4   2  26 o 45.61440 10.20434 5.452051  234.3 4.791683       20.40869 0.07 
1 1 1 4   2  27 f 97.48302 6.947919 125.9339  216.4 -18.65976      13.89584 0.00 
1 1 1 4   2  28 o 152.1362 5.310853 200.4350  222.7 -13.54607      10.62171 0.97 
1 1 1 4   2  29 o 65.49606 13.03891 93.63528  110.4 -28.29162      26.07782 0.83 
1 1 1 4   2  30 o 77.64049 9.582343 157.3772  105.1 10.15579       19.16469 0.94 
1 1 1 4   2  31 o 58.91429 13.08994 17.09135  47.6  8.436962       26.17987 0.40 
1 1 1 4   2  32 o 101.8161 10.72953 89.63986  104.5 -9.297249      21.45905 0.95 
1 1 1 4   2  33 o 38.10006 11.85239 56.65892  16.2  -1.753132      23.70479 0.74 
1 1 1 4   2  34 o 48.65333 13.08352 60.12656  99.1  ?              ?        0.83 
1 1 1 4   4  0  o 498.0087 4.696685 253.4234  188.0 -56.62833      9.393370 0.99 
1 1 1 4   4  1  o 489.7072 4.587708 818.7571  40.6  110.9669       9.175416 0.98 
1 1 1 4   4  2  o 463.5555 4.449929 361.9730  351.7 -9.425354      8.899858 0.98 
1 1 1 4   4  3  o 55.97436 1.964903 460.8549  208.0 -15.41047      3.929806 0.44 
1 1 1 4   4  4  o 452.0433 4.431449 1083.472  94.8  -3.797272      8.862899 0.98 
1 1 1 4   4  5  o 232.6809 2.390320 485.8103  277.7 -37.79575      4.780640 0.93 
1 1 1 4   4  6  o 468.7996 4.005618 678.7729  301.3 -14.35974      8.011235 0.98 
1 1 1 4   4  7  o 422.6149 3.639801 938.7246  33.9  53.22910       7.279603 0.97 
1 1 1 4   4  8  o 279.2845 2.715401 389.6361  1.7   81.59236       5.430802 0.95 
1 1 1 4   4  9  o 170.5128 2.122898 474.1797  339.4 -25.54105      4.245796 0.92 
1 1 1 4   4  10 o 200.9993 2.404134 548.8864  283.5 -26.49484      4.808268 0.92 
1 1 1 4   4  11 o 365.5212 4.213792 579.5645  256.0 24.00674       8.427585 0.96 
1 1 1 4   4  12 o 479.4666 4.413876 409.5645  290.4 -34.93201      8.827751 0.97 
1 1 1 4   4  13 o 39.20434 6.016945 180.0093  23.7  -4.500027      12.03389 0.16 
1 1 1 4   4  14 o 534.5087 5.950118 671.0410  290.8 9.166565       11.90024 0.98 
1 1 1 4   4  15 f 447.4884 4.179883 654.8727  288.7 -23.23615      8.359767 0.00 
1 1 1 4   4  16 o 322.0508 3.437449 400.5523  19.7  -0.9999695     6.874899 0.95 
1 1 1 4   4  17 o 54.50159 6.240725 261.4280  97.9  -8.926422      12.48145 0.60 
1 1 1 4   4  18 f 39.53035 7.574573 87.78870  309.4 1.726067       15.14915 0.00 
1 1 1 4   4  19 o 157.4110 3.217618 288.5422  58.6  -6.438004      6.435236 0.94 
1 1 1 4   4  20 o 297.0626 4.410412 495.5869  64.5  -43.38092      8.820824 0.99 
1 1 1 4   4  21 o 142.8776 3.489813 204.1882  21.7  -24.29488      6.979626 0.94 
1 1 1 4   4  22 o 120.2689 4.083359 183.8700  255.7 2.690941       8.166718 0.93 
1 1 1 4   4  23 o 262.9686 3.623384 431.7532  152.2 -26.09586      7.246769 0.99 
1 1 1 4   4  24 o 135.2234 4.510434 155.9518  107.4 -8.869873      9.020867 0.95 
1 1 1 4   4  25 o 191.0869 3.968951 269.9463  58.7  -3.543823      7.937902 0.98 
1 1 1 4   4  26 f 84.64634 7.263707 66.59288  16.9  -27.13965      14.52741 0.00 
1 1 1 4   4  27 o 118.0077 6.150109 129.5219  288.8 21.94677       12.30022 0.94 
1 1 1 4   4  28 f 77.08366 9.533861 108.2281  318.5 -16.86890      19.06772 0.00 
1 1 1 4   4  29 o 54.18668 11.70270 83.92433  8.4   -18.99951      23.40540 0.81 
1 1 1 4   4  30 o 124.1493 6.760778 175.7346  117.5 -1.368317      13.52156 0.98 
1 1 1 4   4  31 o 144.8239 6.665164 213.2405  48.5  -6.118668      13.33033 0.99 
1 1 1 4   4  32 o 66.99374 13.09846 116.2464  101.9 10.32546       26.19692 0.93 
1 1 1 4   4  33 o 52.01693 13.51679 134.1880  118.7 6.124538       27.03359 0.93 
1 1 1 4   6  0  o 588.9209 5.327710 879.7598  167.4 36.70123       10.65542 0.99 
1 1 1 4   6  1  o 189.5307 2.483420 308.5107  189.2 -12.81685      4.966841 0.84 
1 1 1 4   6  2  o 344.2462 3.483089 450.2526  253.1 13.00323       6.966179 0.96 
1 1 1 4   6  3  f 563.8418 5.075588 863.2731  98.1  -54.42322      10.15118 0.00 
1 1 1 4   6  4  o 66.66499 2.265888 130.6129  301.5 -2.665375      4.531776 0.39 
1 1 1 4   6  5  o 262.6053 2.833724 469.0561  260.1 -29.10803      5.667449 0.93 
1 1 1 4   6  6  o 453.2175 4.169675 897.9320  65.6  -12.17047      8.339351 0.98 
1 1 1 4   6  7  o 470.9472 3.933068 489.9121  214.9 -37.77283      7.866135 0.97 
1 1 1 4   6  8  o 814.3342 9.824517 748.0738  258.9 24.25360       19.64903 0.99 
1 1 1 4   6  9  o 300.4513 3.750170 536.6013  169.5 39.49295       7.500340 0.96 
1 1 1 4   6  10 o 506.4487 5.463700 669.1500  220.3 39.90881       10.92740 0.98 
1 1 1 4   6  11 o 554.7825 4.626660 772.4941  272.2 -58.25836      9.253321 0.98 
1 1 1 4   6  12 o 624.5758 6.451210 913.2095  21.4  -3.793335      12.90242 0.99 
1 1 1 4   6  13 o 36.19464 6.718171 109.6575  83.5  -13.84743      13.43634 0.12 
1 1 1 4   6  14 o 84.62864 3.624964 114.3957  263.9 15.89401       7.249927 0.27 
1 1 1 4   6  15 o 519.5855 4.389557 649.6887  325.9 -15.33707      8.779115 0.99 
1 1 1 4   6  16 o 50.21708 6.542809 214.2280  137.0 14.49223       13.08562 0.62 
1 1 1 4   6  17 o 154.0351 2.831790 273.6704  116.0 7.841141       5.663579 0.94 
1 1 1 4   6  18 o 70.97394 5.529278 178.1948  43.3  11.32540       11.05856 0.86 
1 1 1 4   6  19 o 286.3928 3.438686 334.8748  253.1 9.726074       6.877373 0.98 
1 1 1 4   6  20 o 130.7257 3.872454 314.8814  307.2 10.56964       7.744908 0.96 
1 1 1 4   6  21 o 106.7466 4.515142 166.5819  186.2 8.240280       9.030285 0.93 
1 1 1 4   6  22 o 193.6657 3.512023 233.8079  82.0  14.03859       7.024046 0.98 
1 1 1 4   6  23 o 127.5068 5.024999 205.6593  9.3   63.08305       10.05000 0.96 
1 1 1 4   6  24 o 72.04449 8.486698 113.1203  39.9  11.71744       16.97340 0.90 
1 1 1 4   6  25 o 46.62977 10.34965 63.82877  179.1 23.52013       20.69930 0.70 
1 1 1 4   6  26 o 116.3960 6.377773 172.1591  182.8 -11.15121      12.75555 0.95 
1 1 1 4   6  27 o 83.73077 9.318462 185.1589  208.4 -64.20506      18.63692 0.94 
1 1 1 4   6  28 o 105.0471 6.651935 122.9293  86.3  9.357956       13.30387 0.95 
1 1 1 4   6  29 o 65.41376 12.00639 30.72736  155.1 -21.31209      24.01278 0.66 
1 1 1 4   6  30 o 27.48544 9.412674 19.73093  206.3 5.676455       18.82535 0.30 
1 1 1 4   6  31 o 33.55328 11.03558 18.77818  23.1  1.666779       22.07117 0.33 
1 1 1 4   6  32 o 83.77521 10.70013 141.6783  152.0 ?              ?        0.97 
1 1 1 4   8  0  o 399.5288 3.982558 974.2358  99.8  11.17850       7.965116 0.98 
1 1 1 4   8  1  o 187.8936 2.532871 205.6685  53.5  35.15430       5.065743 0.78 
1 1 1 4   8  2  o 108.3296 3.219512 164.1837  189.5 8.512428       6.439023 0.58 
1 1 1 4   8  3  o 361.2722 3.646912 567.0699  326.8 20.76718       7.293823 0.96 
1 1 1 4   8  4  o 333.6627 3.370379 398.2534  274.6 31.16122       6.740758 0.96 
1 1 1 4   8  5  o 106.4955 2.307630 260.5913  180.2 7.600250       4.615261 0.67 
1 1 1 4   8  6  o 625.0779 7.498850 1146.410  60.0  ?              ?        0.99 
1 1 1 4   8  7  o 360.7352 3.374036 586.2843  17.6  -2.555878      6.748071 0.97 
1 1 1 4   8  8  o 230.9416 2.281334 377.1996  196.6 18.95599       4.562668 0.91 
1 1 1 4   8  9  o 433.7200 3.471343 592.3439  216.4 21.72153       6.942686 0.98 
1 1 1 4   8  10 o 767.0195 7.743275 1090.103  353.3 5.713562       15.48655 0.99 
1 1 1 4   8  11 o 134.1786 3.317917 176.9189  356.6 -19.58363      6.635834 0.73 
1 1 1 4   8  12 o 262.2595 3.790456 397.9075  263.5 4.419525       7.580912 0.96 
1 1 1 4   8  13 f 86.59620 6.300274 197.3477  269.1 -9.730194      12.60055 0.00 
1 1 1 4   8  14 o 128.7784 4.398387 309.2299  156.1 33.93011       8.796774 0.94 
1 1 1 4   8  15 o 134.5256 3.986529 166.3188  356.1 -29.25966      7.973058 0.92 
1 1 1 4   8  16 o 248.1974 2.856606 422.4301  305.6 36.19818       5.713212 0.98 
1 1 1 4   8  17 o 249.3282 3.008848 355.4831  306.2 -31.49718      6.017696 0.98 
1 1 1 4   8  18 o 116.4410 3.592416 207.8690  346.6 -31.44556      7.184832 0.94 
1 1 1 4   8  19 o 49.87449 7.214357 110.9312  216.6 39.01324       14.42871 0.77 
1 1 1 4   8  20 o 57.28537 7.921685 94.59837  189.8 26.13629       15.84337 0.79 
1 1 1 4   8  21 f 278.3494 3.521268 432.9226  268.2 25.30716       7.042537 0.00 
1 1 1 4   8  22 o 185.6062 3.367989 289.6884  216.5 19.88710       6.735978 0.99 
1 1 1 4   8  23 o 88.18524 7.449020 152.4505  150.5 28.69053       14.89804 0.95 
1 1 1 4   8  24 o 127.2188 4.986550 157.1939  4.9   20.82343       9.973101 0.96 
1 1 1 4   8  25 o 34.58336 10.30807 54.39277  90.5  -13.89794      20.61613 0.49 
1 1 1 4   8  26 o 92.67320 7.014791 144.6284  199.7 2.823051       14.02958 0.95 
1 1 1 4   8  27 o 77.52071 8.749535 134.7753  218.3 -8.497040      17.49907 0.95 
1 1 1 4   8  28 o 44.92078 11.53322 48.34635  254.1 8.612152       23.06645 0.75 
1 1 1 4   8  29 o 53.25716 12.34212 115.6988  263.0 -0.1721115     24.68423 0.92 
1 1 1 4   8  30 o 56.58694 12.56069 83.82807  191.0 3.587784       25.12139 0.90 
1 1 1 4   8  31 o 67.45470 12.56491 80.90021  130.6 ?              ?        0.92 
1 1 1 4   10 0  o 449.4489 5.313066 712.9783  50.2  57.26801       10.62613 0.99 
1 1 1 4   10 1  o 504.1293 4.621272 735.5015  297.1 20.34274       9.242544 0.99 
1 1 1 4   10 2  o 637.6058 5.621974 876.0160  237.2 18.03204       11.24395 0.99 
1 1 1 4   10 3  o 142.6999 2.664906 287.5461  261.1 -8.799942      5.329812 0.87 
1 1 1 4   10 4  o 319.6017 3.223906 555.6027  217.6 -34.07019      6.447811 0.98 
1 1 1 4   10 5  o 409.7966 3.912575 702.2610  267.4 -21.74835      7.825149 0.99 
1 1 1 4   10 6  o 421.5184 3.952148 502.0529  343.2 -60.15533      7.904296 0.99 
1 1 1 4   10 7  o 249.9275 2.805573 469.4203  73.3  -13.79065      5.611145 0.98 
1 1 1 4   10 8  o 241.0392 2.829330 408.1230  114.6 -18.94176      5.658659 0.97 
1 1 1 4   10 9  o 141.2391 2.516420 265.3382  266.3 -32.54135      5.032840 0.94 
1 1 1 4   10 10 o 117.4659 4.965066 308.7203  181.3 22.52557       9.930133 0.95 
1 1 1 4   10 11 o 116.8962 3.891799 227.3400  65.8  -16.47930      7.783598 0.94 
1 1 1 4   10 12 o 156.0450 5.550317 266.0928  328.4 -14.58797      11.10063 0.96 
1 1 1 4   10 13 o 62.43497 6.818749 62.00454  191.6 -20.60785      13.63750 0.60 
1 1 1 4   10 14 o 187.2913 3.508172 355.2276  177.5 -10.55032      7.016344 0.98 
1 1 1 4   10 15 o 173.6709 3.850938 217.1398  248.6 -12.46219      7.701877 0.97 
1 1 1 4   10 16 o 117.1441 5.033905 190.2604  344.3 4.355003       10.06781 0.96 
1 1 1 4   10 17 o 115.8623 5.569474 301.9517  125.6 -28.69757      11.13895 0.97 
1 1 1 4   10 18 o 128.8622 4.158720 184.8374  57.6  3.925476       8.317439 0.97 
1 1 1 4   10 19 f 74.70935 8.916816 109.2264  299.6 21.87720       17.83363 0.00 
1 1 1 4   10 20 o 126.1625 5.510268 151.4192  324.6 17.56192       11.02054 0.97 
1 1 1 4   10 21 o 36.28001 10.50599 62.62584  182.6 -7.224552      21.01199 0.56 
1 1 1 4   10 22 o 71.16614 7.953292 138.7770  122.2 -7.990387      15.90658 0.92 
1 1 1 4   10 23 o 42.06218 10.06504 19.26514  207.6 -32.09467      20.13008 0.26 
1 1 1 4   10 24 o 75.83772 8.923906 104.4242  163.2 4.798981       17.84781 0.92 
1 1 1 4   10 25 o 42.98569 10.74459 73.86986  130.5 16.75517       21.48917 0.82 
1 1 1 4   10 26 o 36.37622 11.36292 26.99620  116.8 -8.614582      22.72584 0.49 
1 1 1 4   10 27 o 41.95791 11.20420 82.60088  0.9   15.10544       22.40840 0.86 
1 1 1 4   10 28 o 37.98125 11.32394 12.04116  300.5 -8.778011      22.64789 0.27 
1 1 1 4   10 29 x ?        ?        54.63319  50.1  ?              ?        0.00 
1 1 1 4   12 0  o 88.48515 4.320602 88.78365  183.5 15.42711       8.641204 0.79 
1 1 1 4   12 1  o 77.06647 4.337306 170.1326  152.9 2.807129       8.674612 0.88 
1 1 1 4   12 2  o 159.8953 3.133981 284.1796  110.0 -82.02079      6.267963 0.97 
1 1 1 4   12 3  o 128.6810 2.987029 225.7044  8.1   0.5142670      5.974057 0.95 
1 1 1 4   12 4  o 159.0912 3.431048 249.7559  5.7   9.370239       6.862095 0.97 
1 1 1 4   12 5  o 185.6748 2.939818 299.0891  112.3 -45.57172      5.879636 0.97 
1 1 1 4   12 6  o 257.1011 3.453429 410.6319  120.5 -57.41243      6.906859 0.99 
1 1 1 4   12 7  o 105.5123 3.517052 173.2435  231.4 1.348755       7.034105 0.93 
1 1 1 4   12 8  o 128.6021 3.060577 192.7244  184.2 -31.97925      6.121153 0.96 
1 1 1 4   12 9  o 99.00413 3.341825 243.8360  205.4 6.026001       6.683649 0.96 
1 1 1 4   12 10 o 49.34237 8.406148 63.47186  206.7 14.87432       16.81230 0.64 
1 1 1 4   12 11 o 51.91351 11.32588 37.11884  18.2  -20.45666      22.65176 0.45 
1 1 1 4   12 12 o 55.02637 10.92226 168.7640  288.2 -45.53653      21.84453 0.90 
1 1 1 4   12 13 o 98.35690 9.088970 133.6620  85.3  -20.59264      18.17794 0.94 
1 1 1 4   12 14 o 128.7387 7.409456 174.6256  325.7 31.38396       14.81891 0.97 
1 1 1 4   12 15 o 110.4620 8.519118 136.0206  172.6 24.97958       17.03824 0.96 
1 1 1 4   12 16 o 228.3372 5.881406 436.2178  71.0  7.994202       11.76281 0.99 
1 1 1 4   12 17 f 119.3900 8.426710 195.8526  296.9 5.062973       16.85342 0.00 
1 1 1 4   12 18 o 191.5551 6.663632 226.4549  94.8  -1.061035      13.32726 0.98 
1 1 1 4   12 19 o 140.3489 8.078602 212.7688  140.0 -18.12370      16.15720 0.98 
1 1 1 4   12 20 o 57.92840 13.20849 146.4827  87.8  45.11212       26.41698 0.91 
1 1 1 4   12 21 o 61.51057 8.434102 48.73602  158.9 -18.19538      16.86820 0.81 
1 1 1 4   12 22 o 35.02114 10.94988 47.80934  303.2 -30.59110      21.89976 0.66 
1 1 1 4   12 23 o 30.99387 10.35957 13.30492  340.8 -22.08724      20.71914 0.25 
1 1 1 4   12 24 o 60.46630 10.40507 126.0561  45.9  35.08416       20.81014 0.95 
1 1 1 4   12 25 o 37.78582 10.17402 37.06946  108.7 7.763588       20.34804 0.67 
1 1 1 4   12 26 o 36.14577 11.03554 62.56927  316.2 ?              ?        0.82 
1 1 1 4   14 0  o 158.1658 3.459311 267.8470  97.9  7.492676       6.918623 0.98 
1 1 1 4   14 1  o 284.2662 3.769454 497.7596  83.1  24.97525       7.538909 1.00 
1 1 1 4   14 2  f 177.3671 3.485565 179.3625  246.9 -50.52222      6.971130 0.00 
1 1 1 4   14 3  o 182.3389 3.255263 354.2252  174.4 -0.8145905     6.510526 0.99 
1 1 1 4   14 4  o 119.5306 4.046518 261.6611  301.3 -34.13698      8.093036 0.98 
1 1 1 4   14 5  o 49.23906 7.457219 136.5613  270.1 -27.99277      14.91444 0.90 
1 1 1 4   14 6  o 144.3656 3.518951 272.3264  85.1  9.592087       7.037901 0.99 
1 1 1 4   14 7  o 125.0683 3.796890 245.9772  94.3  8.689758       7.593780 0.98 
1 1 1 4   14 8  o 37.09204 8.910877 62.59074  173.3 -11.95494      17.82175 0.72 
1 1 1 4   14 9  o 156.3885 3.255653 290.5400  174.0 -15.03117      6.511305 0.99 
1 1 1 4   14 10 o 98.42509 3.784935 166.4818  181.6 -12.35725      7.569869 0.96 
1 1 1 4   14 11 o 46.98311 13.57173 42.55688  302.4 -6.637192      27.14346 0.51 
1 1 1 4   14 12 o 109.0734 9.429046 149.9597  257.1 -6.275772      18.85809 0.95 
1 1 1 4   14 13 o 37.73208 17.47108 116.3855  212.0 ?              ?        0.76 
1 1 1 4   14 14 o 128.1263 8.608415 235.6300  200.9 -17.24733      17.21683 0.98 
1 1 1 4   14 15 f 45.61609 13.05292 54.31164  121.1 15.21544       26.10583 0.00 
1 1 1 4   14 16 o 70.23492 14.71597 94.66538  149.6 -19.92444      29.43195 0.90 
1 1 1 4   14 17 o 68.46070 20.20046 64.66998  53.6  ?              ?        0.81 
1 1 1 4   14 18 o 57.46173 14.95759 150.4728  262.2 6.416088       29.91517 0.94 
1 1 1 4   14 19 o 58.91025 15.77848 76.88881  300.6 8.686699       31.55696 0.88 
1 1 1 4   14 20 f 44.56493 13.16842 103.9109  29.9  -23.78969      26.33684 0.00 
1 1 1 4   14 21 o 43.31432 13.95840 79.49469  255.1 3.896248       27.91680 0.85 
1 1 1 4   14 22 o 53.85480 15.00366 111.1695  224.3 ?              ?        0.92 
1 1 1 4   16 0  o 54.63622 9.733782 114.5578  222.6 -27.83397      19.46756 0.89 
1 1 1 4   16 1  o 94.19176 6.117342 126.3333  212.6 -0.2039413     12.23468 0.95 
1 1 1 4   16 2  o 173.3843 3.847673 336.4180  194.7 31.45996       7.695346 0.99 
1 1 1 4   16 3  o 87.32211 6.311956 117.6071  197.3 -0.7516632     12.62391 0.94 
1 1 1 4   16 4  o 77.77563 7.125361 195.6439  288.9 -5.300461      14.25072 0.96 
1 1 1 4   16 5  o 75.76450 7.132543 171.4019  178.5 -10.64166      14.26509 0.96 
1 1 1 4   16 6  o 109.1147 5.179693 243.9148  148.7 -12.98911      10.35939 0.98 
1 1 1 4   16 7  o 42.69389 10.32877 54.06377  344.2 -2.997250      20.65753 0.73 
1 1 1 4   16 8  o 90.41206 6.071937 128.1966  44.6  -17.33646      12.14387 0.96 
1 1 1 4   16 9  o 43.40735 9.591332 102.3322  59.1  -14.71039      19.18266 0.90 
1 1 1 4   16 10 o 41.69902 9.126959 48.86277  214.7 -6.471668      18.25392 0.77 
1 1 1 4   16 11 o 65.00453 14.91112 117.5710  168.3 -2.866573      29.82224 0.93 
1 1 1 4   16 12 o 45.99848 13.92525 26.21358  177.8 -11.84536      27.85051 0.55 
1 1 1 4   16 13 f 55.92638 15.05958 80.82615  355.9 -2.127659      30.11915 0.00 
1 1 1 4   16 14 o 46.05489 13.46922 38.16922  61.5  -20.94264      26.93843 0.69 
1 1 1 4   16 15 o 33.39250 11.50706 109.0516  185.5 -0.8317604     23.01412 0.89 
1 1 1 4   16 16 o 46.91083 14.23595 39.48852  242.3 12.32166       28.47191 0.71 
1 1 1 4   16 17 o 40.84108 13.33127 53.37949  32.4  ?              ?        0.79 
1 1 1 4   18 0  o 48.09127 10.97092 39.20026  161.1 -1.407173      21.94185 0.77 
1 1 1 4   18 1  o 49.67558 11.01829 96.52111  49.9  10.31916       22.03657 0.92 
1 1 1 4   18 2  o 40.40610 10.68800 33.91018  36.6  -11.52255      21.37599 0.68 
1 1 1 4   18 3  o 33.96682 10.34835 65.95104  36.1  3.495461       20.69669 0.83 
1 1 1 4   18 4  o 47.00169 13.39136 118.8648  336.3 -14.24892      26.78272 0.92 
1 1 1 4   18 5  o 37.73824 10.61510 48.14585  158.2 12.44548       21.23020 0.78 
1 1 1 4   18 6  o 30.88633 9.643353 41.60728  92.0  3.579803       19.28671 0.71 
1 1 1 4   18 7  o 65.27219 9.747734 106.1331  69.7  ?              ?        0.95 
1 1 1 4   18 8  o 30.90974 9.629437 79.32780  117.7 ?              ?        0.87 
1 1 1 4   18 9  x ?        ?        54.92309  164.7 ?              ?        0.00 
1 1 1 5   1  0  o 286.8062 3.201508 2103.255  355.7 5.827850       6.403016 0.93 
1 1 1 5   1  1  o 364.0727 3.681898 1948.408  263.5 128.7037       7.363796 0.98 
1 1 1 5   1  2  o 365.8388 3.212728 1897.459  287.2 -72.61597      6.425457 0.98 
1 1 1 5   1  3  o 900.6856 6.418087 2492.336  251.4 56.92383       12.83617 1.00 
1 1 1 5   1  4  o 625.8806 5.259023 1010.688  252.5 3.088928       10.51805 0.99 
1 1 1 5   1  5  o 500.0922 4.903408 1493.111  193.6 146.8551       9.806816 0.99 
1 1 1 5   1  6  o 497.1822 4.775178 612.1696  132.0 74.62323       9.550357 0.99 
1 1 1 5   1  7  o 195.9281 2.600502 665.3782  110.3 97.01193       5.201005 0.81 
1 1 1 5   1  8  o 133.9624 2.230416 441.0468  293.3 9.624176       4.460832 0.42 
1 1 1 5   1  9  o 78.29173 2.447756 350.9479  113.3 -27.03126      4.895512 0.16 
1 1 1 5   1  10 o 63.82546 3.381939 171.6888  274.3 -47.22952      6.763878 0.12 
1 1 1 5   1  11 o 232.2148 3.092998 292.7883  128.9 36.31776       6.185996 0.93 
1 1 1 5   1  12 o 332.2343 3.578270 506.3210  93.3  -0.1019592     7.156540 0.95 
1 1 1 5   1  13 o 169.9684 2.661018 328.3348  264.6 33.37880       5.322037 0.85 
1 1 1 5   1  14 o 529.9655 6.355799 605.0632  258.6 -20.90948      12.71160 0.98 
1 1 1 5   1  15 o 317.2791 3.423682 470.0748  169.3 70.95847       6.847363 0.94 
1 1 1 5   1  16 o 342.9921 3.673349 331.2522  359.6 -28.69989      7.346697 0.94 
1 1 1 5   1  17 o 484.0710 4.571156 613.3840  96.9  -35.59662      9.142312 0.98 
1 1 1 5   1  18 o 165.8586 2.954642 62.31157  316.7 24.53967       5.909284 0.57 
1 1 1 5   1  19 o 135.3058 3.807697 103.9350  58.9  1.135178       7.615393 0.67 
1 1 1 5   1  20 o 64.34409 6.155041 78.01492  211.0 3.954849       12.31008 0.49 
1 1 1 5   1  21 o 396.2101 4.166701 467.3023  171.9 23.97519       8.333402 0.99 
1 1 1 5   1  22 o 258.7480 3.464139 342.1421  203.4 2.125732       6.928278 0.98 
1 1 1 5   1  23 o 77.96002 6.320125 134.4346  299.4 23.48090       12.64025 0.83 
1 1 1 5   1  24 o 94.89082 5.504670 57.86990  57.2  -3.140816      11.00934 0.76 
1 1 1 5   1  25 o 217.5760 5.184110 271.4150  95.6  6.875183       10.36822 0.98 
1 1 1 5   1  26 o 61.75510 9.187839 49.52658  120.4 35.43845       18.37568 0.67 
1 1 1 5   1  27 o 113.5978 6.099311 112.3090  259.3 -14.85590      12.19862 0.94 
1 1 1 5   1  28 o 38.44347 10.90665 57.41471  61.3  7.494450       21.81329 0.48 
1 1 1 5   1  29 o 158.5068 5.314957 188.8211  63.4  -8.735825      10.62991 0.97 
1 1 1 5   1  30 o 49.96068 12.78727 34.50176  67.2  -12.79965      25.57454 0.50 
1 1 1 5   1  31 o 51.53241 12.31553 66.10699  49.7  22.03129       24.63106 0.81 
1 1 1 5   1  32 o 39.63890 12.00997 47.97537  200.8 -5.458054      24.01995 0.69 
1 1 1 5   1  33 o 56.48979 13.35309 41.61940  267.7 -13.49980      26.70618 0.75 
1 1 1 5   1  34 o 42.39291 12.90753 50.58038  87.8  ?              ?        0.77 
1 1 1 5   3  0  o 1386.581 16.19297 3356.911  177.6 -0.9770508     32.38594 1.00 
1 1 1 5   3  1  o 290.3198 3.281545 279.3716  350.7 80.72758       6.563091 0.96 
1 1 1 5   3  2  o 316.8563 3.507934 676.9387  82.1  38.57907       7.015868 0.93 
1 1 1 5   3  3  o 214.5822 2.754553 394.2165  251.5 -8.617996      5.509106 0.92 
1 1 1 5   3  4  o 423.0533 3.854199 629.7253  169.1 -69.85699      7.708399 0.97 
1 1 1 5   3  5  o 699.7382 5.116361 598.0645  267.0 42.58612       10.23272 0.99 
1 1 1 5   3  6  o 627.4170 5.229205 754.6470  281.9 18.34393       10.45841 0.99 
1 1 1 5   3  7  o 389.5775 3.477748 719.0504  63.1  31.13412       6.955495 0.96 
1 1 1 5   3  8  o 61.60925 2.374437 196.8661  218.0 -49.21850      4.748873 0.08 
1 1 1 5   3  9  o 618.8304 5.663618 1073.134  264.4 38.18073       11.32724 0.99 
1 1 1 5   3  10 o 275.9529 3.111416 466.2771  294.7 -89.05040      6.222833 0.93 
1 1 1 5   3  11 o 220.2862 2.612059 175.8157  206.7 -8.193527      5.224118 0.82 
1 1 1 5   3  12 o 342.3574 4.077973 459.5906  355.8 88.29349       8.155946 0.95 
1 1 1 5   3  13 o 156.9011 2.463064 264.6076  226.1 -14.05087      4.926129 0.78 
1 1 1 5   3  14 o 227.3702 2.848545 198.7180  251.8 -14.30432      5.697091 0.85 
1 1 1 5   3  15 o 355.3621 3.681053 540.3521  248.5 7.598663       7.362106 0.96 
1 1 1 5   3  16 o 557.6053 5.008378 657.1205  265.6 8.501892       10.01676 0.98 
1 1 1 5   3  17 o 465.6961 4.418094 757.9013  354.6 -10.32620      8.836188 0.98 
1 1 1 5   3  18 o 127.7865 4.593853 248.0307  242.7 ?              ?        0.87 
1 1 1 5   3  19 o 247.3661 3.154806 362.4485  320.6 40.79050       6.309612 0.97 
1 1 1 5   3  20 o 82.39797 6.345435 61.14497  320.9 22.35031       12.69087 0.51 
1 1 1 5   3  21 o 52.62569 7.677302 118.3335  287.0 31.20383       15.35460 0.67 
1 1 1 5   3  22 o 197.5773 3.404264 268.2057  149.7 -14.24817      6.808527 0.97 
1 1 1 5   3  23 o 109.2953 4.621924 283.9925  300.1 26.65551       9.243849 0.96 
1 1 1 5   3  24 o 41.21767 9.336258 51.10563  310.4 24.75389       18.67252 0.44 
1 1 1 5   3  25 o 147.1536 4.359435 226.2844  184.8 -1.126648      8.718870 0.97 
1 1 1 5   3  26 o 173.7356 4.558299 166.3104  218.5 -10.23212      9.116598 0.98 
1 1 1 5   3  27 o 190.5248 4.730990 250.6227  272.4 -12.91356      9.461980 0.98 
1 1 1 5   3  28 o 62.43185 11.28912 46.96023  131.9 -10.96046      22.57824 0.61 
1 1 1 5   3  29 o 45.35767 10.86577 67.51246  72.3  27.15167       21.73153 0.68 
1 1 1 5   3  30 o 28.73062 9.704060 46.66455  49.0  -5.465918      19.40812 0.49 
1 1 1 5   3  31 o 139.8411 6.527719 177.4224  77.6  17.15884       13.05544 0.98 
1 1 1 5   3  32 o 134.2074 8.200480 160.6594  127.2 -3.690659      16.40096 0.98 
1 1 1 5   3  33 f 48.15044 13.25084 95.59563  68.9  4.905872       26.50168 0.00 
1 1 1 5   5  0  o 360.3692 3.733447 919.4813  15.1  31.52084       7.466894 0.97 
1 1 1 5   5  1  o 694.5186 6.216140 1008.845  17.0  78.85815       12.43228 0.99 
1 1 1 5   5  2  o 214.9639 2.581984 194.6524  89.7  -36.71277      5.163968 0.86 
1 1 1 5   5  3  o 389.3787 3.909004 692.4629  141.2 0.5100403      7.818009 0.96 
1 1 1 5   5  4  o 162.3000 2.262666 493.5166  77.6  62.05975       4.525331 0.92 
1 1 1 5   5  5  f 133.2476 2.173093 449.8829  150.3 -6.408112      4.346185 0.00 
1 1 1 5   5  6  o 416.0306 3.644493 671.8538  8.4   58.53214       7.288987 0.97 
1 1 1 5   5  7  o 533.5066 4.455969 636.3629  160.6 -1.804810      8.911939 0.98 
1 1 1 5   5  8  o 174.2754 3.147147 412.5427  182.7 -81.02136      6.294294 0.89 
1 1 1 5   5  9  o 683.8770 6.078611 919.0947  6.9   15.83698       12.15722 0.99 
1 1 1 5   5  10 o 54.31557 3.809880 185.3901  345.8 24.73100       7.619760 0.35 
1 1 1 5   5  11 o 289.7910 3.927207 357.7019  199.4 7.282440       7.854413 0.94 
1 1 1 5   5  12 o 74.51274 3.309128 197.1225  324.8 -44.03362      6.618256 0.52 
1 1 1 5   5  13 o 78.22308 3.278013 100.5441  163.3 -5.103485      6.556026 0.27 
1 1 1 5   5  14 o 336.5451 3.174942 426.4131  284.7 -25.01224      6.349885 0.95 
1 1 1 5   5  15 o 157.6274 2.585336 139.6154  132.2 43.95982       5.170672 0.53 
1 1 1 5   5  16 o 133.7203 3.175443 167.7261  174.2 -22.95319      6.350887 0.76 
1 1 1 5   5  17 o 337.1424 3.572616 435.3626  329.6 -3.274414      7.145233 0.98 
1 1 1 5   5  18 o 195.3778 2.995322 348.0025  8.9   31.86665       5.990644 0.96 
1 1 1 5   5  19 o 190.0460 3.194935 224.4216  275.5 -50.45297      6.389870 0.96 
1 1 1 5   5  20 o 149.2143 3.560694 194.0369  224.8 -9.377289      7.121389 0.94 
1 1 1 5   5  21 o 166.8025 4.658288 276.8960  210.2 16.07066       9.316576 0.97 
1 1 1 5   5  22 o 203.7257 3.366975 296.7295  339.9 -16.37212      6.733950 0.98 
1 1 1 5   5  23 o 36.46256 9.933696 79.76067  283.6 -0.2074776     19.86739 0.57 
1 1 1 5   5  24 o 124.9084 5.189376 196.2383  328.4 28.33418       10.37875 0.96 
1 1 1 5   5  25 o 116.5179 4.945286 132.9823  336.9 1.060669       9.890573 0.96 
1 1 1 5   5  26 o 45.79622 11.11017 34.00750  102.7 16.81655       22.22034 0.41 
1 1 1 5   5  27 o 182.6792 4.586147 222.1536  265.3 10.68642       9.172294 0.98 
1 1 1 5   5  28 o 89.54501 8.375263 81.75718  319.6 -5.635223      16.75053 0.89 
1 1 1 5   5  29 o 118.2345 6.600496 149.4004  99.6  -11.39122      13.20099 0.97 
1 1 1 5   5  30 o 29.14717 9.682094 21.97249  345.4 -6.146372      19.36419 0.32 
1 1 1 5   5  31 o 63.49737 12.64441 96.35140  354.0 -17.68661      25.28882 0.92 
1 1 1 5   5  32 o 43.40894 12.51622 66.37885  121.5 -0.6846962     25.03244 0.82 
1 1 1 5   5  33 x ?        ?        115.3361  27.7  ?              ?        0.00 
1 1 1 5   7  0  o 303.9902 3.187811 213.5877  48.1  -11.38171      6.375622 0.93 
1 1 1 5   7  1  o 590.1237 5.226696 874.0414  149.8 58.82770       10.45339 0.99 
1 1 1 5   7  2  o 282.3121 3.046268 431.6118  235.6 -26.49329      6.092536 0.95 
1 1 1 5   7  3  f 349.6340 3.436922 612.2868  119.6 -3.794220      6.873844 0.00 
1 1 1 5   7  4  o 372.9504 3.617751 586.0047  120.3 -5.986694      7.235503 0.97 
1 1 1 5   7  5  o 766.9628 8.263427 1056.157  261.4 34.89130       16.52685 0.99 
1 1 1 5   7  6  o 271.5300 2.815208 371.9731  40.3  -2.811066      5.630415 0.94 
1 1 1 5   7  7  o 212.4613 2.968462 484.5051  235.4 13.57344       5.936924 0.92 
1 1 1 5   7  8  o 289.5075 3.030214 535.0698  262.9 -8.873413      6.060428 0.96 
1 1 1 5   7  9  f 633.8007 6.523921 801.1491  155.4 39.64740       13.04784 0.00 
1 1 1 5   7  10 o 92.98125 4.086596 306.9311  223.2 -2.717621      8.173193 0.71 
1 1 1 5   7  11 o 191.6564 2.966822 339.1572  264.0 10.56841       5.933643 0.89 
1 1 1 5   7  12 o 335.6169 4.183271 373.4354  293.2 30.74088       8.366543 0.95 
1 1 1 5   7  13 o 135.3650 3.660783 292.5244  166.8 30.88609       7.321566 0.87 
1 1 1 5   7  14 o 263.2964 3.056427 384.8723  95.6  13.93155       6.112854 0.97 
1 1 1 5   7  15 o 53.30348 6.076322 73.32186  101.6 -31.93259      12.15264 0.33 
1 1 1 5   7  16 o 117.1530 3.601977 260.2411  194.2 41.34677       7.203954 0.93 
1 1 1 5   7  17 o 322.7382 3.346210 485.7172  155.4 28.77139       6.692421 0.99 
1 1 1 5   7  18 o 250.4720 2.997397 395.5905  93.4  28.88159       5.994795 0.98 
1 1 1 5   7  19 o 58.48030 7.082060 149.1523  235.7 20.70111       14.16412 0.81 
1 1 1 5   7  20 o 186.1841 3.224662 277.7798  243.3 10.33975       6.449323 0.98 
1 1 1 5   7  21 o 190.4173 3.437884 287.0009  206.6 24.24394       6.875768 0.98 
1 1 1 5   7  22 o 97.48643 4.944845 113.0467  178.7 3.908745       9.889689 0.92 
1 1 1 5   7  23 o 142.7531 4.102524 198.6742  56.4  -1.208344      8.205048 0.98 
1 1 1 5   7  24 o 177.6684 3.886164 272.6783  309.0 6.340775       7.772327 0.99 
1 1 1 5   7  25 o 29.88984 9.248906 42.23775  221.4 1.745478       18.49781 0.33 
1 1 1 5   7  26 o 49.86177 11.56484 41.80314  164.3 12.39569       23.12967 0.52 
1 1 1 5   7  27 o 120.2582 6.563416 128.3663  282.5 -30.71403      13.12683 0.96 
1 1 1 5   7  28 f 73.49319 10.49566 126.9316  297.7 29.10143       20.99131 0.00 
1 1 1 5   7  29 o 41.70963 11.52315 68.38003  285.2 17.15991       23.04629 0.82 
1 1 1 5   7  30 o 84.64120 10.59990 148.7595  334.7 -23.64491      21.19981 0.96 
1 1 1 5   7  31 f 31.53730 10.47266 73.96474  228.2 -0.2018700     20.94532 0.00 
1 1 1 5   9  0  o 187.4941 3.388364 517.7997  279.0 33.95291       6.776727 0.93 
1 1 1 5   9  1  o 364.4615 3.736399 675.5457  291.4 -17.92740      7.472798 0.98 
1 1 1 5   9  2  o 466.0069 4.371299 828.7488  68.8  77.58411       8.742598 0.98 
1 1 1 5   9  3  o 279.5074 4.183125 295.8287  53.2  33.72141       8.366250 0.92 
1 1 1 5   9  4  o 362.4853 3.620775 498.9031  279.3 43.91980       7.241549 0.97 
1 1 1 5   9  5  o 509.4657 4.634516 742.2240  310.3 -21.29269      9.269032 0.99 
1 1 1 5   9  6  o 461.1320 4.254765 819.2179  28.0  24.47986       8.509530 0.99 
1 1 1 5   9  7  o 233.8330 2.722894 326.4642  288.3 -36.31689      5.445789 0.94 
1 1 1 5   9  8  o 222.4709 2.644959 303.5585  230.6 -43.40379      5.289918 0.93 
1 1 1 5   9  9  o 372.3411 3.282095 567.5657  290.4 -35.83572      6.564190 0.98 
1 1 1 5   9  10 o 170.8918 3.804931 269.4705  281.6 27.37395       7.609863 0.93 
1 1 1 5   9  11 o 246.5335 3.832256 297.0239  265.8 1.713135       7.664511 0.96 
1 1 1 5   9  12 o 67.68460 5.562946 134.3797  260.2 -45.02724      11.12589 0.73 
1 1 1 5   9  13 o 91.43965 4.558187 248.2962  2.5   -14.70302      9.116374 0.93 
1 1 1 5   9  14 o 259.5270 3.893277 419.0565  345.5 -15.13760      7.786553 0.99 
1 1 1 5   9  15 o 102.7526 5.418859 124.7143  355.7 41.51103       10.83772 0.86 
1 1 1 5   9  16 o 136.5129 4.287781 140.9773  207.4 -26.49892      8.575562 0.93 
1 1 1 5   9  17 o 55.21080 8.954132 124.5421  351.6 -30.72863      17.90826 0.82 
1 1 1 5   9  18 f 94.79730 8.507495 173.3378  27.4  36.17609       17.01499 0.00 
1 1 1 5   9  19 o 148.1010 3.344077 267.4333  233.7 -23.82991      6.688154 0.98 
1 1 1 5   9  20 o 192.4657 3.336235 302.8548  236.7 -9.333160      6.672470 0.99 
1 1 1 5   9  21 o 102.0563 5.809588 211.6026  353.0 18.15215       11.61918 0.97 
1 1 1 5   9  22 o 102.7091 5.873841 138.1277  97.6  -1.114098      11.74768 0.95 
1 1 1 5   9  23 o 158.5557 4.264536 219.1057  163.3 17.75272       8.529073 0.98 
1 1 1 5   9  24 o 48.20028 10.48128 126.5323  39.9  -24.50505      20.96257 0.86 
1 1 1 5   9  25 o 67.32195 11.39221 86.72366  261.8 -1.105858      22.78441 0.88 
1 1 1 5   9  26 o 173.2296 4.831770 254.7383  199.1 -6.449478      9.663540 0.99 
1 1 1 5   9  27 o 38.51395 10.82264 29.91540  358.6 -26.99034      21.64528 0.55 
1 1 1 5   9  28 o 39.41656 11.60038 27.07879  293.7 -7.836346      23.20077 0.51 
1 1 1 5   9  29 o 38.53305 12.30994 27.67019  212.4 -21.33315      24.61987 0.53 
1 1 1 5   9  30 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 5   11 0  o 108.3066 3.299847 161.3151  169.4 -5.303757      6.599693 0.87 
1 1 1 5   11 1  f 181.0361 2.745713 349.0562  230.6 -9.427216      5.491427 0.00 
1 1 1 5   11 2  o 407.9785 4.062996 659.3181  220.5 109.7982       8.125992 0.99 
1 1 1 5   11 3  o 274.1712 3.107444 361.1406  208.8 -13.87982      6.214888 0.98 
1 1 1 5   11 4  o 129.5735 2.817834 132.4371  83.8  35.61843       5.635668 0.89 
1 1 1 5   11 5  o 177.5615 3.094019 399.6599  33.4  -4.842285      6.188037 0.98 
1 1 1 5   11 6  o 34.79684 7.505264 45.29954  51.6  13.17298       15.01053 0.17 
1 1 1 5   11 7  o 175.9619 3.044388 227.5315  229.9 21.75224       6.088776 0.96 
1 1 1 5   11 8  o 172.4088 2.790678 311.3067  142.1 0.3054504      5.581357 0.97 
1 1 1 5   11 9  o 95.17892 3.042588 111.6265  46.4  -14.64162      6.085177 0.85 
1 1 1 5   11 10 o 141.7735 2.221303 287.4059  218.5 -14.93018      4.442605 0.96 
1 1 1 5   11 11 o 127.2164 5.251721 173.4024  233.4 40.90173       10.50344 0.94 
1 1 1 5   11 12 o 280.2045 5.237959 453.3909  258.3 7.477386       10.47592 0.99 
1 1 1 5   11 13 o 93.84831 7.535843 113.7356  323.6 -13.17257      15.07169 0.91 
1 1 1 5   11 14 f 177.7104 5.738560 250.5196  227.1 39.66310       11.47712 0.00 
1 1 1 5   11 15 o 56.93804 8.618163 51.25300  63.6  -20.49280      17.23633 0.64 
1 1 1 5   11 16 f 232.3475 4.736629 329.8712  88.3  27.79919       9.473259 0.00 
1 1 1 5   11 17 o 227.3939 4.580461 357.3189  201.0 19.86223       9.160921 0.99 
1 1 1 5   11 18 o 118.5437 5.668432 164.0443  313.9 6.118919       11.33686 0.97 
1 1 1 5   11 19 o 124.7015 6.116450 225.8315  51.6  18.31749       12.23290 0.97 
1 1 1 5   11 20 o 40.99973 10.69795 72.83791  52.4  -1.723053      21.39590 0.67 
1 1 1 5   11 21 o 180.5825 4.445202 262.3903  276.7 5.379501       8.890404 0.99 
1 1 1 5   11 22 o 52.22852 11.55721 60.83073  314.9 -6.338654      23.11441 0.76 
1 1 1 5   11 23 o 52.32000 11.79577 56.82291  308.3 -9.517441      23.59153 0.79 
1 1 1 5   11 24 o 81.78732 10.91334 161.2116  0.6   16.37631       21.82669 0.97 
1 1 1 5   11 25 o 56.33404 11.48570 122.4129  74.9  21.02464       22.97140 0.94 
1 1 1 5   11 26 o 39.14349 11.80751 35.47746  179.2 -5.483814      23.61502 0.63 
1 1 1 5   11 27 o 37.08743 10.58597 56.73783  95.7  ?              ?        0.80 
1 1 1 5   13 0  o 64.54683 6.737478 107.3162  353.7 -74.13931      13.47496 0.84 
1 1 1 5   13 1  o 90.00941 4.448033 195.9575  216.4 18.81685       8.896066 0.94 
1 1 1 5   13 2  o 132.1548 3.166945 190.0944  157.4 12.84885       6.333891 0.96 
1 1 1 5   13 3  o 61.52753 6.440122 127.8291  47.6  -9.638573      12.88024 0.88 
1 1 1 5   13 4  o 327.9937 3.722914 534.9045  330.3 -39.22000      7.445828 1.00 
1 1 1 5   13 5  o 305.9537 3.476208 481.2872  310.7 3.517609       6.952416 0.99 
1 1 1 5   13 6  o 116.6157 3.610107 172.6352  262.0 12.12521       7.220214 0.96 
1 1 1 5   13 7  o 209.5973 3.063980 309.5175  138.7 2.510666       6.127960 0.99 
1 1 1 5   13 8  o 155.6310 3.273914 370.4507  160.9 -23.74782      6.547828 0.99 
1 1 1 5   13 9  o 143.3050 3.411923 249.3577  219.1 -28.24307      6.823845 0.98 
1 1 1 5   13 10 o 38.13768 7.748996 41.75145  173.0 2.681789       15.49799 0.50 
1 1 1 5   13 11 o 128.0763 5.354270 218.1651  250.4 -9.584091      10.70854 0.98 
1 1 1 5   13 12 o 149.5720 6.445469 237.1957  245.9 15.89377       12.89094 0.99 
1 1 1 5   13 13 o 68.80517 13.44951 117.4241  146.8 -18.08288      26.89902 0.91 
1 1 1 5   13 14 o 150.9505 9.191961 169.4626  118.6 ?              ?        0.97 
1 1 1 5   13 15 o 94.81105 10.89021 103.9314  273.8 -1.760147      21.78042 0.91 
1 1 1 5   13 16 o 94.78562 11.59521 225.5234  220.3 -35.94287      23.19041 0.96 
1 1 1 5   13 17 o 59.05863 14.82128 74.61327  155.5 13.92977       29.64256 0.80 
1 1 1 5   13 18 f 186.3160 7.929869 329.1838  199.9 -9.977890      15.85974 0.00 
1 1 1 5   13 19 o 40.34124 12.70224 78.32954  199.4 13.16477       25.40447 0.80 
1 1 1 5   13 20 o 29.93502 10.33269 25.79940  287.9 -5.990850      20.66538 0.41 
1 1 1 5   13 21 o 60.17574 15.32601 115.6480  248.0 -8.696930      30.65203 0.92 
1 1 1 5   13 22 o 67.05634 15.69460 141.1071  319.4 -20.98195      31.38920 0.94 
1 1 1 5   13 23 o 39.02670 13.06963 71.84032  316.0 2.123272       26.13927 0.83 
1 1 1 5   13 24 o 30.93650 9.798615 15.54416  221.0 ?              ?        0.34 
1 1 1 5   15 0  o 80.34767 5.825876 155.5210  255.7 -9.781647      11.65175 0.95 
1 1 1 5   15 1  o 155.4224 3.622337 258.2540  40.9  4.081604       7.244673 0.99 
1 1 1 5   15 2  o 167.6113 3.984226 330.6194  9.9   -15.08090      7.968451 0.99 
1 1 1 5   15 3  f 155.5916 3.891937 310.9524  312.2 8.162521       7.783875 0.00 
1 1 1 5   15 4  o 63.83315 7.909191 157.2054  192.6 -0.1892776     15.81838 0.93 
1 1 1 5   15 5  o 114.0573 5.294997 174.3312  230.9 -29.46136      10.58999 0.97 
1 1 1 5   15 6  o 65.50536 8.151239 52.51918  284.0 -31.89082      16.30248 0.76 
1 1 1 5   15 7  o 104.0036 5.135525 208.3977  0.3   -13.37610      10.27105 0.97 
1 1 1 5   15 8  o 185.3104 3.678316 313.9855  52.6  -20.22679      7.356633 0.99 
1 1 1 5   15 9  o 94.00365 5.387283 235.4385  75.4  19.70885       10.77457 0.97 
1 1 1 5   15 10 o 87.38985 4.651817 166.7583  36.3  -2.437088      9.303634 0.96 
1 1 1 5   15 11 o 38.86429 12.58068 98.10211  4.3   -0.2231445     25.16137 0.81 
1 1 1 5   15 12 o 127.1860 9.416321 193.2601  246.5 -14.78258      18.83264 0.98 
1 1 1 5   15 13 o 119.2917 10.27816 189.9758  209.9 21.60170       20.55633 0.98 
1 1 1 5   15 14 o 77.17455 14.84308 136.0085  228.2 -8.486481      29.68617 0.95 
1 1 1 5   15 15 o 42.33432 13.42408 44.29963  289.9 1.037613       26.84815 0.71 
1 1 1 5   15 16 o 77.15865 13.22725 117.3904  264.7 -45.92894      26.45451 0.95 
1 1 1 5   15 17 o 115.1624 11.10949 190.9356  291.0 -13.52825      22.21898 0.98 
1 1 1 5   15 18 o 51.88667 14.93745 114.7290  330.8 -3.249569      29.87490 0.91 
1 1 1 5   15 19 o 42.83036 13.62166 79.85606  184.7 ?              ?        0.86 
1 1 1 5   15 20 o 36.78749 12.49521 52.09730  178.0 ?              ?        0.77 
1 1 1 5   17 0  o 133.2603 5.382684 220.1178  139.3 -18.75510      10.76537 0.99 
1 1 1 5   17 1  o 140.4937 6.976143 258.1993  124.8 -18.76807      13.95229 0.99 
1 1 1 5   17 2  f 64.93942 9.239551 169.7978  138.7 -29.97999      18.47910 0.00 
1 1 1 5   17 3  o 61.85313 9.300623 88.27829  194.9 -6.019726      18.60125 0.93 
1 1 1 5   17 4  o 32.99033 9.465771 90.70276  212.0 -4.132561      18.93154 0.87 
1 1 1 5   17 5  o 69.77011 9.525152 111.7445  95.0  -31.60685      19.05030 0.96 
1 1 1 5   17 6  o 39.91951 10.36646 94.85294  341.2 18.87311       20.73293 0.90 
1 1 1 5   17 7  o 80.86186 7.865853 132.5902  271.3 -0.6362457     15.73171 0.97 
1 1 1 5   17 8  o 85.22855 6.727030 162.8698  208.5 1.445808       13.45406 0.98 
1 1 1 5   17 9  o 119.6741 5.008429 214.7455  198.5 -3.385925      10.01686 0.99 
1 1 1 5   17 10 o 68.17964 7.608634 159.0892  202.7 -11.33267      15.21727 0.97 
1 1 1 5   17 11 o 43.72329 14.02958 111.4005  172.6 -5.376411      28.05917 0.90 
1 1 1 5   17 12 o 40.45325 13.18407 47.99361  19.4  8.523735       26.36815 0.75 
1 1 1 5   17 13 o 47.31429 15.07519 8.338244  123.3 ?              ?        0.21 
1 1 1 5   17 14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 6   0  0  o 616.6179 8.210827 2844.430  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  1  o 633.9481 6.202689 1635.649  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  2  o 80.49524 2.102608 93.42803  180.0 0.000000       0.000000 0.76 
1 1 1 6   0  3  f 367.4786 4.648825 2202.583  180.0 0.000000       0.000000 0.00 
1 1 1 6   0  4  o 512.7383 7.097938 1197.512  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  5  o 851.1837 10.78775 1945.047  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  6  o 929.9359 11.51970 1282.331  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  7  o 31.76039 4.660885 282.6458  180.0 0.000000       0.000000 0.20 
1 1 1 6   0  8  o 421.5949 6.078794 738.3624  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  9  x ?        ?        116.5236  0.0   ?              ?        0.00 
1 1 1 6   0  10 o 240.9994 4.210205 204.6377  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  11 o 639.9349 8.620861 1062.825  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  12 o 75.65067 4.380829 421.1205  0.0   0.000000       0.000000 0.59 
1 1 1 6   0  13 o 1236.336 14.66638 1613.478  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  14 o 266.9175 4.367898 250.9672  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  15 o 742.4526 13.48721 1029.928  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  16 o 294.4260 5.108824 213.0712  0.0   0.000000       0.000000 0.97 
1 1 1 6   0  17 o 380.6582 5.610551 405.9900  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  18 o 146.2636 4.754286 352.5416  180.0 0.000000       0.000000 0.99 
1 1 1 6   0  19 o 211.3935 4.422210 376.0880  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  20 o 21.91822 13.42974 86.54185  180.0 0.000000       0.000000 0.22 
1 1 1 6   0  21 o 376.4088 6.052706 478.0401  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  22 o 204.6503 4.873839 273.6131  180.0 0.000000       0.000000 1.00 
1 1 1 6   0  23 o 365.9357 5.788065 459.6020  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  24 o 155.2747 7.716313 171.5120  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  25 o 20.67594 13.59925 133.3647  180.0 0.000000       0.000000 0.58 
1 1 1 6   0  26 f 85.13718 10.05658 121.8762  0.0   0.000000       0.000000 0.00 
1 1 1 6   0  27 o 228.4435 6.239885 252.9081  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  28 o 126.5988 8.797703 209.4438  0.0   0.000000       0.000000 1.00 
1 1 1 6   0  29 o 39.01471 20.19709 80.01752  0.0   0.000000       0.000000 0.69 
1 1 1 6   0  30 o 59.33155 19.75546 60.76241  0.0   0.000000       0.000000 0.84 
1 1 1 6   0  31 o 67.14272 21.04406 39.35561  0.0   0.000000       0.000000 0.81 
1 1 1 6   0  32 o 39.12951 21.20374 26.90133  180.0 0.000000       0.000000 0.45 
1 1 1 6   0  33 o 28.97630 18.89794 2.405903  0.0   0.000000       0.000000 0.04 
1 1 1 6   0  34 o 42.69389 23.47616 65.25265  0.0   ?              ?        0.88 
1 1 1 6   2  0  o 914.2504 7.910447 2256.347  151.9 -24.20551      15.82089 1.00 
1 1 1 6   2  1  o 783.8554 7.173567 1413.348  165.7 49.75122       14.34713 0.99 
1 1 1 6   2  2  o 185.5784 2.627197 176.7205  284.5 -3.403290      5.254393 0.76 
1 1 1 6   2  3  o 368.6765 3.531800 1189.868  346.6 4.820190       7.063601 0.95 
1 1 1 6   2  4  o 714.2972 5.291615 1239.828  313.8 -14.73999      10.58323 0.99 
1 1 1 6   2  5  o 686.6447 5.073027 717.9157  196.8 107.2742       10.14605 0.99 
1 1 1 6   2  6  o 198.5957 2.528933 212.7467  49.1  42.35364       5.057866 0.93 
1 1 1 6   2  7  o 496.9079 4.392434 179.1962  271.1 -21.24991      8.784868 0.98 
1 1 1 6   2  8  o 404.7427 4.114527 895.6830  351.3 -92.25290      8.229054 0.97 
1 1 1 6   2  9  o 144.6399 2.347518 394.8183  108.7 31.53355       4.695036 0.83 
1 1 1 6   2  10 o 221.8436 4.089511 683.3391  93.6  ?              ?        0.93 
1 1 1 6   2  11 o 398.8985 4.004809 499.4423  84.8  13.34763       8.009618 0.97 
1 1 1 6   2  12 o 590.2886 5.368531 919.5718  322.2 -31.85901      10.73706 0.99 
1 1 1 6   2  13 o 288.6477 3.222208 493.4875  257.7 23.21808       6.444416 0.95 
1 1 1 6   2  14 o 248.0605 2.817192 191.0263  244.3 7.389160       5.634383 0.83 
1 1 1 6   2  15 o 694.3016 5.950577 1168.653  155.7 46.59058       11.90115 0.99 
1 1 1 6   2  16 o 690.3907 8.657499 795.7568  211.3 ?              ?        0.99 
1 1 1 6   2  17 o 372.2057 4.426228 371.8191  317.1 20.21820       8.852456 0.95 
1 1 1 6   2  18 o 201.8512 2.974063 223.1149  137.3 -13.55154      5.948126 0.89 
1 1 1 6   2  19 o 233.5911 3.568934 424.7938  149.2 -18.36888      7.137868 0.97 
1 1 1 6   2  20 o 211.1100 3.840766 354.8949  167.4 -7.921722      7.681531 0.97 
1 1 1 6   2  21 o 282.4601 3.587532 350.7787  166.0 39.40665       7.175064 0.98 
1 1 1 6   2  22 o 139.6094 4.145819 217.7910  269.0 1.043137       8.291637 0.94 
1 1 1 6   2  23 o 199.4562 3.520187 376.7206  306.5 26.28091       7.040374 0.98 
1 1 1 6   2  24 o 165.5739 4.072236 220.5049  96.1  -29.48419      8.144471 0.97 
1 1 1 6   2  25 o 255.1988 4.114333 333.0547  111.6 -26.78688      8.228666 0.99 
1 1 1 6   2  26 o 86.92776 7.650869 103.5435  219.7 -11.72348      15.30174 0.92 
1 1 1 6   2  27 o 155.5251 5.000346 211.1818  288.2 -17.19014      10.00069 0.98 
1 1 1 6   2  28 o 156.9716 5.268646 151.6260  41.6  -24.23064      10.53729 0.96 
1 1 1 6   2  29 o 46.58799 12.35680 36.15732  124.3 4.141449       24.71359 0.44 
1 1 1 6   2  30 o 39.86766 11.64930 24.42493  159.8 -0.3221130E-01 23.29860 0.36 
1 1 1 6   2  31 o 82.56998 12.96314 107.4080  79.9  7.491554       25.92629 0.94 
1 1 1 6   2  32 o 80.31831 13.09607 55.21701  147.9 32.74330       26.19214 0.88 
1 1 1 6   2  33 o 62.19010 13.18360 60.40985  65.9  -25.20969      26.36719 0.86 
1 1 1 6   4  0  o 731.1763 6.484735 530.2446  137.8 30.54602       12.96947 0.99 
1 1 1 6   4  1  o 415.7401 4.193421 627.8305  121.7 -46.07779      8.386843 0.98 
1 1 1 6   4  2  o 284.8251 3.321509 477.0163  190.7 -51.28851      6.643019 0.95 
1 1 1 6   4  3  o 378.8344 4.059215 600.2770  101.9 4.983093       8.118430 0.97 
1 1 1 6   4  4  o 149.1468 3.279948 627.8533  259.3 ?              ?        0.84 
1 1 1 6   4  5  o 67.47176 2.047888 438.4754  72.1  -8.432701      4.095776 0.19 
1 1 1 6   4  6  o 64.19296 2.125487 301.4509  293.1 4.436779       4.250973 0.27 
1 1 1 6   4  7  o 245.9280 2.234691 517.5034  256.1 25.84254       4.469382 0.94 
1 1 1 6   4  8  o 392.4818 3.580848 968.4497  86.8  22.48120       7.161696 0.98 
1 1 1 6   4  9  o 626.1417 5.084576 1372.633  322.5 0.7633057      10.16915 0.99 
1 1 1 6   4  10 o 535.9938 4.375030 849.7470  85.1  46.89264       8.750059 0.98 
1 1 1 6   4  11 o 391.3604 3.425010 955.4070  145.7 34.64246       6.850021 0.98 
1 1 1 6   4  12 o 194.4908 3.704282 323.5362  279.4 ?              ?        0.82 
1 1 1 6   4  13 o 515.2191 5.554205 289.9660  239.2 -11.96906      11.10841 0.96 
1 1 1 6   4  14 o 406.6979 3.945706 592.2144  211.4 -66.52448      7.891412 0.97 
1 1 1 6   4  15 o 224.9246 2.933991 120.6106  323.6 -18.01021      5.867982 0.80 
1 1 1 6   4  16 o 418.2598 4.168293 588.8467  285.9 -39.37622      8.336585 0.98 
1 1 1 6   4  17 o 292.0869 3.920499 273.1620  307.0 24.63971       7.840998 0.95 
1 1 1 6   4  18 o 89.55183 4.754881 157.8366  14.5  46.89664       9.509762 0.77 
1 1 1 6   4  19 o 244.9411 3.176637 432.6648  337.2 56.56961       6.353274 0.98 
1 1 1 6   4  20 o 108.4371 4.112353 185.4620  299.6 28.11734       8.224706 0.91 
1 1 1 6   4  21 o 301.3346 3.825584 472.2022  292.8 30.24182       7.651168 0.99 
1 1 1 6   4  22 f 349.1269 4.985435 575.0867  291.1 -24.57693      9.970871 0.00 
1 1 1 6   4  23 o 266.4448 3.789781 343.7101  289.6 -25.06567      7.579562 0.99 
1 1 1 6   4  24 o 110.6166 5.643006 101.0252  165.1 -48.59551      11.28601 0.91 
1 1 1 6   4  25 o 272.0901 3.930896 402.5769  243.9 -23.29480      7.861792 0.99 
1 1 1 6   4  26 o 131.8367 5.433040 158.4024  321.5 -20.33595      10.86608 0.96 
1 1 1 6   4  27 o 33.54310 10.36243 51.80713  325.8 -0.7511330     20.72486 0.41 
1 1 1 6   4  28 o 43.79877 11.59983 34.74309  314.4 10.07188       23.19965 0.40 
1 1 1 6   4  29 f 61.64648 12.10810 99.86516  275.9 -13.27319      24.21619 0.00 
1 1 1 6   4  30 o 53.79247 12.63064 38.44177  214.7 -3.149033      25.26129 0.67 
1 1 1 6   4  31 o 40.25552 12.14633 88.23694  92.4  9.768890       24.29266 0.85 
1 1 1 6   4  32 o 88.21495 10.90770 107.9779  21.2  -10.23468      21.81539 0.95 
1 1 1 6   4  33 o 170.5459 6.191993 215.0368  24.0  ?              ?        0.99 
1 1 1 6   6  0  o 416.0008 4.129571 709.8614  54.5  -6.388763      8.259142 0.98 
1 1 1 6   6  1  o 246.8892 2.832987 246.7426  75.8  -9.193512      5.665973 0.94 
1 1 1 6   6  2  o 304.0812 3.223161 576.9894  261.6 -88.51761      6.446321 0.95 
1 1 1 6   6  3  o 170.6985 2.294726 246.0917  179.8 -28.64198      4.589452 0.76 
1 1 1 6   6  4  o 212.2767 2.654654 307.0329  87.6  1.765228       5.309307 0.89 
1 1 1 6   6  5  o 609.7744 5.549191 1103.982  243.9 59.22870       11.09838 0.99 
1 1 1 6   6  6  o 662.0552 5.888899 1184.148  2.5   59.51788       11.77780 0.99 
1 1 1 6   6  7  o 381.5681 3.389963 603.7109  177.0 22.74017       6.779925 0.97 
1 1 1 6   6  8  o 115.7581 4.027236 122.5478  246.5 -32.52159      8.054472 0.74 
1 1 1 6   6  9  o 137.9820 3.161649 358.5342  249.2 4.667542       6.323297 0.74 
1 1 1 6   6  10 f 33.35001 6.904516 172.1297  210.1 0.5087852      13.80903 0.00 
1 1 1 6   6  11 f 157.4713 2.485093 316.0835  153.7 17.23502       4.970185 0.00 
1 1 1 6   6  12 o 129.2535 3.554110 136.2980  191.1 -9.301979      7.108220 0.57 
1 1 1 6   6  13 o 351.7978 3.266937 582.9397  119.3 -0.5002441     6.533873 0.97 
1 1 1 6   6  14 o 478.8511 4.201851 808.3823  55.9  10.40701       8.403703 0.99 
1 1 1 6   6  15 o 179.2746 2.683651 141.7358  266.9 22.98352       5.367302 0.84 
1 1 1 6   6  16 o 196.9716 2.584712 225.3478  314.8 13.94334       5.169424 0.94 
1 1 1 6   6  17 o 69.59163 5.161262 219.1317  123.4 1.513748       10.32252 0.84 
1 1 1 6   6  18 o 293.4752 2.980932 388.0920  157.5 -3.376434      5.961864 0.99 
1 1 1 6   6  19 o 61.51392 6.843360 194.4513  188.1 48.29412       13.68672 0.83 
1 1 1 6   6  20 o 89.17123 4.463031 160.0571  170.3 -15.56302      8.926062 0.90 
1 1 1 6   6  21 o 32.05023 8.665664 57.77723  118.6 7.774277       17.33133 0.39 
1 1 1 6   6  22 o 28.67544 9.406476 15.60720  47.0  6.955204       18.81295 0.11 
1 1 1 6   6  23 o 61.83746 8.896729 157.9361  110.5 7.670639       17.79346 0.90 
1 1 1 6   6  24 o 156.6248 4.258543 222.6529  318.7 -3.773239      8.517087 0.98 
1 1 1 6   6  25 o 112.3446 6.355097 162.5892  31.5  -52.25996      12.71019 0.96 
1 1 1 6   6  26 o 87.39638 8.661781 77.07188  351.0 -26.01320      17.32356 0.86 
1 1 1 6   6  27 o 105.3450 7.549325 139.8054  302.3 -16.62352      15.09865 0.95 
1 1 1 6   6  28 o 72.68593 10.79825 114.1891  354.3 -9.370201      21.59649 0.92 
1 1 1 6   6  29 o 56.86302 12.84887 81.64288  17.8  -0.7303543     25.69774 0.88 
1 1 1 6   6  30 o 172.0645 5.993241 245.2281  321.2 -17.34360      11.98648 0.99 
1 1 1 6   6  31 o 49.00957 13.49388 42.27599  323.4 -14.36567      26.98775 0.72 
1 1 1 6   6  32 o 32.34283 10.90149 40.35433  61.0  ?              ?        0.65 
1 1 1 6   8  0  o 441.5890 4.317803 741.4276  113.8 13.19037       8.635606 0.98 
1 1 1 6   8  1  o 550.4500 5.045502 692.3984  115.5 31.34247       10.09100 0.98 
1 1 1 6   8  2  o 211.5502 3.547657 537.7401  347.1 72.38541       7.095315 0.94 
1 1 1 6   8  3  o 216.4972 2.673809 252.5903  46.5  -14.33539      5.347619 0.91 
1 1 1 6   8  4  o 530.7770 4.710805 808.9334  155.5 -1.973633      9.421611 0.99 
1 1 1 6   8  5  o 335.8168 3.303064 637.0354  297.7 -26.14499      6.606128 0.97 
1 1 1 6   8  6  o 310.0879 3.941613 392.5043  229.8 18.21887       7.883225 0.94 
1 1 1 6   8  7  o 506.2292 4.568213 919.6675  86.0  0.7520447      9.136425 0.99 
1 1 1 6   8  8  o 518.3252 4.277246 841.1469  341.7 -8.830139      8.554492 0.99 
1 1 1 6   8  9  o 346.5468 3.109272 407.8886  256.1 -33.77734      6.218544 0.96 
1 1 1 6   8  10 o 313.8474 4.030679 618.2442  199.3 25.04877       8.061358 0.97 
1 1 1 6   8  11 o 57.26618 7.005736 104.0810  320.4 -18.07368      14.01147 0.36 
1 1 1 6   8  12 o 33.79370 7.475410 92.52842  91.2  9.432472       14.95082 0.23 
1 1 1 6   8  13 o 51.43417 7.941162 187.7775  11.6  -11.45317      15.88232 0.65 
1 1 1 6   8  14 o 109.2013 4.623613 238.8008  62.2  7.648186       9.247227 0.92 
1 1 1 6   8  15 o 229.9139 3.497186 381.9462  145.0 -1.636642      6.994373 0.98 
1 1 1 6   8  16 o 207.9344 3.096619 370.6808  139.4 -29.98341      6.193237 0.98 
1 1 1 6   8  17 o 225.1178 2.960869 319.4543  128.6 21.06165       5.921738 0.98 
1 1 1 6   8  18 o 213.3693 3.000621 328.5325  67.3  18.08673       6.001242 0.98 
1 1 1 6   8  19 o 146.4199 3.743533 224.4445  39.9  16.79471       7.487066 0.97 
1 1 1 6   8  20 o 104.2812 4.316953 72.89162  138.5 -7.675064      8.633905 0.87 
1 1 1 6   8  21 o 38.27676 9.158833 43.15969  206.9 16.82208       18.31767 0.45 
1 1 1 6   8  22 f 135.8311 4.743057 154.3457  233.7 53.05003       9.486114 0.00 
1 1 1 6   8  23 o 188.4890 3.965596 300.1077  137.5 11.49159       7.931192 0.99 
1 1 1 6   8  24 o 44.63604 10.41623 45.26192  80.2  -23.31828      20.83246 0.49 
1 1 1 6   8  25 o 55.42400 10.89523 120.3124  188.7 -21.28991      21.79047 0.87 
1 1 1 6   8  26 o 101.0343 6.762477 175.1884  150.4 -16.64246      13.52495 0.97 
1 1 1 6   8  27 o 129.8425 7.437835 141.6132  351.4 -13.45732      14.87567 0.97 
1 1 1 6   8  28 o 79.65749 10.46364 129.8155  332.7 36.66356       20.92728 0.96 
1 1 1 6   8  29 o 30.90835 10.08408 15.69951  329.5 1.636606       20.16816 0.27 
1 1 1 6   8  30 o 34.51162 11.00429 40.22648  195.3 ?              ?        0.65 
1 1 1 6   10 0  o 234.7424 4.002675 273.2526  0.2   71.66580       8.005349 0.93 
1 1 1 6   10 1  o 360.5471 3.662611 386.5874  126.5 51.72144       7.325222 0.97 
1 1 1 6   10 2  o 364.5327 3.812922 595.6886  61.9  -1.581818      7.625844 0.98 
1 1 1 6   10 3  o 160.1247 2.688988 230.9574  211.8 17.26105       5.377977 0.89 
1 1 1 6   10 4  o 258.9322 3.984649 472.6776  185.1 ?              ?        0.97 
1 1 1 6   10 5  o 73.99110 3.729711 164.4015  229.9 -24.99576      7.459422 0.71 
1 1 1 6   10 6  o 72.20567 4.381261 30.64652  55.1  9.115456       8.762522 0.12 
1 1 1 6   10 7  o 30.10327 7.319041 147.0668  124.6 -11.93537      14.63808 0.41 
1 1 1 6   10 8  f 107.1174 2.939478 49.60353  196.3 -0.9771652     5.878956 0.00 
1 1 1 6   10 9  o 196.5333 2.386459 320.0100  286.4 -19.84966      4.772919 0.97 
1 1 1 6   10 10 o 148.3658 2.673326 279.2834  233.1 -14.61568      5.346652 0.96 
1 1 1 6   10 11 o 83.97402 5.040036 138.7592  52.0  -32.80588      10.08007 0.83 
1 1 1 6   10 12 o 186.5448 3.608981 440.5923  299.2 -13.99870      7.217962 0.98 
1 1 1 6   10 13 o 291.8752 4.380373 518.6445  6.2   10.65964       8.760747 0.99 
1 1 1 6   10 14 o 185.4153 3.723989 244.5758  77.2  -11.99576      7.447978 0.97 
1 1 1 6   10 15 o 179.8418 4.158751 295.7090  183.5 3.583282       8.317503 0.98 
1 1 1 6   10 16 o 223.9090 3.699670 381.9091  230.0 -27.71202      7.399339 0.99 
1 1 1 6   10 17 f 88.49535 6.701632 123.3763  267.7 -2.928474      13.40326 0.00 
1 1 1 6   10 18 o 87.19846 5.868247 163.5490  249.2 -5.868706      11.73649 0.95 
1 1 1 6   10 19 o 41.80431 10.70784 80.23932  348.7 0.3554726      21.41569 0.78 
1 1 1 6   10 20 x ?        ?        57.71614  148.4 ?              ?        0.00 
1 1 1 6   10 21 o 61.00490 9.621804 167.8361  64.3  28.69971       19.24361 0.91 
1 1 1 6   10 22 o 118.6448 7.083293 168.3736  14.0  8.724754       14.16659 0.96 
1 1 1 6   10 23 o 37.73664 11.04581 113.5537  274.5 -7.036911      22.09162 0.82 
1 1 1 6   10 24 o 98.58849 6.509574 179.0168  47.0  -19.28975      13.01915 0.97 
1 1 1 6   10 25 o 38.60205 11.26195 82.52465  78.8  4.365730       22.52390 0.84 
1 1 1 6   10 26 o 89.06561 9.776899 142.0938  213.4 19.24549       19.55380 0.97 
1 1 1 6   10 27 o 58.92793 12.30772 74.72834  168.2 3.409458       24.61544 0.89 
1 1 1 6   10 28 o 30.48718 10.52490 93.34866  164.5 ?              ?        0.86 
1 1 1 6   12 0  o 197.7912 3.190490 422.8473  330.7 -36.09593      6.380980 0.98 
1 1 1 6   12 1  o 192.2420 3.502232 279.5286  163.5 41.53125       7.004464 0.97 
1 1 1 6   12 2  o 89.26595 3.786332 197.2597  312.1 26.52415       7.572664 0.91 
1 1 1 6   12 3  o 156.0451 2.941426 287.1722  338.3 -8.821106      5.882852 0.97 
1 1 1 6   12 4  o 48.98093 6.787054 84.37235  83.6  -15.47527      13.57411 0.61 
1 1 1 6   12 5  o 144.6937 3.072940 135.2057  249.3 11.13113       6.145880 0.93 
1 1 1 6   12 6  o 128.1039 3.556464 167.8356  84.1  -11.22614      7.112927 0.94 
1 1 1 6   12 7  o 118.7673 3.309434 225.6813  42.7  -2.903221      6.618869 0.96 
1 1 1 6   12 8  o 134.0204 3.541520 155.9631  214.3 64.68409       7.083039 0.95 
1 1 1 6   12 9  f 104.1280 3.538781 156.3853  292.5 7.850845       7.077563 0.00 
1 1 1 6   12 10 o 230.7802 2.702636 427.3330  76.3  -6.989563      5.405272 0.99 
1 1 1 6   12 11 o 132.5741 5.135949 228.4811  167.6 -14.11962      10.27190 0.97 
1 1 1 6   12 12 o 286.7259 4.297799 475.4357  220.8 15.61597       8.595598 0.99 
1 1 1 6   12 13 o 95.45476 8.626795 278.2368  230.3 12.51670       17.25359 0.97 
1 1 1 6   12 14 o 94.16518 10.40535 152.3365  256.4 19.13240       20.81069 0.95 
1 1 1 6   12 15 o 58.12784 13.15189 37.73021  281.8 -7.363449      26.30378 0.64 
1 1 1 6   12 16 o 112.0339 9.031081 194.4138  215.1 -26.17934      18.06216 0.97 
1 1 1 6   12 17 o 59.27108 12.84370 154.8737  69.7  5.500801       25.68740 0.90 
1 1 1 6   12 18 o 128.5426 6.345497 214.0154  291.3 34.80438       12.69099 0.97 
1 1 1 6   12 19 o 162.4843 5.612967 303.0117  300.4 7.158371       11.22593 0.99 
1 1 1 6   12 20 o 42.87417 10.12126 98.82427  239.2 6.795982       20.24251 0.84 
1 1 1 6   12 21 o 44.50616 11.92491 69.38378  142.7 -30.03463      23.84981 0.80 
1 1 1 6   12 22 o 137.1280 6.844714 187.0295  153.1 33.65597       13.68943 0.99 
1 1 1 6   12 23 o 54.70928 12.78614 124.0021  216.3 -33.27585      25.57227 0.93 
1 1 1 6   12 24 o 46.28509 10.30705 87.99747  272.4 26.14725       20.61410 0.90 
1 1 1 6   12 25 o 76.26146 11.88829 93.65769  244.8 21.87008       23.77659 0.94 
1 1 1 6   12 26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 6   14 0  o 112.0696 3.939030 160.8365  211.1 54.72220       7.878061 0.96 
1 1 1 6   14 1  o 160.9259 3.581017 255.1854  33.3  -4.950241      7.162035 0.98 
1 1 1 6   14 2  o 201.6374 3.516148 348.3403  56.1  0.5719452      7.032295 0.99 
1 1 1 6   14 3  o 141.5899 3.846866 211.5743  283.1 37.51183       7.693733 0.98 
1 1 1 6   14 4  f 43.27687 7.650326 217.7727  159.8 42.54919       15.30065 0.00 
1 1 1 6   14 5  o 41.65350 8.891440 63.70740  149.4 -0.1748276     17.78288 0.72 
1 1 1 6   14 6  o 168.5199 3.434210 292.9195  270.1 -8.295761      6.868420 0.99 
1 1 1 6   14 7  o 152.7211 3.789232 198.5520  312.6 2.911972       7.578464 0.98 
1 1 1 6   14 8  o 72.26135 7.060857 165.3571  2.4   -27.02309      14.12171 0.95 
1 1 1 6   14 9  o 179.4102 3.408226 339.3514  44.8  -7.152664      6.816452 0.99 
1 1 1 6   14 10 o 24.85415 7.732626 51.60490  126.3 -0.8928490E-01 15.46525 0.42 
1 1 1 6   14 11 o 127.2063 5.356656 228.5800  238.2 -8.918304      10.71331 0.98 
1 1 1 6   14 12 o 52.19315 13.85510 91.78195  303.0 -13.67954      27.71021 0.80 
1 1 1 6   14 13 o 83.58260 18.94958 113.1946  20.9  ?              ?        0.90 
1 1 1 6   14 14 o 75.79183 14.67635 91.15202  7.0   1.856415       29.35271 0.88 
1 1 1 6   14 15 o 62.15013 14.06721 144.8226  306.0 -17.64412      28.13443 0.92 
1 1 1 6   14 16 o 59.75860 15.23083 144.0357  174.0 4.940582       30.46167 0.93 
1 1 1 6   14 17 o 62.34997 21.60219 93.99156  97.9  ?              ?        0.86 
1 1 1 6   14 18 f 68.30830 14.55484 119.2192  34.8  39.99220       29.10968 0.00 
1 1 1 6   14 19 o 61.48426 14.19377 150.9144  47.3  -37.20178      28.38754 0.95 
1 1 1 6   14 20 o 42.53769 13.78742 84.56236  336.4 25.99756       27.57484 0.86 
1 1 1 6   14 21 o 52.13676 15.39271 76.74551  355.3 7.682163       30.78542 0.87 
1 1 1 6   14 22 o 35.80380 12.10194 27.79288  90.0  ?              ?        0.56 
1 1 1 6   16 0  o 62.24287 10.07840 96.94527  241.7 10.88153       20.15681 0.89 
1 1 1 6   16 1  o 39.83559 9.627254 75.31923  13.1  13.18509       19.25451 0.76 
1 1 1 6   16 2  o 95.55687 6.029108 148.5085  65.3  -9.805405      12.05822 0.96 
1 1 1 6   16 3  o 105.1128 6.195297 156.2207  217.5 -45.90691      12.39059 0.97 
1 1 1 6   16 4  o 33.73289 9.571181 62.98413  106.8 4.833538       19.14236 0.68 
1 1 1 6   16 5  o 96.01108 5.779326 168.8937  322.7 7.474045       11.55865 0.97 
1 1 1 6   16 6  o 40.08423 9.626426 88.14650  263.8 -17.98985      19.25285 0.84 
1 1 1 6   16 7  o 84.82092 6.819818 136.6045  208.0 -22.88516      13.63964 0.96 
1 1 1 6   16 8  o 37.02694 10.36580 77.71174  273.6 2.289444       20.73159 0.82 
1 1 1 6   16 9  f 67.87843 8.046990 192.5949  343.0 -19.24139      16.09398 0.00 
1 1 1 6   16 10 o 76.04140 6.301871 104.9580  12.8  -0.4274292     12.60374 0.96 
1 1 1 6   16 11 o 78.42814 10.76200 125.0478  260.8 -20.39108      21.52399 0.96 
1 1 1 6   16 12 o 46.06305 14.16870 86.75231  313.3 -12.48770      28.33739 0.87 
1 1 1 6   16 13 o 63.31245 16.01048 200.8037  70.7  12.92423       32.02097 0.96 
1 1 1 6   16 14 o 54.32387 15.03079 122.6456  43.4  -3.731899      30.06158 0.92 
1 1 1 6   16 15 o 44.99417 13.89932 24.03694  184.0 6.514385       27.79864 0.52 
1 1 1 6   16 16 o 37.45634 12.61221 121.2668  261.3 ?              ?        0.91 
1 1 1 6   16 17 x ?        ?        157.8086  258.2 ?              ?        0.00 
1 1 1 6   18 0  f 40.95145 11.13240 76.52586  205.2 5.800922       22.26479 0.00 
1 1 1 6   18 1  o 34.49741 10.28563 89.90996  284.6 8.262608       20.57126 0.88 
1 1 1 6   18 2  o 42.08916 11.49704 50.93713  50.8  2.479309       22.99409 0.80 
1 1 1 6   18 3  o 45.73580 11.29663 36.46605  127.5 1.399845       22.59326 0.74 
1 1 1 6   18 4  o 49.37550 13.50493 103.7626  213.8 -33.27322      27.00986 0.91 
1 1 1 6   18 5  o 33.52993 10.31290 31.48831  184.7 10.31178       20.62580 0.62 
1 1 1 6   18 6  o 45.93408 11.50610 90.83051  310.8 ?              ?        0.91 
1 1 1 6   18 7  o 55.99487 11.26844 138.7476  323.9 ?              ?        0.95 
1 1 1 6   18 8  o 40.81483 10.94022 39.48148  40.5  ?              ?        0.76 
1 1 1 7   1  0  o 658.9166 5.216057 3034.527  172.5 -20.91711      10.43211 0.99 
1 1 1 7   1  1  o 656.5891 5.065017 1455.985  247.2 -68.92712      10.13003 0.99 
1 1 1 7   1  2  o 179.8370 1.945179 738.4269  263.1 -30.71140      3.890357 0.87 
1 1 1 7   1  3  o 1114.830 7.882537 1361.660  127.7 -42.86426      15.76507 1.00 
1 1 1 7   1  4  o 840.3990 6.179927 1691.160  327.1 -47.14063      12.35985 0.99 
1 1 1 7   1  5  o 636.7514 5.386907 925.8694  74.3  59.51819       10.77381 0.99 
1 1 1 7   1  6  o 349.3486 3.501736 696.1461  159.8 -49.88394      7.003472 0.96 
1 1 1 7   1  7  o 644.0558 5.979614 540.6754  229.3 -41.51123      11.95923 0.99 
1 1 1 7   1  8  o 346.1161 3.606907 492.5332  202.2 -3.974182      7.213814 0.96 
1 1 1 7   1  9  o 316.5314 3.574459 264.1684  143.0 -59.26331      7.148917 0.94 
1 1 1 7   1  10 o 287.5834 3.328046 489.9490  338.7 116.2723       6.656093 0.93 
1 1 1 7   1  11 o 98.48178 2.538559 361.3476  219.4 -29.97334      5.077118 0.47 
1 1 1 7   1  12 o 306.4365 3.457688 491.6160  258.8 -12.82196      6.915377 0.95 
1 1 1 7   1  13 o 403.4666 4.070774 543.0587  212.9 7.810944       8.141547 0.96 
1 1 1 7   1  14 o 516.9653 4.865754 621.0552  57.5  -16.02045      9.731507 0.98 
1 1 1 7   1  15 o 511.6102 4.874032 538.7217  230.7 -10.10156      9.748065 0.98 
1 1 1 7   1  16 o 330.3125 5.277754 533.3269  204.4 ?              ?        0.96 
1 1 1 7   1  17 o 238.5986 3.172610 318.1704  56.2  23.79126       6.345220 0.91 
1 1 1 7   1  18 o 371.0405 4.017813 352.0044  105.1 3.062744       8.035625 0.97 
1 1 1 7   1  19 o 181.9998 2.971222 330.7800  175.1 -19.61726      5.942443 0.95 
1 1 1 7   1  20 o 103.2114 3.992009 131.4296  59.3  8.682762       7.984018 0.83 
1 1 1 7   1  21 o 76.34850 5.657565 117.3532  316.2 -24.81403      11.31513 0.78 
1 1 1 7   1  22 o 35.72224 9.468077 101.1458  27.3  10.82233       18.93615 0.47 
1 1 1 7   1  23 o 172.7004 3.788130 173.5560  334.5 0.2915955E-01  7.576259 0.96 
1 1 1 7   1  24 o 83.30568 6.533287 143.9477  220.7 -3.895638      13.06657 0.91 
1 1 1 7   1  25 o 50.76187 10.40335 99.38902  152.7 14.96988       20.80669 0.77 
1 1 1 7   1  26 o 51.32561 10.66221 57.19234  348.8 -8.734943      21.32443 0.69 
1 1 1 7   1  27 o 36.85653 10.43129 83.82446  356.4 -11.53753      20.86259 0.66 
1 1 1 7   1  28 o 58.63959 11.60154 44.95751  66.3  5.394173       23.20308 0.56 
1 1 1 7   1  29 o 42.42842 11.71284 78.25747  68.4  -0.4159088     23.42568 0.70 
1 1 1 7   1  30 o 139.8400 6.482530 209.0176  67.5  8.353516       12.96506 0.98 
1 1 1 7   1  31 o 108.4102 8.413339 150.7909  354.7 -10.67599      16.82668 0.97 
1 1 1 7   1  32 o 43.85870 12.61840 37.51090  38.4  -14.02169      25.23679 0.63 
1 1 1 7   1  33 o 39.28957 12.04612 48.90710  81.3  -18.28849      24.09225 0.72 
1 1 1 7   3  0  o 1040.806 8.802417 2002.335  336.9 -72.34515      17.60483 1.00 
1 1 1 7   3  1  o 656.6155 6.157895 378.2192  210.7 24.45050       12.31579 0.99 
1 1 1 7   3  2  o 1129.935 9.761779 1745.800  158.1 35.81799       19.52356 1.00 
1 1 1 7   3  3  o 850.7178 7.651667 1170.236  7.1   8.001343       15.30333 0.99 
1 1 1 7   3  4  o 121.8573 1.932496 612.9235  117.7 -13.64454      3.864991 0.88 
1 1 1 7   3  5  o 123.7911 1.789081 269.7378  345.6 47.98357       3.578161 0.76 
1 1 1 7   3  6  o 235.8173 2.765942 481.1429  78.2  49.44331       5.531883 0.94 
1 1 1 7   3  7  o 517.4741 4.591146 1212.670  279.2 -50.31967      9.182293 0.98 
1 1 1 7   3  8  f 174.7380 2.277233 424.4644  256.0 -17.73859      4.554466 0.00 
1 1 1 7   3  9  o 522.1821 4.561745 701.7238  78.1  19.52307       9.123489 0.98 
1 1 1 7   3  10 o 563.3188 4.814120 746.9119  6.3   23.81830       9.628241 0.98 
1 1 1 7   3  11 o 214.8637 2.727413 269.3015  204.7 -39.27081      5.454826 0.86 
1 1 1 7   3  12 o 433.4948 4.161750 818.6004  179.0 32.51251       8.323500 0.97 
1 1 1 7   3  13 o 175.5641 2.499106 340.7785  143.5 32.51241       4.998212 0.87 
1 1 1 7   3  14 o 577.4507 6.184747 587.9223  83.8  -13.68774      12.36949 0.98 
1 1 1 7   3  15 o 63.61950 4.854343 133.1343  173.3 -15.08354      9.708687 0.26 
1 1 1 7   3  16 o 117.6361 4.095348 312.4583  188.5 59.43250       8.190696 0.82 
1 1 1 7   3  17 o 253.8879 3.229588 322.1239  348.4 -37.26816      6.459175 0.94 
1 1 1 7   3  18 o 294.9658 4.263521 465.5112  353.2 5.168121       8.527041 0.97 
1 1 1 7   3  19 o 257.8612 4.691061 424.2461  41.2  ?              ?        0.98 
1 1 1 7   3  20 o 120.2990 4.754748 146.6313  314.4 -28.92862      9.509496 0.90 
1 1 1 7   3  21 o 110.6788 4.264843 121.4106  206.1 2.907021       8.529687 0.85 
1 1 1 7   3  22 o 179.6626 3.603747 302.9535  281.1 -25.04768      7.207493 0.97 
1 1 1 7   3  23 o 200.7595 3.497841 346.4177  304.0 -52.61168      6.995683 0.98 
1 1 1 7   3  24 o 89.77333 6.274086 78.35136  124.0 5.805840       12.54817 0.84 
1 1 1 7   3  25 o 159.2790 4.650450 198.9009  244.5 9.923782       9.300900 0.97 
1 1 1 7   3  26 o 48.84618 10.83490 94.71830  232.3 -5.968025      21.66980 0.82 
1 1 1 7   3  27 o 41.16175 11.44613 9.038157  46.2  11.46307       22.89225 0.09 
1 1 1 7   3  28 o 52.72017 10.77707 52.24292  33.7  32.98819       21.55413 0.61 
1 1 1 7   3  29 o 76.26814 9.991481 132.9577  211.6 -9.183350      19.98296 0.93 
1 1 1 7   3  30 o 53.73849 13.06478 95.61600  61.0  -0.1128769     26.12956 0.88 
1 1 1 7   3  31 o 55.54561 12.53884 95.40572  54.1  -25.45518      25.07769 0.90 
1 1 1 7   3  32 o 36.77158 11.66244 53.75480  141.7 -6.914581      23.32489 0.71 
1 1 1 7   3  33 o 85.63683 12.21277 82.53092  103.9 ?              ?        0.94 
1 1 1 7   5  0  o 148.3037 2.055023 331.0434  57.3  -13.84695      4.110047 0.86 
1 1 1 7   5  1  o 389.4020 3.850944 569.1555  158.5 54.20691       7.701888 0.97 
1 1 1 7   5  2  o 476.9441 4.709484 611.4585  103.9 -66.70062      9.418968 0.98 
1 1 1 7   5  3  o 336.3711 3.624177 565.7476  123.9 -33.11218      7.248354 0.95 
1 1 1 7   5  4  o 353.6189 5.508417 529.9890  126.7 ?              ?        0.96 
1 1 1 7   5  5  o 221.5049 2.761418 341.4399  90.9  -31.49054      5.522835 0.92 
1 1 1 7   5  6  o 266.3354 2.801709 257.3324  43.5  -66.72716      5.603418 0.92 
1 1 1 7   5  7  o 496.7889 4.267313 973.5831  166.8 6.044373       8.534625 0.98 
1 1 1 7   5  8  o 320.5585 3.273204 450.7206  170.6 -33.69485      6.546408 0.95 
1 1 1 7   5  9  o 87.79044 3.857008 207.0578  26.6  77.60830       7.714015 0.47 
1 1 1 7   5  10 o 321.4927 3.174521 316.3176  116.9 -79.26758      6.349041 0.94 
1 1 1 7   5  11 o 61.58375 3.968611 179.6516  40.7  25.56565       7.937222 0.31 
1 1 1 7   5  12 o 661.6396 5.322394 817.9638  0.1   33.03314       10.64479 0.99 
1 1 1 7   5  13 o 292.1356 3.286342 366.5304  140.7 -46.03464      6.572684 0.95 
1 1 1 7   5  14 o 220.3664 2.626056 306.6911  306.5 54.63983       5.252112 0.90 
1 1 1 7   5  15 f 351.4192 3.357258 338.4155  201.3 -37.93817      6.714516 0.00 
1 1 1 7   5  16 o 124.0528 3.042521 155.5815  96.6  21.60605       6.085043 0.75 
1 1 1 7   5  17 o 268.8891 2.967589 348.9454  168.6 -55.52219      5.935177 0.97 
1 1 1 7   5  18 o 159.5182 3.289801 206.6293  198.4 -13.17647      6.579601 0.94 
1 1 1 7   5  19 o 166.8214 3.167777 343.9365  355.4 -2.141571      6.335554 0.97 
1 1 1 7   5  20 o 103.9200 4.160651 77.95016  142.8 -20.22495      8.321302 0.74 
1 1 1 7   5  21 o 96.34976 5.196041 168.9206  340.4 21.01984       10.39208 0.92 
1 1 1 7   5  22 o 62.12658 7.622124 62.94954  42.8  -22.25878      15.24425 0.67 
1 1 1 7   5  23 o 46.36639 10.95848 52.95774  56.7  -9.279182      21.91696 0.51 
1 1 1 7   5  24 o 31.77419 9.391505 45.48258  267.7 12.69799       18.78301 0.41 
1 1 1 7   5  25 o 40.30124 10.92914 91.84422  20.6  6.813168       21.85827 0.76 
1 1 1 7   5  26 o 291.1691 4.416714 314.8301  41.9  -9.904114      8.833428 0.99 
1 1 1 7   5  27 o 102.8541 7.014977 121.6247  72.2  3.488197       14.02995 0.93 
1 1 1 7   5  28 o 38.95460 10.55584 38.35476  319.9 -21.91044      21.11168 0.46 
1 1 1 7   5  29 o 39.40514 11.63695 30.45235  302.9 -3.815346      23.27391 0.47 
1 1 1 7   5  30 o 36.95669 11.58431 44.33468  299.6 1.104515       23.16861 0.65 
1 1 1 7   5  31 o 60.81531 13.53603 71.68246  119.8 11.34911       27.07206 0.87 
1 1 1 7   5  32 o 38.39857 11.71106 42.49416  350.9 ?              ?        0.69 
1 1 1 7   7  0  f 327.8452 3.366674 550.5783  290.9 18.26611       6.733349 0.00 
1 1 1 7   7  1  o 248.3217 2.755487 263.8417  154.0 -62.69485      5.510975 0.89 
1 1 1 7   7  2  o 179.7386 2.480428 496.0582  0.4   61.74272       4.960855 0.90 
1 1 1 7   7  3  o 517.3940 4.807316 765.9284  345.6 -14.43225      9.614633 0.98 
1 1 1 7   7  4  o 365.1394 3.660037 713.5032  138.2 17.60352       7.320074 0.97 
1 1 1 7   7  5  o 222.1453 3.512150 365.9733  212.4 -12.32152      7.024300 0.92 
1 1 1 7   7  6  o 322.1191 3.317510 544.7710  187.8 -21.57132      6.635020 0.96 
1 1 1 7   7  7  o 181.0089 2.633544 507.1761  109.4 -20.04767      5.267088 0.90 
1 1 1 7   7  8  o 606.5870 4.943805 821.2778  360.0 -1.595520      9.887610 0.99 
1 1 1 7   7  9  o 388.7991 4.327402 488.9097  330.5 70.19168       8.654803 0.97 
1 1 1 7   7  10 o 252.8880 3.611712 461.2667  90.3  13.30878       7.223423 0.94 
1 1 1 7   7  11 o 215.9173 3.187320 132.4612  148.0 -14.54227      6.374640 0.72 
1 1 1 7   7  12 o 279.7785 3.997205 336.5140  183.7 15.63107       7.994411 0.95 
1 1 1 7   7  13 o 149.9668 3.622190 225.5473  298.1 -49.35305      7.244380 0.85 
1 1 1 7   7  14 o 62.64812 5.195251 167.6604  338.0 8.735813       10.39050 0.65 
1 1 1 7   7  15 o 218.3184 2.949795 462.9720  193.4 16.13113       5.899589 0.98 
1 1 1 7   7  16 o 106.9748 3.563155 180.4089  92.9  -4.238274      7.126310 0.91 
1 1 1 7   7  17 o 179.9039 2.902987 239.5692  79.5  11.73747       5.805975 0.96 
1 1 1 7   7  18 o 82.85503 4.673550 162.8834  222.6 -5.362190      9.347100 0.88 
1 1 1 7   7  19 o 32.64211 8.809964 16.69055  337.4 -13.65926      17.61993 0.11 
1 1 1 7   7  20 o 110.2476 4.195375 214.4455  113.9 16.77166       8.390750 0.96 
1 1 1 7   7  21 o 156.8114 3.483551 209.0906  95.6  9.113342       6.967101 0.97 
1 1 1 7   7  22 o 99.89337 5.021055 174.5038  102.0 -17.41671      10.04211 0.95 
1 1 1 7   7  23 o 205.3608 4.149268 269.8522  133.9 -6.476120      8.298535 0.99 
1 1 1 7   7  24 f 45.83729 10.72204 81.06638  217.1 0.2361259      21.44408 0.00 
1 1 1 7   7  25 o 65.07741 10.81331 89.24715  153.9 9.606655       21.62663 0.83 
1 1 1 7   7  26 o 71.41695 9.072291 111.5511  149.4 2.862526       18.14458 0.90 
1 1 1 7   7  27 o 33.27921 10.31561 18.61367  125.9 -17.78782      20.63122 0.25 
1 1 1 7   7  28 o 50.28526 10.19040 14.18849  127.5 -45.60352      20.38080 0.35 
1 1 1 7   7  29 o 38.60023 10.94525 34.30330  187.3 12.16693       21.89050 0.59 
1 1 1 7   7  30 o 43.57546 11.68674 49.66039  35.1  10.53148       23.37349 0.76 
1 1 1 7   7  31 o 35.27967 11.02994 76.85731  64.3  ?              ?        0.84 
1 1 1 7   9  0  o 767.5476 8.091737 1058.189  107.8 -36.40302      16.18347 0.99 
1 1 1 7   9  1  o 213.7717 2.783051 410.3600  54.0  40.49751       5.566102 0.93 
1 1 1 7   9  2  o 438.0322 4.219495 797.3227  347.6 -25.80444      8.438990 0.98 
1 1 1 7   9  3  o 494.4516 5.721946 743.8845  143.4 40.78699       11.44389 0.98 
1 1 1 7   9  4  o 208.0370 2.686397 356.9980  163.6 -32.08983      5.372793 0.91 
1 1 1 7   9  5  o 127.8616 2.756937 227.4692  99.3  0.7697067      5.513874 0.78 
1 1 1 7   9  6  o 50.29585 6.013879 37.99405  256.5 19.53277       12.02776 0.08 
1 1 1 7   9  7  o 335.6545 3.909150 537.5241  128.4 3.200287       7.818300 0.98 
1 1 1 7   9  8  o 186.8636 2.590205 376.4742  355.2 -16.44083      5.180411 0.95 
1 1 1 7   9  9  o 126.0309 2.696931 206.4367  59.4  -12.83623      5.393862 0.87 
1 1 1 7   9  10 o 109.2487 2.467364 186.1500  292.6 -17.71488      4.934728 0.85 
1 1 1 7   9  11 o 62.45496 5.939442 117.0512  84.9  -12.49358      11.87888 0.57 
1 1 1 7   9  12 o 179.8470 3.893575 258.0257  177.5 14.16682       7.787149 0.96 
1 1 1 7   9  13 o 87.05699 7.130599 193.1126  46.0  36.63460       14.26120 0.90 
1 1 1 7   9  14 o 75.17931 7.221037 127.8143  53.2  7.389557       14.44207 0.81 
1 1 1 7   9  15 o 121.7608 4.511922 179.3521  82.9  7.454575       9.023844 0.93 
1 1 1 7   9  16 o 132.4313 4.540051 230.6283  282.5 -8.492462      9.080103 0.96 
1 1 1 7   9  17 o 124.0941 4.934409 238.2503  288.9 -3.452271      9.868817 0.97 
1 1 1 7   9  18 o 86.94400 8.176220 105.2474  115.2 30.99685       16.35244 0.89 
1 1 1 7   9  19 o 84.84918 6.909393 142.1695  37.8  -14.50310      13.81879 0.93 
1 1 1 7   9  20 o 122.0667 4.658376 203.8363  264.1 -12.57627      9.316751 0.97 
1 1 1 7   9  21 o 78.91147 6.897006 82.42231  288.2 0.9637299      13.79401 0.89 
1 1 1 7   9  22 o 157.6630 4.232785 229.1482  254.8 14.45540       8.465570 0.98 
1 1 1 7   9  23 o 139.5910 4.952375 257.5504  155.9 14.30167       9.904750 0.98 
1 1 1 7   9  24 o 185.4548 4.350413 259.3769  50.6  12.39543       8.700826 0.99 
1 1 1 7   9  25 o 81.06305 9.249454 109.7758  332.4 -49.79270      18.49891 0.94 
1 1 1 7   9  26 o 140.0065 6.587749 221.6174  267.0 -20.34801      13.17550 0.99 
1 1 1 7   9  27 o 109.1330 7.722766 208.7029  286.1 1.870941       15.44553 0.98 
1 1 1 7   9  28 o 68.59443 12.14079 77.82803  323.7 17.80792       24.28157 0.91 
1 1 1 7   9  29 o 38.05767 11.58475 89.98548  323.4 ?              ?        0.88 
1 1 1 7   11 0  f 461.8683 4.493294 625.8193  27.5  70.96423       8.986588 0.00 
1 1 1 7   11 1  o 393.3027 4.063208 564.7328  25.5  21.22229       8.126415 0.99 
1 1 1 7   11 2  o 161.0823 3.136902 268.9490  269.8 41.63390       6.273804 0.95 
1 1 1 7   11 3  o 176.6696 2.741616 308.9763  261.6 6.767059       5.483233 0.97 
1 1 1 7   11 4  o 195.8738 4.223037 347.4993  112.6 ?              ?        0.98 
1 1 1 7   11 5  o 239.0563 3.077897 298.0817  60.0  -15.07919      6.155794 0.98 
1 1 1 7   11 6  o 163.3966 2.869121 246.8578  347.1 38.50586       5.738242 0.96 
1 1 1 7   11 7  o 331.4981 3.556186 531.8459  231.4 -20.11469      7.112372 0.99 
1 1 1 7   11 8  o 186.7974 2.847952 252.6855  160.3 14.41376       5.695904 0.97 
1 1 1 7   11 9  o 254.1997 3.030381 393.6318  64.7  -11.75327      6.060762 0.99 
1 1 1 7   11 10 o 338.4535 3.219171 578.4413  33.3  38.18668       6.438343 0.99 
1 1 1 7   11 11 o 122.8328 2.244114 116.9091  186.4 -22.46391      4.488228 0.92 
1 1 1 7   11 12 o 90.12643 6.248724 157.3864  242.0 -26.25909      12.49745 0.93 
1 1 1 7   11 13 o 81.90512 7.254814 105.1424  114.1 12.58447       14.50963 0.88 
1 1 1 7   11 14 o 44.46696 8.541821 30.06681  334.7 5.878460       17.08364 0.35 
1 1 1 7   11 15 o 61.40446 7.999002 83.33640  341.1 6.485550       15.99800 0.82 
1 1 1 7   11 16 o 163.8837 4.669048 289.7453  196.6 -12.78101      9.338097 0.99 
1 1 1 7   11 17 o 75.32043 9.300293 167.0570  59.8  32.99678       18.60059 0.95 
1 1 1 7   11 18 o 86.98502 10.02405 136.4379  279.4 34.97238       20.04811 0.94 
1 1 1 7   11 19 o 41.81227 11.26014 55.69805  130.5 -10.64442      22.52028 0.55 
1 1 1 7   11 20 o 170.8293 4.956470 302.6260  118.8 -1.959915      9.912941 0.99 
1 1 1 7   11 21 o 57.28506 11.83616 107.7656  85.1  -24.25871      23.67232 0.87 
1 1 1 7   11 22 o 79.50458 10.20981 80.79037  33.4  -4.791725      20.41962 0.91 
1 1 1 7   11 23 o 89.94435 8.311471 142.8991  230.3 -19.27905      16.62294 0.97 
1 1 1 7   11 24 o 96.62077 10.55847 137.1756  265.2 35.79846       21.11694 0.97 
1 1 1 7   11 25 o 80.74233 11.22667 121.2402  298.3 20.31221       22.45334 0.95 
1 1 1 7   11 26 o 57.86005 12.33447 82.01419  297.7 -27.95890      24.66895 0.91 
1 1 1 7   11 27 o 57.00410 12.72211 102.7698  232.9 ?              ?        0.93 
1 1 1 7   13 0  o 213.3010 3.209667 366.0657  112.9 23.04951       6.419335 0.99 
1 1 1 7   13 1  f 104.7639 4.157761 262.0864  160.3 -19.99496      8.315521 0.00 
1 1 1 7   13 2  o 56.63763 7.950175 139.9854  113.4 -8.180271      15.90035 0.87 
1 1 1 7   13 3  o 86.85623 4.539608 150.0964  188.6 27.10955       9.079216 0.93 
1 1 1 7   13 4  o 174.9344 3.307189 244.7290  101.9 5.653107       6.614377 0.98 
1 1 1 7   13 5  o 75.80692 5.225058 171.9139  36.7  5.379700       10.45012 0.93 
1 1 1 7   13 6  o 136.2820 3.850235 248.7002  232.3 -13.85262      7.700471 0.98 
1 1 1 7   13 7  o 102.9364 4.384260 145.0528  260.0 23.27541       8.768519 0.95 
1 1 1 7   13 8  f 102.1805 4.363385 188.0483  212.8 20.69687       8.726770 0.00 
1 1 1 7   13 9  o 190.2886 3.631974 358.0563  41.0  -23.36136      7.263947 0.99 
1 1 1 7   13 10 o 94.38042 4.004403 213.0141  97.7  6.031372       8.008805 0.97 
1 1 1 7   13 11 o 76.26797 3.799507 82.13683  84.8  -12.64314      7.599014 0.91 
1 1 1 7   13 12 o 112.7472 5.295307 160.1734  340.6 -12.85493      10.59061 0.97 
1 1 1 7   13 13 o 89.73318 11.68730 62.01455  175.4 45.82346       23.37460 0.85 
1 1 1 7   13 14 o 171.7116 6.539887 254.1317  116.0 0.1485291      13.07977 0.98 
1 1 1 7   13 15 o 87.41733 12.11332 149.3987  61.5  -64.39024      24.22663 0.94 
1 1 1 7   13 16 o 75.18510 11.23267 103.7732  2.2   -68.02602      22.46534 0.90 
1 1 1 7   13 17 o 45.83247 13.58733 85.79095  23.9  1.571892       27.17466 0.79 
1 1 1 7   13 18 o 77.68286 14.55575 141.8299  4.6   -6.470711      29.11151 0.94 
1 1 1 7   13 19 o 83.22157 12.47777 149.4722  30.5  -65.36351      24.95555 0.96 
1 1 1 7   13 20 o 72.78255 13.92999 103.5803  221.5 39.35970       27.85998 0.94 
1 1 1 7   13 21 f 49.59303 9.890997 96.72434  122.4 13.65884       19.78199 0.00 
1 1 1 7   13 22 o 109.2717 6.355342 221.6055  137.0 -1.211830      12.71068 0.99 
1 1 1 7   13 23 o 112.5736 10.40448 208.2938  90.3  34.03568       20.80897 0.98 
1 1 1 7   13 24 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 7   15 0  o 184.8091 5.066616 309.8940  135.8 -10.24153      10.13323 0.99 
1 1 1 7   15 1  o 109.7718 4.723298 178.1597  203.1 -5.472252      9.446596 0.97 
1 1 1 7   15 2  o 92.52394 5.142618 137.4502  22.8  8.163734       10.28524 0.95 
1 1 1 7   15 3  o 57.13201 8.010928 52.88982  319.6 -0.1518250E-02 16.02186 0.74 
1 1 1 7   15 4  o 42.34679 9.181329 107.1741  187.8 -12.72482      18.36266 0.82 
1 1 1 7   15 5  o 86.41376 5.883579 124.4206  242.1 -4.669945      11.76716 0.93 
1 1 1 7   15 6  o 50.10091 9.326142 86.77310  335.9 -5.635906      18.65228 0.81 
1 1 1 7   15 7  f 74.38377 6.864329 255.5446  295.4 12.65778       13.72866 0.00 
1 1 1 7   15 8  o 209.0400 3.702199 427.2336  246.5 3.861374       7.404397 0.99 
1 1 1 7   15 9  o 63.40022 8.362814 118.3932  239.4 35.93599       16.72563 0.91 
1 1 1 7   15 10 o 120.9419 4.270626 258.5818  83.3  -20.23839      8.541251 0.98 
1 1 1 7   15 11 o 84.92445 4.230194 156.7445  18.2  17.53347       8.460387 0.96 
1 1 1 7   15 12 o 77.67313 13.78796 104.2192  68.9  -25.79675      27.57593 0.93 
1 1 1 7   15 13 o 104.0635 12.43560 217.4254  85.2  3.418503       24.87119 0.98 
1 1 1 7   15 14 f 42.55023 13.42823 59.91186  169.0 2.488209       26.85647 0.00 
1 1 1 7   15 15 o 73.07317 15.41425 123.4668  152.2 -19.93600      30.82850 0.94 
1 1 1 7   15 16 o 36.63800 12.30871 55.68854  140.8 0.6752586      24.61741 0.76 
1 1 1 7   15 17 o 41.30914 13.31478 62.17703  24.2  -5.073410      26.62957 0.80 
1 1 1 7   15 18 o 122.2755 12.45435 270.6271  357.0 -3.748642      24.90870 0.99 
1 1 1 7   15 19 o 41.91536 12.16515 41.38626  13.0  ?              ?        0.74 
1 1 1 7   17 0  o 72.36095 8.777292 166.9738  304.2 -15.07500      17.55458 0.97 
1 1 1 7   17 1  o 93.00586 9.214081 193.7877  253.6 -7.020897      18.42816 0.98 
1 1 1 7   17 2  o 86.12939 6.604564 209.2711  322.0 3.941429       13.20913 0.98 
1 1 1 7   17 3  o 67.01817 8.481144 199.4320  333.6 3.725204       16.96229 0.97 
1 1 1 7   17 4  o 105.8543 6.684279 195.4060  137.1 -19.63163      13.36856 0.99 
1 1 1 7   17 5  o 106.3096 5.751687 224.4341  118.8 -14.76276      11.50337 0.99 
1 1 1 7   17 6  o 66.71954 9.234057 76.58450  96.3  -15.44250      18.46811 0.93 
1 1 1 7   17 7  o 102.6637 6.063021 229.5324  10.2  5.827911       12.12604 0.99 
1 1 1 7   17 8  o 37.70823 10.67840 101.4908  16.3  6.585693       21.35680 0.90 
1 1 1 7   17 9  o 28.16673 8.896284 100.6348  120.1 -10.37385      17.79257 0.87 
1 1 1 7   17 10 o 47.43798 9.763742 49.51493  206.0 12.29865       19.52748 0.84 
1 1 1 7   17 11 o 43.27809 12.60894 121.7561  316.9 -11.34195      25.21788 0.92 
1 1 1 7   17 12 o 48.48027 14.92852 41.22273  26.3  ?              ?        0.72 
1 1 1 7   17 13 o 31.54821 11.15677 70.14063  164.4 ?              ?        0.83 
1 1 1 8   0  0  o 705.4179 9.498240 1772.144  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  1  o 1049.600 10.83251 1956.528  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  2  o 353.6676 4.100543 463.6854  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  3  o 281.7263 3.379206 570.6823  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  4  o 1111.427 11.29445 1306.666  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  5  f 1319.089 15.95210 1872.028  0.0   0.000000       0.000000 0.00 
1 1 1 8   0  6  o 471.2770 6.740763 594.6793  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  7  o 769.7645 9.801984 669.3110  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  8  o 63.94858 3.499213 381.5305  0.0   0.000000       0.000000 0.36 
1 1 1 8   0  9  o 89.16775 3.402259 230.6414  180.0 0.000000       0.000000 0.26 
1 1 1 8   0  10 o 192.9592 3.829237 47.88592  180.0 0.000000       0.000000 0.77 
1 1 1 8   0  11 o 384.9725 5.848349 383.3312  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  12 o 189.2993 4.422052 266.3147  180.0 0.000000       0.000000 0.83 
1 1 1 8   0  13 o 391.1123 5.642489 479.0777  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  14 f 121.9008 3.875731 52.99551  0.0   0.000000       0.000000 0.00 
1 1 1 8   0  15 f 552.4449 7.247849 847.1241  180.0 0.000000       0.000000 0.00 
1 1 1 8   0  16 o 273.6180 4.846902 391.9709  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  17 o 474.0053 9.559752 525.5870  0.0   0.000000       0.000000 1.00 
1 1 1 8   0  18 o 77.50520 6.873322 156.5833  0.0   0.000000       0.000000 0.68 
1 1 1 8   0  19 o 44.60749 12.02128 133.2638  180.0 0.000000       0.000000 0.41 
1 1 1 8   0  20 o 23.21225 13.94381 132.2554  0.0   0.000000       0.000000 0.41 
1 1 1 8   0  21 o 114.0679 5.564442 253.2852  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  22 o 169.9823 5.296201 230.0068  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  23 o 79.70802 9.013829 62.95671  180.0 0.000000       0.000000 0.77 
1 1 1 8   0  24 o 29.32159 18.31174 105.2473  180.0 0.000000       0.000000 0.59 
1 1 1 8   0  25 o 37.66879 18.71455 0.6957304 0.0   0.000000       0.000000 0.01 
1 1 1 8   0  26 o 212.6980 6.368798 248.6069  180.0 0.000000       0.000000 1.00 
1 1 1 8   0  27 o 67.78761 24.42051 78.56464  180.0 0.000000       0.000000 0.85 
1 1 1 8   0  28 o 26.45197 16.88234 73.41262  180.0 0.000000       0.000000 0.47 
1 1 1 8   0  29 o 63.78285 18.79488 74.42551  0.0   0.000000       0.000000 0.89 
1 1 1 8   0  30 o 24.91267 16.64285 31.88095  0.0   0.000000       0.000000 0.31 
1 1 1 8   0  31 o 24.13760 16.38441 33.39067  0.0   0.000000       0.000000 0.40 
1 1 1 8   0  32 o 65.45636 23.30872 43.07581  180.0 0.000000       0.000000 0.84 
1 1 1 8   0  33 o 27.52925 18.31013 83.33282  180.0 ?              ?        0.85 
1 1 1 8   2  0  o 504.1436 4.097148 1452.077  241.5 23.71338       8.194297 0.99 
1 1 1 8   2  1  o 351.3888 3.450355 1062.626  267.8 -18.69357      6.900709 0.97 
1 1 1 8   2  2  o 653.3362 6.189518 1538.695  121.4 -19.77197      12.37904 0.99 
1 1 1 8   2  3  o 592.1671 5.088963 1763.061  22.7  37.21051       10.17793 0.99 
1 1 1 8   2  4  o 320.0969 2.962082 760.8352  146.5 -45.52628      5.924164 0.97 
1 1 1 8   2  5  o 647.9156 4.838288 887.2234  129.0 -22.28418      9.676577 0.99 
1 1 1 8   2  6  o 161.3751 2.218600 302.4448  304.0 41.38400       4.437201 0.82 
1 1 1 8   2  7  o 371.8891 3.474992 400.2206  258.7 -21.24588      6.949984 0.97 
1 1 1 8   2  8  o 265.5914 3.111907 915.5657  246.7 20.40413       6.223813 0.95 
1 1 1 8   2  9  o 668.8240 5.503728 1145.828  44.3  -12.89227      11.00746 0.99 
1 1 1 8   2  10 o 186.3455 2.576175 73.19656  133.8 -36.59473      5.152350 0.67 
1 1 1 8   2  11 o 563.2295 5.183496 705.6282  172.3 -40.84790      10.36699 0.98 
1 1 1 8   2  12 o 657.9032 7.306262 716.3947  102.3 55.15320       14.61252 0.99 
1 1 1 8   2  13 o 249.7231 3.041326 504.9883  9.1   -31.60533      6.082652 0.94 
1 1 1 8   2  14 o 314.8724 3.445452 458.7130  17.8  5.163116       6.890904 0.95 
1 1 1 8   2  15 o 382.3042 3.915288 505.5101  349.4 -5.132324      7.830577 0.96 
1 1 1 8   2  16 o 457.2664 4.415049 676.0518  92.9  52.79309       8.830097 0.98 
1 1 1 8   2  17 o 304.2643 3.503853 491.7896  49.2  8.245239       7.007707 0.96 
1 1 1 8   2  18 f 309.9263 3.509867 337.2037  339.2 -13.42120      7.019735 0.00 
1 1 1 8   2  19 f 167.5081 3.935673 262.6441  338.0 -62.46924      7.871345 0.00 
1 1 1 8   2  20 o 74.61320 5.068221 126.8263  95.4  2.526443       10.13644 0.79 
1 1 1 8   2  21 o 46.45848 8.353338 42.32253  340.2 27.16232       16.70668 0.29 
1 1 1 8   2  22 o 66.97066 8.422365 122.4990  215.8 -23.78629      16.84473 0.79 
1 1 1 8   2  23 o 116.6405 5.003938 199.3606  274.3 -43.38493      10.00788 0.95 
1 1 1 8   2  24 o 106.2840 4.938065 180.2403  345.2 -7.565025      9.876129 0.95 
1 1 1 8   2  25 o 150.5860 4.067033 176.2474  355.7 0.8878174      8.134066 0.97 
1 1 1 8   2  26 o 60.10194 9.553380 99.69210  209.2 -39.64734      19.10676 0.87 
1 1 1 8   2  27 o 177.0691 4.719840 259.7401  171.6 -19.96503      9.439679 0.98 
1 1 1 8   2  28 o 45.36118 11.13934 72.11911  158.7 25.22962       22.27868 0.66 
1 1 1 8   2  29 f 173.1208 7.128171 209.6667  44.8  9.686234       14.25634 0.00 
1 1 1 8   2  30 o 110.9421 8.493591 180.6788  73.7  19.16385       16.98718 0.97 
1 1 1 8   2  31 o 52.48471 13.34189 81.43514  333.2 -3.964718      26.68378 0.87 
1 1 1 8   2  32 o 41.50549 13.11749 26.56286  277.5 18.68483       26.23498 0.48 
1 1 1 8   2  33 o 48.05687 13.35720 56.71841  8.8   ?              ?        0.81 
1 1 1 8   4  0  o 917.5288 7.913917 780.0963  37.5  -56.87067      15.82783 0.99 
1 1 1 8   4  1  o 411.0780 4.207447 496.3122  183.8 10.63443       8.414894 0.97 
1 1 1 8   4  2  o 106.8207 2.220637 741.8917  67.6  -30.21017      4.441273 0.90 
1 1 1 8   4  3  o 171.5416 2.520871 429.3329  196.6 44.20123       5.041742 0.81 
1 1 1 8   4  4  o 501.1447 4.900579 885.3137  3.9   10.49789       9.801159 0.99 
1 1 1 8   4  5  o 218.1360 2.639875 261.3922  27.9  76.01276       5.279750 0.92 
1 1 1 8   4  6  o 312.8773 3.130601 473.1847  187.2 49.71616       6.261203 0.94 
1 1 1 8   4  7  o 92.09398 1.915181 279.8767  325.7 10.71886       3.830363 0.67 
1 1 1 8   4  8  o 423.4988 3.940535 706.9319  219.0 5.157104       7.881069 0.98 
1 1 1 8   4  9  o 455.0237 4.128983 624.1137  173.4 -31.29474      8.257967 0.97 
1 1 1 8   4  10 o 276.5932 2.886916 136.8162  98.5  -31.87134      5.773832 0.90 
1 1 1 8   4  11 o 45.20491 4.848151 307.6432  261.3 -31.21152      9.696301 0.20 
1 1 1 8   4  12 o 234.6148 2.670892 289.9022  264.6 51.15918       5.341784 0.88 
1 1 1 8   4  13 o 205.1999 2.484461 319.5174  141.6 -22.04443      4.968922 0.90 
1 1 1 8   4  14 o 281.1301 2.771380 522.9866  85.7  15.38251       5.542761 0.95 
1 1 1 8   4  15 f 338.4389 3.440278 749.4180  254.1 -0.2425842     6.880557 0.00 
1 1 1 8   4  16 o 311.1001 3.425706 346.4675  110.4 14.98120       6.851412 0.96 
1 1 1 8   4  17 f 399.5057 5.006079 465.3147  108.8 14.96399       10.01216 0.00 
1 1 1 8   4  18 o 91.27756 4.286651 144.4263  114.4 24.78262       8.573301 0.79 
1 1 1 8   4  19 o 236.4605 3.230226 299.7913  90.0  15.31406       6.460452 0.98 
1 1 1 8   4  20 o 350.4711 3.917016 483.6738  130.2 12.20755       7.834031 0.99 
1 1 1 8   4  21 o 134.0272 3.886481 191.1183  200.1 -22.46402      7.772962 0.94 
1 1 1 8   4  22 o 34.78528 9.753458 34.86731  92.9  -12.32172      19.50692 0.25 
1 1 1 8   4  23 o 176.8390 4.222615 292.4540  71.8  -6.198563      8.445230 0.98 
1 1 1 8   4  24 o 108.5277 5.113549 210.1740  114.8 -12.64995      10.22710 0.96 
1 1 1 8   4  25 o 32.17318 9.855801 62.55393  46.5  8.261364       19.71160 0.60 
1 1 1 8   4  26 o 167.5659 5.023266 132.9243  110.8 -18.02278      10.04653 0.96 
1 1 1 8   4  27 o 44.75898 11.67663 19.11849  180.8 -7.470482      23.35327 0.22 
1 1 1 8   4  28 o 40.46247 11.44043 15.35499  166.5 6.748100       22.88086 0.19 
1 1 1 8   4  29 f 114.1907 7.513921 174.1043  201.7 31.87773       15.02784 0.00 
1 1 1 8   4  30 f 85.08582 10.08067 67.45902  200.6 -9.117737      20.16134 0.00 
1 1 1 8   4  31 o 78.15822 11.39520 84.70179  186.6 10.77114       22.79041 0.93 
1 1 1 8   4  32 o 108.0999 9.249478 132.1339  226.2 27.84262       18.49896 0.97 
1 1 1 8   6  0  o 283.8470 3.140870 698.1016  4.0   -57.24002      6.281740 0.94 
1 1 1 8   6  1  o 212.6570 2.534271 325.1239  168.2 64.12212       5.068542 0.92 
1 1 1 8   6  2  o 413.5868 4.113209 668.1339  136.8 -11.02826      8.226418 0.97 
1 1 1 8   6  3  o 408.3066 4.087441 779.1791  352.3 63.29269       8.174882 0.97 
1 1 1 8   6  4  o 479.3535 4.671257 1136.750  225.2 3.808472       9.342514 0.98 
1 1 1 8   6  5  f 288.2837 3.228563 196.9102  145.0 17.88800       6.457125 0.00 
1 1 1 8   6  6  o 477.4950 4.595206 603.4695  149.8 -35.92252      9.190413 0.98 
1 1 1 8   6  7  o 180.0482 2.303161 294.8100  287.7 22.08240       4.606321 0.82 
1 1 1 8   6  8  o 63.47256 5.551827 378.9740  309.4 55.81631       11.10365 0.53 
1 1 1 8   6  9  o 192.3275 3.838442 495.8060  260.1 ?              ?        0.92 
1 1 1 8   6  10 f 484.1924 5.365897 822.2964  215.2 -38.16943      10.73179 0.00 
1 1 1 8   6  11 o 583.3201 6.133565 791.6855  170.7 27.34851       12.26713 0.99 
1 1 1 8   6  12 o 244.0390 2.895557 349.8037  155.9 -5.643219      5.791115 0.91 
1 1 1 8   6  13 o 151.4896 2.791999 222.7876  177.5 9.298767       5.583998 0.83 
1 1 1 8   6  14 o 441.2507 3.883265 678.8942  347.1 10.39529       7.766530 0.99 
1 1 1 8   6  15 o 217.3468 2.911057 371.8510  226.9 -14.27649      5.822114 0.96 
1 1 1 8   6  16 o 150.7251 2.998039 247.9866  281.1 16.80096       5.996077 0.93 
1 1 1 8   6  17 o 241.8262 2.817250 332.8439  341.7 15.86461       5.634500 0.98 
1 1 1 8   6  18 o 231.3831 3.111325 279.8921  272.6 32.64339       6.222649 0.97 
1 1 1 8   6  19 o 203.3730 3.172578 268.5471  299.7 28.09105       6.345157 0.97 
1 1 1 8   6  20 o 48.61649 7.406885 51.20686  304.5 31.51883       14.81377 0.46 
1 1 1 8   6  21 o 165.2671 3.803342 246.5929  346.9 41.28668       7.606684 0.97 
1 1 1 8   6  22 o 39.38469 9.312313 63.81717  120.3 -17.61178      18.62463 0.54 
1 1 1 8   6  23 o 114.5257 4.760242 165.8691  164.3 -24.63768      9.520483 0.96 
1 1 1 8   6  24 o 115.6478 5.168644 234.4657  203.4 -3.977455      10.33729 0.97 
1 1 1 8   6  25 o 124.5434 4.836661 190.0484  185.7 -33.41987      9.673322 0.96 
1 1 1 8   6  26 o 117.4716 6.429107 191.0061  53.6  21.28243       12.85821 0.96 
1 1 1 8   6  27 o 57.70018 11.01964 76.57838  16.1  33.57274       22.03928 0.81 
1 1 1 8   6  28 o 39.71455 11.60489 47.56787  20.0  -0.4361343E-01 23.20978 0.63 
1 1 1 8   6  29 o 38.04295 11.86120 59.85529  112.5 -4.334496      23.72240 0.76 
1 1 1 8   6  30 o 45.26256 12.83722 39.68311  223.3 -4.110722      25.67444 0.67 
1 1 1 8   6  31 o 34.54908 11.12811 45.85260  299.0 9.355043       22.25621 0.68 
1 1 1 8   8  0  o 456.9039 4.274407 688.1393  349.1 -14.47577      8.548814 0.98 
1 1 1 8   8  1  o 204.9277 2.691518 402.1008  327.0 63.12294       5.383035 0.90 
1 1 1 8   8  2  o 606.7957 6.879900 810.9936  47.9  24.38690       13.75980 0.99 
1 1 1 8   8  3  o 409.6141 4.061128 756.8860  200.0 -9.210815      8.122256 0.98 
1 1 1 8   8  4  o 120.6714 2.695496 241.4669  20.0  17.25039       5.390992 0.73 
1 1 1 8   8  5  o 226.4301 3.381011 516.5154  225.7 -13.07622      6.762022 0.95 
1 1 1 8   8  6  o 400.1216 5.252302 558.3450  260.7 -50.81711      10.50460 0.97 
1 1 1 8   8  7  o 273.0669 3.173933 499.5789  193.1 -55.90407      6.347867 0.95 
1 1 1 8   8  8  f 91.04412 2.979903 208.9413  226.6 25.01295       5.959806 0.00 
1 1 1 8   8  9  o 59.25484 4.598711 77.47427  71.2  -41.24319      9.197422 0.29 
1 1 1 8   8  10 o 315.8420 3.072554 557.5285  320.5 -6.658966      6.145109 0.97 
1 1 1 8   8  11 o 38.51826 8.785385 195.1442  83.2  -18.12472      17.57077 0.50 
1 1 1 8   8  12 o 82.72337 5.083807 188.5913  192.7 -7.310425      10.16761 0.79 
1 1 1 8   8  13 o 163.8942 3.309157 227.6502  158.7 -20.54504      6.618314 0.93 
1 1 1 8   8  14 o 166.6587 3.427316 277.0217  227.2 -32.26660      6.854632 0.97 
1 1 1 8   8  15 o 92.00378 4.867476 144.5465  349.5 -10.12196      9.734952 0.87 
1 1 1 8   8  16 f 85.05008 7.841870 296.9042  109.4 64.91411       15.68374 0.00 
1 1 1 8   8  17 o 33.75114 8.741293 95.94839  295.1 -2.966637      17.48259 0.50 
1 1 1 8   8  18 o 156.6911 3.416698 290.4356  292.1 -4.210876      6.833396 0.98 
1 1 1 8   8  19 o 76.77277 5.883172 116.8094  359.5 -13.67213      11.76634 0.88 
1 1 1 8   8  20 o 59.33590 7.859353 40.67523  343.5 -55.69944      15.71871 0.55 
1 1 1 8   8  21 o 64.48847 8.690220 153.7545  66.4  23.35477       17.38044 0.92 
1 1 1 8   8  22 o 227.7223 3.472701 322.9033  52.8  -6.945587      6.945402 0.99 
1 1 1 8   8  23 o 91.73056 6.246052 140.8167  351.9 -8.209663      12.49210 0.93 
1 1 1 8   8  24 o 86.32497 7.381578 154.9719  331.7 -22.12820      14.76316 0.94 
1 1 1 8   8  25 o 40.41577 10.14038 23.77640  40.6  -22.81104      20.28075 0.32 
1 1 1 8   8  26 o 60.25364 12.04482 87.14382  312.9 -17.09288      24.08963 0.88 
1 1 1 8   8  27 o 90.85050 7.517900 95.92898  246.3 -3.684540      15.03580 0.95 
1 1 1 8   8  28 o 43.58363 11.82945 79.72697  93.1  9.519184       23.65890 0.85 
1 1 1 8   8  29 o 111.8455 7.287947 149.2556  24.5  15.47339       14.57589 0.98 
1 1 1 8   8  30 o 55.43613 12.46719 86.85949  47.0  ?              ?        0.91 
1 1 1 8   10 0  o 198.3013 3.732493 270.9122  77.9  4.716156       7.464987 0.92 
1 1 1 8   10 1  o 156.0001 2.661119 350.5892  17.2  -2.508698      5.322237 0.92 
1 1 1 8   10 2  o 508.3873 4.719704 796.8317  31.7  -5.381744      9.439408 0.99 
1 1 1 8   10 3  o 248.1062 3.461663 416.1989  20.8  -16.68752      6.923326 0.96 
1 1 1 8   10 4  o 216.0825 2.801630 472.0396  351.7 -43.29369      5.603261 0.97 
1 1 1 8   10 5  o 245.2728 2.976167 306.5206  254.2 -4.177124      5.952335 0.96 
1 1 1 8   10 6  f 251.0244 3.003140 367.2620  308.0 -52.05553      6.006279 0.00 
1 1 1 8   10 7  o 133.1266 2.893132 131.5135  18.9  16.54797       5.786264 0.84 
1 1 1 8   10 8  o 302.6196 3.240799 539.9271  61.4  23.28091       6.481597 0.99 
1 1 1 8   10 9  o 148.3192 2.506161 381.9532  67.5  -34.70290      5.012321 0.97 
1 1 1 8   10 10 o 222.8435 2.936213 287.0725  280.1 -69.52959      5.872425 0.98 
1 1 1 8   10 11 o 268.6700 2.738748 470.9142  187.7 -32.42633      5.477496 0.99 
1 1 1 8   10 12 o 191.0104 3.642102 362.7724  139.8 -18.14209      7.284203 0.98 
1 1 1 8   10 13 o 209.0548 3.553688 335.1983  57.2  -33.40919      7.107376 0.98 
1 1 1 8   10 14 o 147.6630 4.106238 178.0814  30.2  -19.01085      8.212477 0.96 
1 1 1 8   10 15 o 60.46029 8.516337 113.3832  216.7 -0.3518448     17.03267 0.84 
1 1 1 8   10 16 o 57.01970 9.059243 168.3228  180.7 10.43992       18.11849 0.90 
1 1 1 8   10 17 o 100.1319 7.456381 179.1382  1.4   46.50293       14.91276 0.95 
1 1 1 8   10 18 o 169.2151 5.095143 275.4420  280.1 26.69991       10.19029 0.99 
1 1 1 8   10 19 o 146.3090 5.507547 218.8806  226.2 29.00969       11.01509 0.98 
1 1 1 8   10 20 o 174.3741 4.937076 254.5330  154.8 20.44691       9.874152 0.98 
1 1 1 8   10 21 o 195.9200 4.569990 325.9261  171.3 7.786407       9.139980 0.99 
1 1 1 8   10 22 o 50.76465 11.02281 214.1133  276.4 -45.04227      22.04561 0.93 
1 1 1 8   10 23 o 55.54262 11.37839 61.52688  135.3 -18.44901      22.75679 0.78 
1 1 1 8   10 24 o 33.58053 10.65941 36.73077  326.0 -15.57014      21.31882 0.51 
1 1 1 8   10 25 o 78.64634 10.19806 99.38036  355.0 -31.08915      20.39613 0.95 
1 1 1 8   10 26 o 164.0732 5.968561 210.0400  340.2 11.68633       11.93712 0.99 
1 1 1 8   10 27 o 91.83142 10.47801 139.3033  307.4 -26.79600      20.95603 0.97 
1 1 1 8   10 28 o 52.92481 13.34401 78.74449  263.6 ?              ?        0.90 
1 1 1 8   12 0  o 125.6596 3.280781 201.2091  82.7  19.55878       6.561562 0.94 
1 1 1 8   12 1  o 144.8683 3.125865 187.8549  23.3  3.898605       6.251730 0.95 
1 1 1 8   12 2  o 41.29870 7.757338 152.0518  308.7 0.8087234      15.51468 0.72 
1 1 1 8   12 3  o 55.11193 7.960653 133.1801  66.3  -17.07475      15.92131 0.76 
1 1 1 8   12 4  o 164.6030 2.882879 280.1113  182.3 20.05029       5.765759 0.97 
1 1 1 8   12 5  o 135.1488 3.330826 117.9801  165.9 17.20338       6.661652 0.92 
1 1 1 8   12 6  o 55.33765 6.982325 106.7632  258.1 -16.09021      13.96465 0.75 
1 1 1 8   12 7  o 169.9252 3.111907 269.7536  66.9  11.24248       6.223814 0.98 
1 1 1 8   12 8  o 164.7906 3.122139 243.6786  177.8 10.07230       6.244278 0.98 
1 1 1 8   12 9  f 176.6237 2.878852 286.1751  297.9 14.67218       5.757704 0.00 
1 1 1 8   12 10 o 238.2401 2.756798 436.7773  340.1 -22.02641      5.513595 0.99 
1 1 1 8   12 11 o 301.7223 2.906700 535.4672  39.2  6.030060       5.813401 1.00 
1 1 1 8   12 12 o 195.1617 4.346721 348.7275  87.6  15.59224       8.693441 0.99 
1 1 1 8   12 13 o 81.56613 7.726364 133.2074  153.2 -2.647720      15.45273 0.94 
1 1 1 8   12 14 o 28.41153 8.749326 22.63795  247.6 -9.951479      17.49865 0.27 
1 1 1 8   12 15 o 40.77547 8.535110 102.8541  171.4 10.81746       17.07022 0.83 
1 1 1 8   12 16 o 114.0186 6.097826 172.5002  245.1 2.246071       12.19565 0.96 
1 1 1 8   12 17 o 162.7455 4.757943 196.5259  7.2   -1.263107      9.515885 0.98 
1 1 1 8   12 18 o 84.78226 9.829443 143.4313  40.2  42.64220       19.65889 0.94 
1 1 1 8   12 19 o 50.22853 11.10550 91.72999  51.3  -31.61924      22.21101 0.84 
1 1 1 8   12 20 o 99.63387 7.635460 173.2805  289.5 -27.76210      15.27092 0.97 
1 1 1 8   12 21 o 87.24008 9.398129 150.0423  35.8  -21.11195      18.79626 0.97 
1 1 1 8   12 22 o 133.3047 6.485882 187.6166  95.3  -8.393204      12.97176 0.99 
1 1 1 8   12 23 o 59.07051 12.96116 124.7635  29.4  0.1876488      25.92232 0.94 
1 1 1 8   12 24 o 37.95553 11.67587 34.36270  59.0  -3.115376      23.35174 0.62 
1 1 1 8   12 25 f 31.80885 10.40580 61.45371  130.1 ?              ?        0.00 
1 1 1 8   14 0  o 65.27473 6.441712 128.6328  264.9 7.535534       12.88342 0.91 
1 1 1 8   14 1  o 70.07890 8.737965 173.1372  258.8 -10.37032      17.47593 0.94 
1 1 1 8   14 2  o 113.2261 4.177392 197.3137  353.8 41.52397       8.354784 0.97 
1 1 1 8   14 3  o 53.42919 8.181985 117.8037  337.1 0.3627930      16.36397 0.89 
1 1 1 8   14 4  o 72.42976 6.566296 195.4184  126.3 -22.62178      13.13259 0.96 
1 1 1 8   14 5  o 46.19825 8.279709 73.28517  232.5 -29.88448      16.55942 0.80 
1 1 1 8   14 6  o 94.93834 5.475717 150.9211  204.4 -17.62901      10.95143 0.96 
1 1 1 8   14 7  o 181.0915 3.668788 272.0326  290.1 -9.538879      7.337577 0.99 
1 1 1 8   14 8  o 104.3543 4.942400 166.2452  198.9 -1.448967      9.884799 0.97 
1 1 1 8   14 9  f 59.61203 7.932743 105.0774  17.3  -12.65070      15.86549 0.00 
1 1 1 8   14 10 o 112.3876 4.088202 196.9157  270.9 -7.172638      8.176404 0.97 
1 1 1 8   14 11 o 25.23007 7.470934 62.25540  272.0 4.964069       14.94187 0.48 
1 1 1 8   14 12 o 142.8043 6.681232 217.5438  94.1  2.028259       13.36246 0.98 
1 1 1 8   14 13 o 94.59255 17.48934 202.3670  73.5  ?              ?        0.95 
1 1 1 8   14 14 o 94.80930 13.00630 122.2200  325.8 -35.14227      26.01259 0.94 
1 1 1 8   14 15 o 69.79916 13.06940 146.1988  157.4 48.89534       26.13879 0.94 
1 1 1 8   14 16 o 67.05533 15.47808 100.5922  226.9 1.566811       30.95617 0.91 
1 1 1 8   14 17 o 50.76343 20.10039 160.0037  219.0 ?              ?        0.91 
1 1 1 8   14 18 o 51.12878 14.22402 51.44282  10.2  -20.44841      28.44803 0.79 
1 1 1 8   14 19 f 32.33808 11.23043 32.63978  55.8  8.221472       22.46086 0.00 
1 1 1 8   14 20 o 39.30091 12.59741 39.38031  119.1 -9.384876      25.19481 0.67 
1 1 1 8   14 21 o 43.79810 14.34575 29.54389  354.9 ?              ?        0.59 
1 1 1 8   16 0  o 52.23177 10.82999 67.54255  90.9  3.532024       21.65998 0.80 
1 1 1 8   16 1  o 52.65529 9.152677 111.9316  193.9 -17.78553      18.30535 0.89 
1 1 1 8   16 2  o 70.35923 7.373688 142.8765  224.9 38.07656       14.74738 0.94 
1 1 1 8   16 3  o 35.29630 9.846633 37.92735  209.4 3.282166       19.69327 0.51 
1 1 1 8   16 4  o 43.46818 10.04274 116.3016  104.0 -5.354206      20.08548 0.88 
1 1 1 8   16 5  o 94.21896 6.323166 218.4363  69.3  -17.79774      12.64633 0.98 
1 1 1 8   16 6  o 53.42040 10.78175 150.9392  90.2  -13.64273      21.56350 0.93 
1 1 1 8   16 7  o 39.49459 10.30101 55.00374  176.7 -13.71835      20.60202 0.74 
1 1 1 8   16 8  f 106.9965 5.856459 203.5384  213.5 8.613731       11.71292 0.00 
1 1 1 8   16 9  o 105.1384 5.788430 169.7300  170.9 -1.861969      11.57686 0.98 
1 1 1 8   16 10 o 78.20073 6.483737 122.8902  158.4 -4.254868      12.96747 0.97 
1 1 1 8   16 11 o 23.87842 7.398393 63.82310  307.4 -10.39738      14.79679 0.75 
1 1 1 8   16 12 o 46.55219 14.18680 82.84297  285.4 -10.40879      28.37359 0.87 
1 1 1 8   16 13 o 67.61200 16.38956 105.8661  311.8 -10.62971      32.77913 0.92 
1 1 1 8   16 14 o 41.85210 13.62231 48.95549  331.7 -2.611328      27.24462 0.74 
1 1 1 8   16 15 o 60.40512 16.29195 135.6985  24.0  -17.41297      32.58391 0.94 
1 1 1 8   16 16 o 37.26027 12.70003 40.63578  52.4  ?              ?        0.69 
1 1 1 8   18 0  o 37.60233 9.948244 123.9113  204.7 -16.22480      19.89649 0.92 
1 1 1 8   18 1  o 59.46349 9.770541 201.6184  213.8 -32.86671      19.54108 0.97 
1 1 1 8   18 2  f 41.18722 12.03192 42.98614  1.2   23.49128       24.06383 0.00 
1 1 1 8   18 3  o 45.81520 10.05213 65.80731  336.0 44.76044       20.10426 0.88 
1 1 1 8   18 4  o 61.65403 10.51625 149.0195  219.9 -37.97577      21.03251 0.96 
1 1 1 8   18 5  o 76.23034 9.594111 121.6402  203.7 ?              ?        0.97 
1 1 1 8   18 6  o 32.42811 10.36449 85.18299  208.1 ?              ?        0.87 
1 1 1 8   18 7  o 49.60780 10.04254 120.8117  284.2 ?              ?        0.95 
1 1 1 8   18 8  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 9   1  0  o 561.5149 4.676521 1090.668  75.6  -23.08344      9.353043 0.99 
1 1 1 9   1  1  o 464.0035 4.004058 1439.880  355.8 62.85135       8.008116 0.98 
1 1 1 9   1  2  o 156.2118 1.752139 653.1042  276.3 -3.074936      3.504278 0.85 
1 1 1 9   1  3  o 690.9852 5.148779 1120.344  307.5 24.13501       10.29756 0.99 
1 1 1 9   1  4  o 475.9714 3.955216 239.5216  191.4 -32.43094      7.910432 0.98 
1 1 1 9   1  5  f 437.6176 4.158942 567.2306  126.9 -18.25107      8.317883 0.00 
1 1 1 9   1  6  o 370.1468 3.620588 114.6963  194.4 50.23737       7.241176 0.97 
1 1 1 9   1  7  o 498.5549 4.489954 587.7208  196.2 -42.69278      8.979909 0.98 
1 1 1 9   1  8  o 379.7010 3.960551 715.7998  310.5 -44.06168      7.921103 0.98 
1 1 1 9   1  9  o 405.2303 4.220089 537.0872  13.6  38.31281       8.440178 0.96 
1 1 1 9   1  10 o 470.1216 4.709694 621.3173  215.3 5.286682       9.419389 0.98 
1 1 1 9   1  11 o 256.8275 3.109708 363.9952  224.5 -7.544327      6.219416 0.90 
1 1 1 9   1  12 o 286.3381 3.239140 600.8086  51.0  16.92249       6.478280 0.94 
1 1 1 9   1  13 o 259.7155 3.258582 336.7482  144.5 87.23967       6.517164 0.93 
1 1 1 9   1  14 o 333.7586 3.752296 826.1867  99.6  -7.678467      7.504592 0.97 
1 1 1 9   1  15 f 279.9971 4.282948 304.0464  94.4  6.017487       8.565897 0.00 
1 1 1 9   1  16 o 376.9275 4.054373 406.1320  82.4  -19.77548      8.108746 0.96 
1 1 1 9   1  17 o 224.0859 3.172790 256.9961  278.5 4.806061       6.345580 0.89 
1 1 1 9   1  18 o 282.0076 3.568751 344.6890  287.2 3.946014       7.137503 0.96 
1 1 1 9   1  19 o 177.2098 3.259300 241.2118  248.1 -29.64189      6.518601 0.94 
1 1 1 9   1  20 o 129.3673 3.723474 99.14315  293.4 18.56339       7.446949 0.84 
1 1 1 9   1  21 o 75.39028 7.561226 166.5149  247.7 8.649811       15.12245 0.85 
1 1 1 9   1  22 o 218.0439 3.740024 266.7479  145.7 -32.32796      7.480047 0.97 
1 1 1 9   1  23 o 111.1941 4.582466 109.2529  13.9  -0.9793854     9.164931 0.90 
1 1 1 9   1  24 o 185.9774 3.956850 304.2510  59.1  -6.022324      7.913699 0.98 
1 1 1 9   1  25 o 56.95349 8.767811 58.69328  341.3 -40.44141      17.53562 0.69 
1 1 1 9   1  26 o 110.6891 7.352142 201.3038  179.1 -35.86807      14.70428 0.97 
1 1 1 9   1  27 o 76.45584 9.531712 131.0811  111.9 -38.15974      19.06342 0.90 
1 1 1 9   1  28 o 139.5627 5.408850 151.1344  254.0 -0.6306610     10.81770 0.96 
1 1 1 9   1  29 o 43.39243 11.80888 67.47279  73.2  7.081158       23.61777 0.69 
1 1 1 9   1  30 o 43.10955 11.23969 50.24090  132.2 -24.52502      22.47937 0.68 
1 1 1 9   1  31 o 57.86178 12.99907 18.12781  301.5 -8.234863      25.99814 0.46 
1 1 1 9   1  32 f 37.61638 11.75521 44.31118  335.5 -7.723404      23.51043 0.00 
1 1 1 9   1  33 o 41.02266 12.66938 38.69141  309.6 ?              ?        0.67 
1 1 1 9   3  0  o 1154.854 9.102118 1495.227  303.5 80.25439       18.20424 1.00 
1 1 1 9   3  1  o 267.0404 3.432811 468.1858  167.0 -61.92041      6.865622 0.96 
1 1 1 9   3  2  o 314.8368 3.740284 140.1202  17.8  -4.135620      7.480567 0.96 
1 1 1 9   3  3  o 371.4978 4.121533 957.7501  252.6 69.06396       8.243067 0.97 
1 1 1 9   3  4  o 248.4223 2.805922 827.6082  178.9 -42.51103      5.611844 0.95 
1 1 1 9   3  5  o 84.34029 2.847389 44.71229  149.4 ?              ?        0.52 
1 1 1 9   3  6  o 279.5362 2.662712 800.0530  301.1 28.51172       5.325425 0.95 
1 1 1 9   3  7  o 499.7354 3.946771 849.1453  273.6 75.74475       7.893542 0.98 
1 1 1 9   3  8  o 476.0961 4.238575 689.2563  152.6 9.138550       8.477151 0.98 
1 1 1 9   3  9  o 450.4474 3.978799 618.2287  107.4 -8.748260      7.957598 0.98 
1 1 1 9   3  10 o 233.9520 2.598956 306.2127  308.4 35.27982       5.197912 0.88 
1 1 1 9   3  11 o 347.5853 3.188287 523.9001  70.9  78.79712       6.376573 0.95 
1 1 1 9   3  12 o 204.1594 2.540427 18.80515  293.8 65.51602       5.080853 0.62 
1 1 1 9   3  13 o 363.9507 3.689450 441.9561  297.5 2.858368       7.378900 0.96 
1 1 1 9   3  14 o 360.9463 3.650855 678.6345  302.7 12.68542       7.301711 0.97 
1 1 1 9   3  15 o 948.2732 11.10545 1463.969  229.1 ?              ?        0.99 
1 1 1 9   3  16 o 253.2652 3.947515 309.2307  60.4  -17.74977      7.895030 0.93 
1 1 1 9   3  17 o 326.9028 4.292065 451.3718  9.1   59.25034       8.584130 0.97 
1 1 1 9   3  18 o 173.6335 3.944348 341.3096  143.3 ?              ?        0.95 
1 1 1 9   3  19 o 147.6706 3.343166 209.1698  130.5 24.37964       6.686332 0.94 
1 1 1 9   3  20 o 246.3687 4.568072 303.7510  150.6 5.885803       9.136145 0.98 
1 1 1 9   3  21 o 502.3005 5.051577 712.5685  214.6 -21.11060      10.10315 1.00 
1 1 1 9   3  22 o 213.0532 3.542418 385.5051  183.4 -1.001953      7.084836 0.99 
1 1 1 9   3  23 o 163.4363 3.893372 203.6699  93.6  1.677612       7.786745 0.97 
1 1 1 9   3  24 o 106.8604 5.713034 112.9973  347.0 -11.37316      11.42607 0.92 
1 1 1 9   3  25 o 55.47081 8.859603 125.4289  39.7  -47.36419      17.71921 0.89 
1 1 1 9   3  26 o 151.9626 5.046999 118.1627  334.3 -9.089584      10.09400 0.95 
1 1 1 9   3  27 o 120.3899 6.795815 207.5299  237.5 -42.04579      13.59163 0.96 
1 1 1 9   3  28 o 63.33274 11.54819 107.1765  106.5 -7.352367      23.09639 0.87 
1 1 1 9   3  29 o 119.7384 7.008982 205.0692  34.2  -20.35332      14.01796 0.98 
1 1 1 9   3  30 o 163.0902 6.302748 204.5742  288.4 -27.44162      12.60550 0.99 
1 1 1 9   3  31 o 140.3038 9.454055 207.4334  289.9 25.73657       18.90811 0.98 
1 1 1 9   3  32 f 73.49892 12.98681 122.2300  306.3 1.073463       25.97363 0.00 
1 1 1 9   3  33 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 9   5  0  o 350.9863 3.629028 587.1867  285.7 -65.74991      7.258057 0.97 
1 1 1 9   5  1  o 405.0201 4.091782 517.1790  242.3 -0.3017578     8.183564 0.97 
1 1 1 9   5  2  o 543.0099 5.287390 937.7808  342.5 -8.626160      10.57478 0.99 
1 1 1 9   5  3  o 118.3396 2.228089 320.5832  206.3 38.17261       4.456179 0.63 
1 1 1 9   5  4  o 354.7217 3.940010 401.5082  94.0  132.7256       7.880021 0.97 
1 1 1 9   5  5  o 251.5419 3.168102 345.5619  192.0 -42.25722      6.336204 0.91 
1 1 1 9   5  6  f 400.5825 3.748097 594.2727  97.1  9.794830       7.496195 0.00 
1 1 1 9   5  7  o 640.3808 5.276313 1121.851  326.3 -29.92908      10.55263 0.99 
1 1 1 9   5  8  o 142.6943 2.468093 297.4432  173.5 -3.489716      4.936186 0.70 
1 1 1 9   5  9  o 766.1538 6.073089 1028.247  199.2 10.58813       12.14618 0.99 
1 1 1 9   5  10 o 494.2747 4.396309 813.8911  211.6 -14.93152      8.792618 0.98 
1 1 1 9   5  11 o 402.4281 4.015215 752.8772  58.4  20.75098       8.030430 0.98 
1 1 1 9   5  12 o 234.1353 2.839953 361.5152  19.3  -21.80679      5.679906 0.92 
1 1 1 9   5  13 o 318.5208 3.252527 548.7966  273.7 7.047821       6.505054 0.96 
1 1 1 9   5  14 o 374.8354 4.450527 457.3641  269.8 -23.34009      8.901053 0.97 
1 1 1 9   5  15 o 143.9950 2.660801 167.6666  317.4 -17.08124      5.321602 0.82 
1 1 1 9   5  16 o 212.3803 2.669897 300.8986  86.1  11.47980       5.339795 0.95 
1 1 1 9   5  17 o 258.7236 2.975285 359.4458  46.7  14.34389       5.950569 0.98 
1 1 1 9   5  18 o 157.0488 2.964093 278.5153  40.1  -9.239319      5.928185 0.96 
1 1 1 9   5  19 o 130.7491 3.429185 223.6583  286.8 38.95927       6.858370 0.94 
1 1 1 9   5  20 o 233.6457 3.144457 275.4769  264.2 -11.03343      6.288914 0.98 
1 1 1 9   5  21 o 143.9263 3.712720 185.3069  290.4 1.302582       7.425440 0.96 
1 1 1 9   5  22 o 54.73946 9.807791 46.29971  42.4  -34.21400      19.61558 0.51 
1 1 1 9   5  23 o 108.3006 5.102116 87.74570  158.6 -17.40262      10.20423 0.90 
1 1 1 9   5  24 o 51.02862 10.50415 151.5311  192.3 2.089130       21.00830 0.90 
1 1 1 9   5  25 o 71.72558 9.894008 119.4768  231.4 -37.93924      19.78802 0.89 
1 1 1 9   5  26 o 59.34393 11.28947 28.20546  177.9 17.64235       22.57895 0.40 
1 1 1 9   5  27 o 148.6728 5.353582 200.8707  293.1 -2.759781      10.70716 0.97 
1 1 1 9   5  28 o 87.62637 9.186739 94.21967  280.5 1.634743       18.37348 0.92 
1 1 1 9   5  29 o 72.71391 12.23097 123.5719  211.9 3.354744       24.46195 0.94 
1 1 1 9   5  30 f 94.16833 9.607673 140.4413  180.2 -13.63614      19.21535 0.00 
1 1 1 9   5  31 o 68.85368 13.09175 60.12853  253.8 3.236763       26.18350 0.88 
1 1 1 9   5  32 o 57.36333 12.79014 62.96268  250.0 ?              ?        0.88 
1 1 1 9   7  0  o 345.0027 3.439533 510.3882  52.8  40.52432       6.879066 0.96 
1 1 1 9   7  1  o 368.4271 3.736259 571.7392  284.4 27.20627       7.472517 0.96 
1 1 1 9   7  2  o 389.6360 3.889748 797.5088  300.0 19.55316       7.779496 0.98 
1 1 1 9   7  3  o 382.2352 3.817656 684.2776  214.0 -50.14954      7.635311 0.97 
1 1 1 9   7  4  o 761.6233 6.575793 828.3436  296.7 34.41595       13.15159 0.99 
1 1 1 9   7  5  o 171.0661 2.605152 370.6527  133.2 21.52493       5.210304 0.85 
1 1 1 9   7  6  o 522.8027 5.937869 657.6765  205.7 -73.78476      11.87574 0.98 
1 1 1 9   7  7  o 204.3585 2.593495 377.2845  179.2 53.48860       5.186989 0.90 
1 1 1 9   7  8  o 352.4976 3.227309 550.3982  200.6 56.56116       6.454618 0.97 
1 1 1 9   7  9  f 389.6187 4.563366 570.6339  267.3 -5.634033      9.126732 0.00 
1 1 1 9   7  10 o 331.6648 3.092515 528.0415  228.6 6.890137       6.185031 0.97 
1 1 1 9   7  11 o 364.5549 4.753252 636.6942  136.3 -28.99966      9.506504 0.98 
1 1 1 9   7  12 o 171.3684 4.087025 98.49123  40.6  -46.76863      8.174050 0.71 
1 1 1 9   7  13 o 305.4017 4.025002 369.2018  135.1 -22.94974      8.050005 0.97 
1 1 1 9   7  14 o 356.0401 3.629496 464.6336  104.3 -49.41312      7.258991 0.98 
1 1 1 9   7  15 o 390.0566 3.619237 562.0815  276.8 5.788239       7.238474 0.99 
1 1 1 9   7  16 o 104.7489 3.969891 159.5318  272.5 -23.98512      7.939782 0.91 
1 1 1 9   7  17 o 177.0591 3.097178 253.8906  82.3  -29.93248      6.194356 0.96 
1 1 1 9   7  18 o 152.7132 3.417886 222.7596  295.6 14.19473       6.835771 0.96 
1 1 1 9   7  19 o 66.99122 7.303249 151.0502  341.9 14.12001       14.60650 0.88 
1 1 1 9   7  20 o 43.28236 9.592023 74.52293  228.3 -14.14046      19.18405 0.61 
1 1 1 9   7  21 o 123.9728 4.403975 229.9529  346.7 -0.2462311     8.807951 0.97 
1 1 1 9   7  22 o 223.3168 3.981485 375.1820  6.8   23.48175       7.962970 0.99 
1 1 1 9   7  23 o 61.08621 8.123571 90.86036  15.2  32.99878       16.24714 0.86 
1 1 1 9   7  24 o 67.55481 10.09716 163.5738  88.3  -15.98512      20.19431 0.91 
1 1 1 9   7  25 o 85.71358 8.403947 156.0857  41.4  31.68235       16.80789 0.94 
1 1 1 9   7  26 o 138.2347 4.976988 235.1240  4.7   -9.311508      9.953976 0.98 
1 1 1 9   7  27 o 51.26624 11.97333 75.96077  214.3 -12.89229      23.94667 0.84 
1 1 1 9   7  28 o 49.21301 11.69055 125.2229  93.8  7.117371       23.38111 0.92 
1 1 1 9   7  29 o 100.7952 8.373667 118.5294  12.4  -3.023857      16.74733 0.96 
1 1 1 9   7  30 o 33.84964 10.92250 27.79650  248.3 -20.09179      21.84499 0.50 
1 1 1 9   9  0  o 322.4645 4.169976 310.2415  339.1 -7.672638      8.339952 0.95 
1 1 1 9   9  1  o 112.8042 2.507043 224.8425  213.5 10.08404       5.014086 0.71 
1 1 1 9   9  2  o 355.6550 3.694359 656.5674  181.5 21.10291       7.388719 0.97 
1 1 1 9   9  3  o 146.1412 3.668036 266.4538  169.2 10.15945       7.336071 0.84 
1 1 1 9   9  4  o 290.9217 4.555419 353.6962  339.9 ?              ?        0.95 
1 1 1 9   9  5  o 105.7545 3.616494 181.2998  301.2 ?              ?        0.65 
1 1 1 9   9  6  o 307.3698 3.322666 483.9127  348.6 -23.53857      6.645332 0.97 
1 1 1 9   9  7  o 276.1169 3.149141 346.9855  299.1 24.89297       6.298281 0.96 
1 1 1 9   9  8  o 172.7516 3.810026 270.1882  230.6 ?              ?        0.92 
1 1 1 9   9  9  o 321.2540 3.120177 542.2695  67.9  -15.03500      6.240354 0.98 
1 1 1 9   9  10 f 187.9504 2.567731 264.4380  330.7 -8.087128      5.135463 0.00 
1 1 1 9   9  11 o 153.3382 2.613089 315.7114  202.6 -59.72557      5.226178 0.96 
1 1 1 9   9  12 o 167.1483 3.616564 198.9300  135.7 -2.490082      7.233128 0.95 
1 1 1 9   9  13 o 93.04980 5.232659 174.6238  221.9 2.275146       10.46532 0.90 
1 1 1 9   9  14 o 281.2785 4.292429 498.7491  224.0 -15.42844      8.584859 0.99 
1 1 1 9   9  15 o 206.7756 4.171592 356.9181  153.5 -8.327042      8.343184 0.98 
1 1 1 9   9  16 o 180.6140 4.348509 366.4431  75.3  11.41135       8.697019 0.98 
1 1 1 9   9  17 o 173.9629 4.029570 341.9366  356.4 21.17392       8.059140 0.98 
1 1 1 9   9  18 o 141.5558 4.974971 248.6882  256.8 -22.68854      9.949943 0.97 
1 1 1 9   9  19 o 74.78873 8.017441 128.3191  164.4 -35.02303      16.03488 0.92 
1 1 1 9   9  20 o 298.0522 3.754838 434.0603  60.0  14.44562       7.509675 1.00 
1 1 1 9   9  21 o 99.65781 6.449479 151.8849  39.0  22.13592       12.89896 0.95 
1 1 1 9   9  22 o 53.61895 10.55481 107.9026  287.9 -23.29865      21.10962 0.83 
1 1 1 9   9  23 o 126.9639 5.343142 124.1350  9.3   5.661430       10.68628 0.95 
1 1 1 9   9  24 o 112.1292 6.623582 138.1311  182.1 -0.8542328     13.24716 0.96 
1 1 1 9   9  25 o 160.4714 5.411594 202.6775  123.6 22.60124       10.82319 0.99 
1 1 1 9   9  26 f 113.7557 7.257907 187.3787  52.5  0.8948517      14.51581 0.00 
1 1 1 9   9  27 o 55.93330 12.95633 91.07318  148.9 -20.21154      25.91265 0.90 
1 1 1 9   9  28 o 114.3549 8.078949 151.1944  147.7 0.4094849      16.15790 0.98 
1 1 1 9   9  29 x ?        ?        48.77964  75.4  ?              ?        0.00 
1 1 1 9   11 0  o 382.1372 4.025667 653.0649  358.3 11.50247       8.051334 0.99 
1 1 1 9   11 1  o 205.8951 2.993506 210.0357  30.4  12.50816       5.987012 0.95 
1 1 1 9   11 2  o 247.7344 3.419224 420.7994  72.0  2.887726       6.838448 0.98 
1 1 1 9   11 3  o 234.1889 2.901225 361.1539  330.7 -6.380615      5.802451 0.98 
1 1 1 9   11 4  o 330.6538 4.333354 549.6902  333.0 -2.865265      8.666709 0.99 
1 1 1 9   11 5  o 217.1357 2.975498 335.4118  16.8  -38.29077      5.950995 0.98 
1 1 1 9   11 6  o 133.2613 3.093375 97.31380  237.2 22.61805       6.186751 0.89 
1 1 1 9   11 7  o 101.2001 3.736804 97.82969  103.1 9.764702       7.473607 0.85 
1 1 1 9   11 8  o 250.7189 3.263115 450.8257  222.3 -19.61440      6.526230 0.99 
1 1 1 9   11 9  o 136.5250 3.053220 224.3963  349.7 17.25447       6.106440 0.96 
1 1 1 9   11 10 o 241.8537 2.739234 416.0901  76.0  -5.110825      5.478467 0.99 
1 1 1 9   11 11 o 158.3094 2.438741 198.1001  91.5  26.08371       4.877481 0.97 
1 1 1 9   11 12 o 43.63741 9.318605 124.2616  112.3 -15.01823      18.63721 0.79 
1 1 1 9   11 13 o 107.9317 5.584810 221.6567  146.0 5.338371       11.16962 0.96 
1 1 1 9   11 14 o 140.7017 4.618260 211.4365  46.0  -7.425385      9.236521 0.97 
1 1 1 9   11 15 o 104.9094 6.117934 143.1955  10.1  -5.843498      12.23587 0.95 
1 1 1 9   11 16 o 114.5750 6.547550 202.6232  231.0 11.64611       13.09510 0.97 
1 1 1 9   11 17 o 80.11047 7.740410 113.5740  323.7 -13.16525      15.48082 0.93 
1 1 1 9   11 18 o 114.7067 6.357120 176.2801  36.4  10.50556       12.71424 0.96 
1 1 1 9   11 19 o 134.6581 6.399026 197.4124  200.7 2.805710       12.79805 0.97 
1 1 1 9   11 20 o 200.8334 5.086226 301.6265  230.9 21.47198       10.17245 0.99 
1 1 1 9   11 21 o 139.7858 6.232204 209.2942  89.0  1.513901       12.46441 0.98 
1 1 1 9   11 22 o 128.8350 6.834918 251.0568  97.5  3.135399       13.66984 0.99 
1 1 1 9   11 23 o 63.72514 11.99062 98.87626  67.2  19.39423       23.98125 0.92 
1 1 1 9   11 24 o 45.48992 12.81353 61.64896  88.6  -7.934269      25.62706 0.81 
1 1 1 9   11 25 o 36.64919 11.52779 60.51376  205.1 0.4417305      23.05557 0.78 
1 1 1 9   11 26 o 37.78597 12.19261 63.30719  300.2 ?              ?        0.81 
1 1 1 9   13 0  o 54.03035 7.581203 193.9538  195.5 -23.45814      15.16241 0.91 
1 1 1 9   13 1  o 129.5829 3.263057 142.4566  134.1 -3.144516      6.526115 0.95 
1 1 1 9   13 2  o 96.54445 4.010647 74.32092  342.2 44.75760       8.021295 0.87 
1 1 1 9   13 3  o 117.8020 3.530873 162.5834  17.8  41.81761       7.061745 0.96 
1 1 1 9   13 4  o 47.23941 7.242883 50.53126  9.5   35.07671       14.48577 0.57 
1 1 1 9   13 5  o 177.3426 3.392412 248.5530  51.5  -1.871292      6.784824 0.98 
1 1 1 9   13 6  o 138.1073 3.895434 179.7494  77.9  26.01050       7.790868 0.97 
1 1 1 9   13 7  o 250.2489 3.595081 421.3308  308.3 12.40720       7.190161 0.99 
1 1 1 9   13 8  o 136.7330 3.763221 217.1842  288.1 26.89300       7.526443 0.98 
1 1 1 9   13 9  o 80.22065 5.897177 134.1482  311.5 33.11747       11.79435 0.94 
1 1 1 9   13 10 o 145.8811 2.993872 243.6228  230.4 -13.03209      5.987743 0.98 
1 1 1 9   13 11 o 33.04112 7.611688 74.98113  117.8 -11.38649      15.22338 0.74 
1 1 1 9   13 12 o 66.24618 4.344360 62.70037  328.1 15.95084       8.688721 0.84 
1 1 1 9   13 13 o 186.2445 4.979398 276.0215  336.1 32.92072       9.958797 0.99 
1 1 1 9   13 14 o 220.0952 4.425507 381.1176  287.3 0.9822083E-01  8.851013 0.99 
1 1 1 9   13 15 o 240.7858 4.814710 337.0515  178.2 5.339722       9.629419 0.99 
1 1 1 9   13 16 o 60.29642 10.93679 66.14175  177.6 -15.15025      21.87358 0.80 
1 1 1 9   13 17 o 63.83051 10.69438 138.5833  287.8 -1.145618      21.38876 0.93 
1 1 1 9   13 18 o 84.40100 10.47044 208.7710  343.8 17.47987       20.94088 0.97 
1 1 1 9   13 19 o 132.3062 6.408413 185.2245  275.7 -12.09444      12.81683 0.98 
1 1 1 9   13 20 o 98.14621 9.471236 144.7661  234.2 8.797562       18.94247 0.97 
1 1 1 9   13 21 f 65.08936 10.94757 134.2197  238.0 28.42218       21.89515 0.00 
1 1 1 9   13 22 f 30.42823 9.939247 50.55220  336.0 -3.137585      19.87849 0.00 
1 1 1 9   13 23 o 59.33536 9.990055 93.26241  257.8 ?              ?        0.94 
1 1 1 9   15 0  o 63.11858 8.632542 121.0342  161.7 -15.49120      17.26508 0.91 
1 1 1 9   15 1  o 140.8486 3.961518 248.6174  184.8 23.57872       7.923037 0.98 
1 1 1 9   15 2  o 72.79665 10.91957 102.2924  206.9 7.851128       21.83913 0.90 
1 1 1 9   15 3  o 36.10758 9.659398 44.80456  101.5 13.67120       19.31880 0.48 
1 1 1 9   15 4  o 63.84849 7.632106 48.22353  191.6 18.01690       15.26421 0.72 
1 1 1 9   15 5  o 106.9063 5.653709 199.0010  53.2  -30.52522      11.30742 0.97 
1 1 1 9   15 6  o 88.89697 5.767453 172.3788  105.4 1.651482       11.53491 0.96 
1 1 1 9   15 7  o 71.41268 8.496185 79.57899  105.2 -21.66496      16.99237 0.87 
1 1 1 9   15 8  o 139.7879 4.697252 288.9194  298.7 -15.99530      9.394504 0.99 
1 1 1 9   15 9  o 166.6981 3.939739 318.3923  301.6 -19.49452      7.879478 0.99 
1 1 1 9   15 10 o 75.31123 6.502083 98.13905  293.6 -4.140526      13.00417 0.93 
1 1 1 9   15 11 o 30.98059 8.223068 64.96298  93.9  -10.46063      16.44614 0.71 
1 1 1 9   15 12 o 83.88016 3.926430 99.82655  20.5  -12.52497      7.852859 0.95 
1 1 1 9   15 13 o 73.02669 13.68362 149.7536  348.3 -43.97915      27.36724 0.95 
1 1 1 9   15 14 o 40.87778 13.17075 97.53453  74.9  -4.131561      26.34150 0.88 
1 1 1 9   15 15 o 67.15001 15.80100 84.91463  334.6 1.772362       31.60200 0.90 
1 1 1 9   15 16 o 70.77151 21.97336 102.8178  239.7 ?              ?        0.89 
1 1 1 9   15 17 o 65.23723 14.67686 153.2794  144.3 38.05786       29.35373 0.95 
1 1 1 9   15 18 o 38.80686 12.93229 92.04010  147.4 ?              ?        0.88 
1 1 1 9   15 19 o 37.86272 12.82450 95.68657  101.1 ?              ?        0.89 
1 1 1 9   17 0  o 37.97390 10.68308 68.22623  61.3  13.29994       21.36615 0.83 
1 1 1 9   17 1  o 88.06239 9.450563 159.4601  185.5 -8.163803      18.90113 0.97 
1 1 1 9   17 2  o 58.09140 10.27821 136.9687  162.8 27.89231       20.55643 0.95 
1 1 1 9   17 3  o 48.77746 10.78099 104.1166  328.4 2.916351       21.56198 0.92 
1 1 1 9   17 4  o 147.8673 8.576953 311.8987  310.5 14.72656       17.15391 0.99 
1 1 1 9   17 5  o 186.7598 4.386741 339.5413  284.9 2.412170       8.773482 1.00 
1 1 1 9   17 6  o 50.72453 11.64892 54.43855  251.4 7.259834       23.29784 0.84 
1 1 1 9   17 7  o 39.65635 10.95130 39.13586  254.1 10.75331       21.90261 0.70 
1 1 1 9   17 8  o 50.74419 10.03171 77.65223  89.4  39.02335       20.06342 0.90 
1 1 1 9   17 9  o 43.41990 10.15723 123.5329  100.0 -24.73462      20.31447 0.93 
1 1 1 9   17 10 o 32.96247 9.823707 28.20090  268.8 -1.750233      19.64741 0.57 
1 1 1 9   17 11 o 36.53701 9.061119 69.05623  7.2   ?              ?        0.87 
1 1 1 9   17 12 o 48.71783 15.02061 95.68185  82.5  ?              ?        0.90 
1 1 1 10  0  0  o 364.2333 6.157672 2026.023  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  1  o 951.2792 8.893565 1867.139  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  2  o 167.2743 3.406202 351.5223  0.0   0.000000       0.000000 0.98 
1 1 1 10  0  3  o 983.7918 8.762259 1010.205  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  4  o 285.7138 3.892939 464.2821  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  5  o 156.7217 3.522645 1195.203  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  6  o 189.7985 3.094764 304.5579  0.0   0.000000       0.000000 0.96 
1 1 1 10  0  7  o 563.1203 7.837672 551.9697  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  8  o 70.02153 3.705619 1.369961  180.0 0.000000       0.000000 0.22 
1 1 1 10  0  9  o 295.2337 4.974070 34.36388  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  10 o 77.77580 4.141739 161.8384  180.0 0.000000       0.000000 0.46 
1 1 1 10  0  11 o 46.24969 5.940562 140.2651  180.0 0.000000       0.000000 0.00 
1 1 1 10  0  12 o 172.4641 4.027547 320.9368  0.0   0.000000       0.000000 0.92 
1 1 1 10  0  13 o 283.5025 4.740342 844.5450  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  14 o 278.3958 4.891551 494.3669  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  15 o 216.8712 4.474607 180.8380  180.0 0.000000       0.000000 0.84 
1 1 1 10  0  16 o 398.3558 6.009254 384.6322  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  17 o 190.3319 4.069753 173.4898  180.0 0.000000       0.000000 0.93 
1 1 1 10  0  18 f 189.0369 4.664378 6.719769  180.0 0.000000       0.000000 0.00 
1 1 1 10  0  19 o 76.85431 7.418370 39.44878  180.0 0.000000       0.000000 0.31 
1 1 1 10  0  20 o 243.2270 5.014624 297.5186  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  21 o 174.3302 5.214382 338.5496  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  22 o 30.90159 16.25061 10.52231  0.0   0.000000       0.000000 0.06 
1 1 1 10  0  23 o 227.6015 5.164334 309.3630  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  24 f 69.88994 11.49247 176.1730  0.0   0.000000       0.000000 0.00 
1 1 1 10  0  25 o 205.5457 5.765234 344.1693  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  26 o 102.2373 10.18889 150.2801  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  27 o 174.9882 11.01811 136.3379  180.0 0.000000       0.000000 1.00 
1 1 1 10  0  28 o 27.80113 17.55302 82.61244  0.0   0.000000       0.000000 0.56 
1 1 1 10  0  29 o 128.4653 9.663133 168.8699  0.0   0.000000       0.000000 1.00 
1 1 1 10  0  30 f 34.93993 20.53920 1.049711  180.0 0.000000       0.000000 0.00 
1 1 1 10  0  31 o 21.91763 15.45022 22.30877  0.0   0.000000       0.000000 0.25 
1 1 1 10  0  32 o 37.07661 21.09334 57.94279  0.0   0.000000       0.000000 0.77 
1 1 1 10  0  33 o 22.49066 15.90030 13.88170  0.0   ?              ?        0.19 
1 1 1 10  2  0  o 81.61323 1.990377 498.9016  108.3 68.54485       3.980755 0.58 
1 1 1 10  2  1  o 766.8778 5.874826 902.8184  78.1  32.60553       11.74965 0.99 
1 1 1 10  2  2  o 333.3460 3.583150 263.2961  126.1 22.03555       7.166300 0.96 
1 1 1 10  2  3  f 900.9774 7.524441 1998.727  259.4 52.75922       15.04888 0.00 
1 1 1 10  2  4  o 437.6816 3.843520 772.6112  214.2 17.36493       7.687040 0.98 
1 1 1 10  2  5  o 292.5807 2.780704 111.7233  191.2 -30.16248      5.561407 0.94 
1 1 1 10  2  6  o 413.4110 3.456868 789.3959  318.8 -43.58618      6.913735 0.98 
1 1 1 10  2  7  o 507.1709 4.472375 1029.937  253.5 38.27386       8.944750 0.98 
1 1 1 10  2  8  f 159.2909 2.274284 98.47298  173.7 6.656357       4.548568 0.00 
1 1 1 10  2  9  o 189.6150 2.465812 105.9343  159.3 -7.066818      4.931624 0.42 
1 1 1 10  2  10 o 390.7996 3.686439 576.5537  281.9 16.38654       7.372878 0.97 
1 1 1 10  2  11 f 152.2572 2.779214 212.2516  145.0 -81.99651      5.558428 0.00 
1 1 1 10  2  12 o 270.9802 3.224046 421.4508  226.1 -19.74261      6.448092 0.93 
1 1 1 10  2  13 o 654.3483 5.843163 934.5330  238.6 23.87567       11.68633 0.99 
1 1 1 10  2  14 o 611.1039 6.751440 1001.895  299.5 -6.468323      13.50288 0.99 
1 1 1 10  2  15 o 347.4886 5.144861 480.5354  225.6 ?              ?        0.96 
1 1 1 10  2  16 o 228.2589 3.184375 359.3055  297.4 29.71236       6.368750 0.93 
1 1 1 10  2  17 o 379.5682 4.018258 404.8336  228.8 -2.348572      8.036515 0.97 
1 1 1 10  2  18 o 168.8055 3.400910 199.0817  325.4 31.78432       6.801821 0.90 
1 1 1 10  2  19 o 238.2477 3.510528 406.6355  256.4 23.87842       7.021056 0.98 
1 1 1 10  2  20 o 74.69145 5.676701 7.763207  266.7 -36.15539      11.35340 0.08 
1 1 1 10  2  21 o 279.2388 3.877694 336.6636  173.7 14.14249       7.755389 0.98 
1 1 1 10  2  22 o 298.9973 5.599876 407.6069  165.6 -16.29501      11.19975 0.99 
1 1 1 10  2  23 o 108.3270 5.404399 136.8533  122.5 -29.36073      10.80880 0.92 
1 1 1 10  2  24 o 44.17222 10.27308 71.14204  42.6  -0.5200157     20.54616 0.61 
1 1 1 10  2  25 o 40.51082 10.57619 54.10809  36.3  -7.362278      21.15238 0.58 
1 1 1 10  2  26 o 148.9291 4.913035 194.6585  27.7  -26.47198      9.826071 0.97 
1 1 1 10  2  27 o 130.9516 5.933997 139.0279  186.3 10.03750       11.86799 0.95 
1 1 1 10  2  28 o 202.6065 5.288023 212.3531  219.5 9.000534       10.57605 0.98 
1 1 1 10  2  29 o 47.83369 12.48842 67.70569  122.9 -0.2451324E-01 24.97684 0.76 
1 1 1 10  2  30 o 71.61959 10.92923 118.7258  23.2  34.01995       21.85846 0.94 
1 1 1 10  2  31 o 50.37018 11.33141 43.18860  230.1 39.70147       22.66282 0.74 
1 1 1 10  2  32 o 57.94299 12.62931 73.14825  345.7 21.34794       25.25861 0.88 
1 1 1 10  2  33 x ?        ?        90.86942  330.4 ?              ?        0.00 
1 1 1 10  4  0  f 267.8879 2.960908 512.7339  3.6   95.43112       5.921816 0.00 
1 1 1 10  4  1  o 249.0355 3.118025 183.0085  252.7 -17.12756      6.236050 0.91 
1 1 1 10  4  2  o 94.51739 2.607203 296.0096  214.8 55.96349       5.214405 0.66 
1 1 1 10  4  3  o 163.6150 2.534772 559.1993  279.3 14.28465       5.069543 0.89 
1 1 1 10  4  4  o 144.7543 2.586048 109.4557  191.0 -23.09244      5.172096 0.74 
1 1 1 10  4  5  o 91.07417 2.358047 81.47984  301.9 31.05430       4.716094 0.20 
1 1 1 10  4  6  o 652.5909 5.580245 1205.419  344.2 3.453918       11.16049 0.99 
1 1 1 10  4  7  o 331.1040 3.303113 615.0070  265.3 12.89917       6.606227 0.96 
1 1 1 10  4  8  o 252.8922 2.403363 479.8979  156.7 45.42358       4.806726 0.94 
1 1 1 10  4  9  o 306.7639 4.008728 497.6315  139.5 63.79181       8.017456 0.95 
1 1 1 10  4  10 o 411.8792 3.792426 364.5971  174.0 -24.00339      7.584852 0.96 
1 1 1 10  4  11 o 324.1087 3.102892 415.9398  314.2 1.973206       6.205784 0.94 
1 1 1 10  4  12 o 365.3206 3.658320 564.2763  206.5 -14.51147      7.316640 0.97 
1 1 1 10  4  13 o 591.9813 5.323977 911.0840  150.5 18.14374       10.64795 0.99 
1 1 1 10  4  14 o 386.9025 3.608111 667.4680  133.0 24.26508       7.216221 0.98 
1 1 1 10  4  15 f 294.6650 2.899584 461.7834  278.9 17.48416       5.799167 0.00 
1 1 1 10  4  16 o 341.2576 3.380075 523.9264  39.1  15.16568       6.760150 0.98 
1 1 1 10  4  17 o 275.3031 3.653389 356.3943  13.7  42.69022       7.306779 0.97 
1 1 1 10  4  18 o 104.5044 4.000780 119.9462  38.6  5.417503       8.001560 0.86 
1 1 1 10  4  19 o 251.8508 3.223398 354.0031  219.0 18.82043       6.446795 0.98 
1 1 1 10  4  20 o 134.1905 4.007349 110.7686  186.7 -2.420303      8.014698 0.88 
1 1 1 10  4  21 o 228.5300 3.635224 318.6246  273.7 -7.197647      7.270448 0.98 
1 1 1 10  4  22 o 268.7516 3.679110 375.6938  272.6 -13.94873      7.358220 0.99 
1 1 1 10  4  23 o 61.13730 8.684265 45.51549  212.6 -12.98523      17.36853 0.57 
1 1 1 10  4  24 o 191.8304 4.259212 282.4593  291.3 -12.86157      8.518425 0.99 
1 1 1 10  4  25 o 67.92945 10.26666 49.51843  310.5 3.425171       20.53333 0.72 
1 1 1 10  4  26 o 103.0894 6.803751 103.5747  355.0 -7.502541      13.60750 0.91 
1 1 1 10  4  27 o 149.7584 5.130792 213.8332  300.0 7.585464       10.26158 0.97 
1 1 1 10  4  28 o 78.41966 9.300387 93.53908  18.8  42.16210       18.60077 0.90 
1 1 1 10  4  29 o 72.46888 11.32964 117.8873  334.6 -23.95480      22.65929 0.93 
1 1 1 10  4  30 o 75.97923 11.36607 141.2083  245.5 -22.21404      22.73213 0.95 
1 1 1 10  4  31 o 53.46220 12.99696 98.98203  285.7 0.5751686      25.99392 0.90 
1 1 1 10  4  32 o 40.20396 12.46819 65.99320  35.4  ?              ?        0.82 
1 1 1 10  6  0  o 171.6660 2.341349 338.7191  342.3 -20.50851      4.682698 0.90 
1 1 1 10  6  1  o 242.4511 2.892244 615.1610  174.6 -7.072372      5.784488 0.92 
1 1 1 10  6  2  o 269.1874 3.206225 232.7255  340.1 45.96669       6.412450 0.88 
1 1 1 10  6  3  o 286.9274 3.323013 695.2753  155.5 8.434113       6.646026 0.95 
1 1 1 10  6  4  o 409.7719 4.169707 443.1519  309.2 -40.30460      8.339415 0.96 
1 1 1 10  6  5  o 424.1893 4.285092 698.1584  359.6 -1.818024      8.570184 0.97 
1 1 1 10  6  6  o 115.6616 2.782925 352.8169  233.2 -32.44545      5.565851 0.75 
1 1 1 10  6  7  o 698.1984 5.805443 1016.183  7.1   -25.58209      11.61089 0.99 
1 1 1 10  6  8  o 270.6706 2.865419 424.1259  6.5   3.764038       5.730837 0.94 
1 1 1 10  6  9  o 461.3675 4.108049 746.4720  324.8 -13.99313      8.216098 0.98 
1 1 1 10  6  10 o 591.7665 6.165913 813.9592  17.5  -8.851624      12.33183 0.99 
1 1 1 10  6  11 o 332.5771 3.933470 438.3306  54.6  38.36188       7.866939 0.95 
1 1 1 10  6  12 o 335.0410 3.516627 389.2722  210.5 -32.50381      7.033253 0.96 
1 1 1 10  6  13 o 354.3157 3.428488 449.8779  273.8 -32.25452      6.856977 0.97 
1 1 1 10  6  14 o 212.7433 2.965267 297.0525  226.0 26.33928       5.930534 0.94 
1 1 1 10  6  15 o 302.6448 3.257642 431.7861  227.3 -10.41031      6.515284 0.98 
1 1 1 10  6  16 f 218.3499 2.841234 352.7484  104.1 34.06316       5.682468 0.00 
1 1 1 10  6  17 o 237.2374 3.027929 389.2260  67.4  12.30914       6.055858 0.98 
1 1 1 10  6  18 o 93.56998 4.287674 179.0673  271.6 -16.69916      8.575348 0.89 
1 1 1 10  6  19 o 209.9895 3.021390 320.6771  203.6 -7.491821      6.042781 0.98 
1 1 1 10  6  20 o 63.75112 7.921331 117.6548  22.4  -35.66276      15.84266 0.84 
1 1 1 10  6  21 o 167.3288 3.618655 283.3911  359.6 -24.46542      7.237310 0.98 
1 1 1 10  6  22 o 95.75584 5.287195 162.8169  44.9  9.596085       10.57439 0.94 
1 1 1 10  6  23 o 129.8025 5.200248 99.44939  30.7  -14.98550      10.40050 0.95 
1 1 1 10  6  24 o 37.64473 8.981544 47.90892  170.9 20.91456       17.96309 0.48 
1 1 1 10  6  25 o 29.93181 9.425166 37.80198  215.8 -8.412777      18.85033 0.30 
1 1 1 10  6  26 o 162.9473 4.345662 220.7731  118.8 12.48695       8.691324 0.98 
1 1 1 10  6  27 o 51.54858 11.92433 35.80983  235.7 -10.88164      23.84867 0.57 
1 1 1 10  6  28 o 46.51762 11.51445 43.34747  214.9 8.978687       23.02891 0.69 
1 1 1 10  6  29 o 45.90813 11.99282 61.32351  106.5 2.787251       23.98563 0.81 
1 1 1 10  6  30 o 68.02466 10.97482 110.6610  96.6  31.30293       21.94963 0.94 
1 1 1 10  6  31 o 54.82851 13.12789 66.35599  279.6 ?              ?        0.87 
1 1 1 10  8  0  o 150.7789 2.506546 412.9831  309.6 -3.482971      5.013093 0.86 
1 1 1 10  8  1  o 467.2346 4.480319 593.3557  270.6 -37.02246      8.960639 0.98 
1 1 1 10  8  2  o 373.2377 3.781751 465.2610  226.7 19.42520       7.563502 0.97 
1 1 1 10  8  3  o 612.8287 5.429307 1074.668  131.4 7.532715       10.85861 0.99 
1 1 1 10  8  4  o 265.7047 3.153330 306.7021  187.1 53.06326       6.306659 0.93 
1 1 1 10  8  5  o 505.9660 4.724674 857.3880  72.6  -10.30734      9.449347 0.99 
1 1 1 10  8  6  o 788.1843 8.443325 1188.417  76.6  11.75757       16.88665 0.99 
1 1 1 10  8  7  o 258.2451 3.108992 231.9250  319.5 21.96791       6.217984 0.92 
1 1 1 10  8  8  o 167.1825 2.411543 151.1202  98.4  -3.394501      4.823087 0.75 
1 1 1 10  8  9  o 400.8510 3.683866 474.2478  83.1  -30.49722      7.367732 0.98 
1 1 1 10  8  10 o 248.9350 2.832987 356.6651  155.4 -14.78101      5.665974 0.96 
1 1 1 10  8  11 o 253.4156 2.769485 407.2143  122.7 -27.38983      5.538970 0.97 
1 1 1 10  8  12 o 229.0369 3.589061 436.4565  340.8 -14.26987      7.178123 0.97 
1 1 1 10  8  13 o 71.43863 7.568161 139.7552  244.4 44.44505       15.13632 0.80 
1 1 1 10  8  14 o 66.61051 8.012003 38.32973  290.7 12.36811       16.02401 0.45 
1 1 1 10  8  15 o 306.0942 4.245005 427.9820  356.5 33.66251       8.490009 0.99 
1 1 1 10  8  16 o 50.48108 8.730525 101.0306  259.7 -18.79290      17.46105 0.64 
1 1 1 10  8  17 o 178.8377 3.449785 204.0354  181.0 2.186462       6.899570 0.97 
1 1 1 10  8  18 o 151.2721 3.567178 255.5394  218.4 -8.750626      7.134356 0.97 
1 1 1 10  8  19 o 46.89710 9.201165 61.03066  199.4 -15.69651      18.40233 0.59 
1 1 1 10  8  20 f 100.5058 5.705420 161.5784  81.8  -21.44010      11.41084 0.00 
1 1 1 10  8  21 o 114.2764 5.284919 111.3320  100.6 -26.03093      10.56984 0.95 
1 1 1 10  8  22 o 92.78185 6.444547 163.2494  163.1 -3.842514      12.88909 0.95 
1 1 1 10  8  23 o 56.07060 10.53825 97.29334  238.9 -11.84422      21.07650 0.81 
1 1 1 10  8  24 o 115.6483 5.707181 194.9137  168.1 -33.71466      11.41436 0.97 
1 1 1 10  8  25 o 132.2329 6.228039 160.6656  121.8 -9.416084      12.45608 0.97 
1 1 1 10  8  26 o 122.7334 5.857481 180.7578  3.7   -0.6786957     11.71496 0.98 
1 1 1 10  8  27 o 91.91771 8.329823 120.2252  230.1 -11.87482      16.65965 0.96 
1 1 1 10  8  28 o 84.76691 9.680160 116.9385  156.0 4.932755       19.36032 0.96 
1 1 1 10  8  29 o 37.64940 11.60743 51.82343  110.6 -3.968018      23.21486 0.75 
1 1 1 10  10 0  o 176.0223 2.753137 196.8165  117.0 -0.2934265     5.506274 0.89 
1 1 1 10  10 1  o 290.8419 4.380928 429.6387  85.0  31.49280       8.761855 0.97 
1 1 1 10  10 2  o 311.2594 6.400939 527.9470  227.4 ?              ?        0.98 
1 1 1 10  10 3  o 67.47736 5.940856 122.6142  140.8 -29.12963      11.88171 0.51 
1 1 1 10  10 4  o 204.9044 2.900896 185.5170  113.4 -42.19170      5.801791 0.92 
1 1 1 10  10 5  o 353.8278 4.352650 557.3167  128.0 -19.13141      8.705300 0.99 
1 1 1 10  10 6  o 108.9703 3.098726 188.9906  157.0 -46.43814      6.197451 0.86 
1 1 1 10  10 7  o 60.80832 4.878200 90.61841  254.2 -28.24296      9.756399 0.56 
1 1 1 10  10 8  o 346.7899 3.617566 536.0973  178.4 -11.87646      7.235133 0.99 
1 1 1 10  10 9  o 188.7733 2.607175 266.1207  96.4  -52.97437      5.214351 0.97 
1 1 1 10  10 10 o 410.4209 3.696601 556.9708  29.2  -11.13809      7.393201 0.99 
1 1 1 10  10 11 o 89.84621 3.112005 144.9829  259.2 -10.55708      6.224011 0.88 
1 1 1 10  10 12 o 338.5519 4.766516 490.2417  127.7 -2.251953      9.533032 0.99 
1 1 1 10  10 13 o 165.6625 3.904251 219.8820  68.5  -16.89404      7.808503 0.97 
1 1 1 10  10 14 o 107.4326 5.634346 141.1805  308.9 -7.746323      11.26869 0.93 
1 1 1 10  10 15 o 122.5136 5.428940 199.1979  292.8 15.52242       10.85788 0.96 
1 1 1 10  10 16 o 192.9583 4.144277 279.6106  87.7  -14.06500      8.288554 0.98 
1 1 1 10  10 17 o 83.79530 8.635962 169.4007  21.4  14.34087       17.27192 0.95 
1 1 1 10  10 18 o 159.3119 5.071546 214.4287  323.2 -2.732101      10.14309 0.98 
1 1 1 10  10 19 o 101.7405 6.795794 166.2414  309.9 1.361580       13.59159 0.96 
1 1 1 10  10 20 o 96.73975 7.503871 108.0657  284.0 -14.42966      15.00774 0.92 
1 1 1 10  10 21 o 216.0035 4.859292 298.2888  351.7 -1.903152      9.718584 0.99 
1 1 1 10  10 22 o 38.06890 10.94346 88.04605  92.6  3.863850       21.88692 0.75 
1 1 1 10  10 23 o 30.56938 10.29269 47.45678  134.9 -15.75857      20.58537 0.55 
1 1 1 10  10 24 o 86.51297 8.164263 83.60236  219.8 -12.06677      16.32853 0.94 
1 1 1 10  10 25 o 88.45614 9.937645 108.0511  185.3 20.18604       19.87529 0.96 
1 1 1 10  10 26 o 133.7729 7.856567 165.6303  116.9 14.81406       15.71313 0.98 
1 1 1 10  10 27 o 106.5485 8.877457 135.7423  78.9  ?              ?        0.98 
1 1 1 10  12 0  o 70.09155 5.754093 81.01124  358.2 8.210632       11.50819 0.70 
1 1 1 10  12 1  o 123.5715 3.440294 251.2589  291.3 -11.98161      6.880588 0.95 
1 1 1 10  12 2  o 83.59869 4.561085 167.4073  38.9  13.46101       9.122170 0.90 
1 1 1 10  12 3  o 162.4277 3.078738 193.0668  43.4  52.52487       6.157476 0.96 
1 1 1 10  12 4  o 144.9763 4.662672 234.0438  58.2  ?              ?        0.96 
1 1 1 10  12 5  f 143.2684 3.312432 194.2569  30.7  10.62573       6.624864 0.00 
1 1 1 10  12 6  o 282.7437 3.471102 393.0158  260.8 5.737793       6.942204 0.99 
1 1 1 10  12 7  o 204.1805 3.150244 296.5047  299.2 -27.98051      6.300487 0.98 
1 1 1 10  12 8  o 46.50521 7.406876 59.55639  310.2 -28.41692      14.81375 0.60 
1 1 1 10  12 9  o 57.73335 6.966535 192.6815  65.5  40.19433       13.93307 0.92 
1 1 1 10  12 10 o 255.3278 3.052871 445.8198  223.5 -17.20436      6.105742 0.99 
1 1 1 10  12 11 o 37.26882 6.297427 13.77418  317.2 25.53182       12.59485 0.16 
1 1 1 10  12 12 f 125.5397 2.867919 171.6022  73.3  26.85533       5.735839 0.00 
1 1 1 10  12 13 o 49.44136 9.645666 80.34193  115.7 -8.644985      19.29133 0.82 
1 1 1 10  12 14 o 40.15137 10.50900 55.45458  331.2 -24.13930      21.01800 0.66 
1 1 1 10  12 15 o 49.01649 10.40631 60.47045  201.6 -17.30502      20.81262 0.70 
1 1 1 10  12 16 f 155.7641 5.734650 231.3816  349.5 -5.408875      11.46930 0.00 
1 1 1 10  12 17 o 69.66671 10.49864 91.60582  236.4 11.82368       20.99728 0.87 
1 1 1 10  12 18 o 83.73590 10.73018 154.5013  152.6 49.12864       21.46036 0.94 
1 1 1 10  12 19 o 154.4844 5.835085 232.8993  193.0 -15.51210      11.67017 0.99 
1 1 1 10  12 20 o 37.81879 11.56564 115.9752  112.4 -8.278202      23.13128 0.87 
1 1 1 10  12 21 o 56.99434 14.06214 83.57628  145.8 -0.3254623     28.12427 0.89 
1 1 1 10  12 22 o 95.09940 9.872356 102.8890  356.9 -1.474709      19.74471 0.96 
1 1 1 10  12 23 f 40.25134 12.47527 54.37678  75.0  -24.18975      24.95054 0.00 
1 1 1 10  12 24 f 51.09440 13.51627 127.6977  357.3 -9.640160      27.03253 0.00 
1 1 1 10  12 25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 10  14 0  o 91.96294 5.599596 152.8791  114.6 -37.13473      11.19919 0.95 
1 1 1 10  14 1  o 112.4722 7.182820 237.1059  199.7 2.965935       14.36564 0.98 
1 1 1 10  14 2  o 90.01804 5.142304 100.7993  298.8 31.94166       10.28461 0.93 
1 1 1 10  14 3  o 212.6028 3.569186 364.9430  56.1  2.474838       7.138372 0.99 
1 1 1 10  14 4  o 51.52940 8.981884 140.8013  343.6 8.503803       17.96377 0.91 
1 1 1 10  14 5  o 76.23337 6.431453 126.8493  178.7 5.254646       12.86291 0.95 
1 1 1 10  14 6  o 100.6958 5.325970 202.4618  144.3 -15.54721      10.65194 0.98 
1 1 1 10  14 7  o 40.78707 9.736656 106.9811  351.4 17.28020       19.47331 0.84 
1 1 1 10  14 8  o 156.8957 3.929021 244.8144  22.9  -4.471710      7.858042 0.98 
1 1 1 10  14 9  o 50.81128 9.123922 51.76791  30.2  4.308685       18.24784 0.66 
1 1 1 10  14 10 o 59.99220 7.900652 133.1236  214.6 -25.71808      15.80130 0.90 
1 1 1 10  14 11 o 65.49341 5.888666 89.83700  193.6 11.70158       11.77733 0.88 
1 1 1 10  14 12 f 71.37328 4.817185 87.75162  107.8 -7.332474      9.634371 0.00 
1 1 1 10  14 13 o 56.60620 7.542154 18.36274  252.3 ?              ?        0.40 
1 1 1 10  14 14 o 69.14162 10.54726 130.3665  267.0 -5.054878      21.09451 0.94 
1 1 1 10  14 15 o 57.66690 13.78613 92.36957  295.0 -23.00815      27.57226 0.89 
1 1 1 10  14 16 o 58.78305 14.67445 78.58229  97.7  24.51503       29.34891 0.88 
1 1 1 10  14 17 o 129.2529 13.14351 200.7051  108.9 ?              ?        0.98 
1 1 1 10  14 18 o 42.31038 13.16365 48.75690  94.3  5.296673       26.32731 0.74 
1 1 1 10  14 19 o 59.49686 15.07495 98.34330  289.8 -3.529327      30.14989 0.91 
1 1 1 10  14 20 o 61.87038 14.38689 136.3042  251.0 39.58340       28.77378 0.94 
1 1 1 10  14 21 f 70.10680 11.36085 88.42257  147.5 ?              ?        0.00 
1 1 1 10  16 0  o 44.66801 11.27909 94.86948  315.9 17.96870       22.55818 0.84 
1 1 1 10  16 1  o 98.92597 6.338336 201.8698  283.5 -20.11555      12.67667 0.97 
1 1 1 10  16 2  o 40.67102 9.073629 46.23281  162.2 -23.22095      18.14726 0.65 
1 1 1 10  16 3  o 35.49361 11.05155 2.303323  128.5 0.3642769      22.10310 0.04 
1 1 1 10  16 4  o 93.36102 6.697877 160.9323  302.5 7.650520       13.39575 0.97 
1 1 1 10  16 5  o 112.3176 7.150205 189.1906  18.8  14.10054       14.30041 0.98 
1 1 1 10  16 6  o 162.1474 4.519279 270.6236  34.5  -13.38135      9.038559 0.99 
1 1 1 10  16 7  o 38.10513 10.79780 77.55570  317.5 -3.415798      21.59559 0.83 
1 1 1 10  16 8  o 48.75415 10.62682 86.96835  77.9  0.9907990      21.25363 0.89 
1 1 1 10  16 9  o 104.0101 5.605485 195.4801  45.7  -0.6893311     11.21097 0.98 
1 1 1 10  16 10 o 36.34397 10.26178 51.05572  291.1 4.620045       20.52356 0.77 
1 1 1 10  16 11 o 29.65666 8.439547 18.88163  171.0 -9.203533      16.87909 0.39 
1 1 1 10  16 12 f 70.82001 5.117863 142.2671  121.9 -1.747185      10.23573 0.00 
1 1 1 10  16 13 o 63.52879 16.01972 143.6761  176.6 -0.6341019     32.03943 0.94 
1 1 1 10  16 14 o 51.99800 14.82874 96.12537  138.9 -1.963043      29.65748 0.90 
1 1 1 10  16 15 o 36.82119 12.23100 47.52097  354.9 ?              ?        0.74 
1 1 1 10  16 16 x ?        ?        70.16141  220.6 ?              ?        0.00 
1 1 1 10  18 0  o 115.1224 6.080079 256.0380  356.4 5.722321       12.16016 0.99 
1 1 1 10  18 1  o 61.53800 10.65966 115.9678  20.7  -3.392796      21.31931 0.95 
1 1 1 10  18 2  o 67.51319 12.05751 175.7991  72.2  -8.467602      24.11503 0.97 
1 1 1 10  18 3  o 55.35557 12.22755 141.7270  58.7  -13.50865      24.45510 0.95 
1 1 1 10  18 4  o 38.18769 11.97117 48.83022  356.5 ?              ?        0.77 
1 1 1 10  18 5  o 33.80575 11.39395 14.42113  129.5 ?              ?        0.33 
1 1 1 10  18 6  o 50.75610 11.91105 132.5424  95.5  ?              ?        0.95 
1 1 1 10  18 7  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 11  1  0  o 649.4805 5.336366 836.8156  349.6 -66.99994      10.67273 0.99 
1 1 1 11  1  1  o 986.9373 7.223099 2294.057  286.0 14.50720       14.44620 1.00 
1 1 1 11  1  2  o 716.1796 5.364336 1390.264  140.2 12.24658       10.72867 0.99 
1 1 1 11  1  3  o 499.4727 3.714644 687.8088  125.9 1.190552       7.429288 0.98 
1 1 1 11  1  4  o 195.7462 2.161029 645.4440  14.0  -144.2812      4.322058 0.88 
1 1 1 11  1  5  o 352.3092 2.947299 710.6489  95.0  11.16504       5.894599 0.96 
1 1 1 11  1  6  o 303.7437 3.333747 187.1282  243.0 -64.88617      6.667494 0.74 
1 1 1 11  1  7  o 430.0034 4.009355 626.9313  307.5 3.619751       8.018710 0.97 
1 1 1 11  1  8  o 535.9923 4.774396 385.3669  30.5  30.07733       9.548792 0.98 
1 1 1 11  1  9  o 207.1060 2.576345 369.7822  329.5 54.61722       5.152690 0.89 
1 1 1 11  1  10 o 409.1750 4.287449 567.1706  57.4  18.14371       8.574898 0.97 
1 1 1 11  1  11 o 86.76386 2.943893 166.9881  290.7 22.65065       5.887786 0.19 
1 1 1 11  1  12 o 739.1462 8.168860 982.6216  238.6 8.620850       16.33772 0.99 
1 1 1 11  1  13 o 422.5256 4.168125 543.5683  19.9  10.33157       8.336250 0.97 
1 1 1 11  1  14 o 919.3636 9.822701 1137.831  331.8 1.750244       19.64540 0.99 
1 1 1 11  1  15 o 108.8493 3.412026 219.1454  26.2  -0.9037552     6.824051 0.63 
1 1 1 11  1  16 o 360.2059 4.074966 438.3413  50.3  32.41995       8.149933 0.97 
1 1 1 11  1  17 o 270.5888 4.015108 369.4322  153.7 -14.69885      8.030215 0.96 
1 1 1 11  1  18 o 154.3511 3.342043 266.8393  254.2 9.667404       6.684086 0.92 
1 1 1 11  1  19 o 192.2740 3.250274 209.1295  110.7 -28.66167      6.500548 0.95 
1 1 1 11  1  20 o 514.9261 5.475817 661.8962  347.4 -28.97311      10.95163 0.99 
1 1 1 11  1  21 o 134.9899 4.866518 144.5661  77.7  27.96652       9.733037 0.91 
1 1 1 11  1  22 o 146.4376 4.131929 157.1229  124.4 2.025284       8.263859 0.94 
1 1 1 11  1  23 o 121.2505 4.927758 212.5147  150.6 2.839462       9.855516 0.96 
1 1 1 11  1  24 o 34.22346 9.919091 31.81808  110.7 -12.84683      19.83818 0.26 
1 1 1 11  1  25 o 55.86999 10.01088 68.46793  202.6 19.07528       20.02175 0.77 
1 1 1 11  1  26 o 216.8404 5.459115 281.4356  50.2  1.945877       10.91823 0.99 
1 1 1 11  1  27 o 111.2033 6.581578 138.5753  180.6 5.470825       13.16316 0.94 
1 1 1 11  1  28 o 79.25200 10.17304 88.61073  38.4  10.41592       20.34608 0.87 
1 1 1 11  1  29 o 49.78673 12.87707 115.3512  290.7 -11.02534      25.75414 0.88 
1 1 1 11  1  30 o 47.16029 12.57957 65.87801  308.1 -13.10517      25.15913 0.81 
1 1 1 11  1  31 o 136.4274 7.271329 155.7056  189.9 23.76602       14.54266 0.98 
1 1 1 11  1  32 o 51.24452 12.36726 95.81876  310.2 -33.95853      24.73453 0.90 
1 1 1 11  3  0  o 264.5203 2.719804 728.3658  76.8  -108.6630      5.439608 0.94 
1 1 1 11  3  1  o 577.7351 5.236634 1040.117  167.7 40.76642       10.47327 0.99 
1 1 1 11  3  2  o 166.2385 2.493583 718.2734  53.5  73.46587       4.987166 0.85 
1 1 1 11  3  3  o 99.12248 2.390815 545.9766  50.2  -16.77672      4.781631 0.85 
1 1 1 11  3  4  o 413.6124 4.120857 388.4652  268.0 30.12714       8.241714 0.97 
1 1 1 11  3  5  o 182.8509 2.525395 133.3209  14.4  -47.32697      5.050790 0.65 
1 1 1 11  3  6  o 493.7961 3.899492 720.3082  332.3 -46.42239      7.798983 0.98 
1 1 1 11  3  7  f 612.0303 4.759789 1214.504  218.0 45.07440       9.519578 0.00 
1 1 1 11  3  8  o 294.8127 3.209854 481.5420  80.5  -23.30298      6.419708 0.94 
1 1 1 11  3  9  o 458.3423 4.075219 673.7875  64.9  -2.796265      8.150438 0.98 
1 1 1 11  3  10 f 557.5397 4.656248 956.4639  139.4 -13.56610      9.312496 0.00 
1 1 1 11  3  11 o 117.6833 2.774863 79.85419  219.8 11.11989       5.549726 0.40 
1 1 1 11  3  12 o 274.3912 2.763626 333.8997  304.2 13.97931       5.527251 0.91 
1 1 1 11  3  13 o 297.3641 3.391882 475.9362  46.8  -85.61604      6.783764 0.94 
1 1 1 11  3  14 o 217.0951 2.630022 280.8516  143.0 2.191269       5.260043 0.89 
1 1 1 11  3  15 o 396.7681 3.672603 555.2802  172.3 8.757141       7.345206 0.97 
1 1 1 11  3  16 o 193.5122 3.616627 259.8694  66.8  -16.52010      7.233253 0.91 
1 1 1 11  3  17 o 237.1559 3.236380 255.6731  179.1 -0.1976013E-01 6.472760 0.95 
1 1 1 11  3  18 o 95.51904 4.506138 183.9518  26.3  33.11658       9.012277 0.86 
1 1 1 11  3  19 o 179.4947 4.791754 236.7780  177.5 14.09555       9.583508 0.96 
1 1 1 11  3  20 o 154.0974 3.795777 258.4897  58.9  -23.29008      7.591555 0.96 
1 1 1 11  3  21 o 146.4806 4.004117 227.0262  53.8  -14.56129      8.008233 0.96 
1 1 1 11  3  22 o 158.7667 3.843448 156.6205  171.2 -10.20328      7.686896 0.96 
1 1 1 11  3  23 o 80.09818 6.238053 90.19043  87.5  -25.82174      12.47611 0.85 
1 1 1 11  3  24 o 241.1995 3.888881 279.7813  254.4 -14.65211      7.777763 0.99 
1 1 1 11  3  25 o 176.9348 4.498499 284.5681  131.7 11.09467       8.996998 0.99 
1 1 1 11  3  26 o 185.3542 4.903067 300.3064  84.3  -5.575974      9.806134 0.98 
1 1 1 11  3  27 o 158.2562 5.696517 183.6210  187.8 12.58942       11.39303 0.97 
1 1 1 11  3  28 f 142.6120 5.685597 190.0611  172.2 -38.53422      11.37119 0.00 
1 1 1 11  3  29 o 157.5855 5.787492 186.9775  126.8 -25.60619      11.57498 0.98 
1 1 1 11  3  30 o 62.02270 12.70339 125.4100  64.2  -3.779213      25.40677 0.93 
1 1 1 11  3  31 o 45.29890 13.72119 33.82960  178.6 -17.96321      27.44238 0.59 
1 1 1 11  3  32 o 45.92661 12.84033 72.34704  72.3  ?              ?        0.85 
1 1 1 11  5  0  o 396.9544 4.037670 562.0725  322.1 28.09940       8.075340 0.97 
1 1 1 11  5  1  o 408.2353 4.212405 786.0430  358.7 -20.00128      8.424809 0.98 
1 1 1 11  5  2  o 92.54935 2.511871 402.8009  253.0 23.53477       5.023741 0.51 
1 1 1 11  5  3  o 343.3278 3.825511 807.3548  149.7 74.87695       7.651023 0.97 
1 1 1 11  5  4  o 762.6392 7.092958 1308.847  229.7 19.81500       14.18592 0.99 
1 1 1 11  5  5  o 86.43519 2.832422 100.5403  314.1 -44.13940      5.664844 0.28 
1 1 1 11  5  6  o 770.2828 6.419925 811.5051  13.2  9.051208       12.83985 0.99 
1 1 1 11  5  7  o 189.4782 2.530563 319.3437  329.5 5.359039       5.061126 0.86 
1 1 1 11  5  8  o 511.5927 4.335783 780.9198  318.6 71.99097       8.671565 0.98 
1 1 1 11  5  9  o 474.0847 4.174356 617.3879  342.5 -26.02164      8.348713 0.98 
1 1 1 11  5  10 o 261.2665 3.136595 543.2458  77.8  29.45998       6.273189 0.95 
1 1 1 11  5  11 o 165.0648 2.686825 225.9508  230.1 -7.849945      5.373650 0.66 
1 1 1 11  5  12 o 144.9919 2.703605 173.1404  136.8 -45.97883      5.407210 0.69 
1 1 1 11  5  13 o 692.2214 5.615575 1001.780  251.1 -25.96411      11.23115 0.99 
1 1 1 11  5  14 o 561.7251 5.929803 754.6552  202.7 -1.994629      11.85961 0.99 
1 1 1 11  5  15 o 314.4711 3.101617 383.4862  151.2 4.770355       6.203234 0.97 
1 1 1 11  5  16 o 206.4083 2.863975 302.8943  100.3 -12.18625      5.727950 0.96 
1 1 1 11  5  17 o 205.6420 2.999686 346.5522  251.0 -18.93492      5.999373 0.98 
1 1 1 11  5  18 o 164.7404 3.050455 195.3351  168.8 -1.003433      6.100910 0.95 
1 1 1 11  5  19 o 107.0170 3.881141 186.6013  150.8 12.82525       7.762282 0.91 
1 1 1 11  5  20 o 74.26720 5.060380 138.6624  354.5 -2.374702      10.12076 0.87 
1 1 1 11  5  21 f 224.4463 3.481362 332.8910  31.5  -54.01477      6.962725 0.00 
1 1 1 11  5  22 o 48.32938 9.240565 25.55437  65.9  -2.346603      18.48113 0.29 
1 1 1 11  5  23 o 90.56709 5.569458 112.1860  231.9 -2.141235      11.13892 0.92 
1 1 1 11  5  24 o 51.54912 10.54716 75.68322  202.0 -8.459984      21.09431 0.77 
1 1 1 11  5  25 o 136.6968 4.836868 190.8031  170.4 34.49434       9.673736 0.96 
1 1 1 11  5  26 o 49.34913 9.297437 80.36982  191.3 26.60084       18.59487 0.74 
1 1 1 11  5  27 o 55.74960 12.03546 74.52713  330.2 -16.77790      24.07093 0.79 
1 1 1 11  5  28 f 56.27370 12.20875 109.5478  83.5  24.96465       24.41749 0.00 
1 1 1 11  5  29 o 68.88200 12.22742 107.6656  259.3 -18.02704      24.45484 0.93 
1 1 1 11  5  30 o 42.77891 12.19854 51.90517  228.3 9.130306       24.39709 0.74 
1 1 1 11  5  31 o 35.01044 11.53521 42.21576  168.7 ?              ?        0.65 
1 1 1 11  7  0  o 738.5995 6.431953 1085.233  31.2  -31.17450      12.86391 0.99 
1 1 1 11  7  1  o 130.0114 2.467393 373.4157  47.0  40.56587       4.934786 0.77 
1 1 1 11  7  2  o 368.9780 3.791981 649.8918  230.5 28.40491       7.583961 0.97 
1 1 1 11  7  3  o 431.2430 4.280122 805.1759  116.2 14.40372       8.560244 0.98 
1 1 1 11  7  4  o 479.4555 4.519858 709.2996  103.7 0.2001038      9.039716 0.98 
1 1 1 11  7  5  f 668.3489 5.947613 755.7005  39.8  2.168701       11.89523 0.00 
1 1 1 11  7  6  o 519.9967 4.843950 669.0367  50.8  -6.371399      9.687900 0.98 
1 1 1 11  7  7  o 161.7759 2.762626 229.6032  61.9  30.17519       5.525252 0.86 
1 1 1 11  7  8  f 53.60558 5.815230 180.8162  257.1 -37.13232      11.63046 0.00 
1 1 1 11  7  9  o 403.6561 3.755072 485.3461  35.3  -18.43292      7.510143 0.97 
1 1 1 11  7  10 o 248.4513 2.896241 204.0490  6.7   27.31253       5.792482 0.87 
1 1 1 11  7  11 o 180.6123 3.537135 371.6615  70.4  9.742126       7.074270 0.92 
1 1 1 11  7  12 o 194.2003 3.671680 466.7915  270.0 -43.70174      7.343360 0.96 
1 1 1 11  7  13 o 344.7923 4.401240 569.0687  335.3 -28.75610      8.802481 0.98 
1 1 1 11  7  14 o 160.1425 3.745351 223.8936  330.3 36.49265       7.490702 0.94 
1 1 1 11  7  15 o 374.4757 3.704429 572.2463  323.4 -7.954773      7.408857 0.99 
1 1 1 11  7  16 o 97.59380 4.071358 121.5853  18.6  28.02843       8.142716 0.83 
1 1 1 11  7  17 o 138.8885 3.264643 272.2238  236.3 -2.443939      6.529287 0.96 
1 1 1 11  7  18 o 175.5170 3.204399 226.5597  238.2 -17.54738      6.408798 0.97 
1 1 1 11  7  19 o 179.8595 3.380299 249.1056  157.1 10.81480       6.760598 0.98 
1 1 1 11  7  20 o 326.7047 3.500911 521.6112  79.2  -7.064087      7.001822 0.99 
1 1 1 11  7  21 o 78.21052 6.405231 94.29678  80.9  -14.77798      12.81046 0.89 
1 1 1 11  7  22 o 213.6301 3.819315 267.8942  213.3 1.887054       7.638630 0.99 
1 1 1 11  7  23 o 191.9001 4.295377 287.6175  284.9 -13.22208      8.590754 0.99 
1 1 1 11  7  24 o 201.5357 4.003954 281.2455  280.0 22.60934       8.007908 0.99 
1 1 1 11  7  25 o 43.66510 12.49521 70.96555  138.7 -8.927055      24.99043 0.68 
1 1 1 11  7  26 o 77.92851 9.196566 106.8949  61.5  -28.81654      18.39313 0.93 
1 1 1 11  7  27 o 64.50413 12.03984 111.7256  343.0 -9.010746      24.07969 0.93 
1 1 1 11  7  28 o 57.07783 11.71134 78.15393  218.1 -33.33348      23.42268 0.89 
1 1 1 11  7  29 o 31.78136 10.32620 74.55767  125.6 2.248930       20.65240 0.79 
1 1 1 11  7  30 o 35.24736 11.20476 17.45370  315.7 ?              ?        0.37 
1 1 1 11  9  0  o 292.8843 3.854057 486.4154  279.1 34.77518       7.708115 0.96 
1 1 1 11  9  1  o 435.8200 4.069100 577.2190  321.7 -54.86310      8.138200 0.98 
1 1 1 11  9  2  o 464.4394 4.352799 649.9182  215.1 19.28363       8.705598 0.98 
1 1 1 11  9  3  o 544.8506 5.918383 532.0530  207.9 -7.890564      11.83677 0.98 
1 1 1 11  9  4  o 475.2926 4.481100 644.8294  129.8 -22.28510      8.962200 0.98 
1 1 1 11  9  5  o 367.4694 3.753712 570.8219  70.4  -35.14127      7.507425 0.98 
1 1 1 11  9  6  f 311.8848 3.335733 612.1311  76.3  -26.25101      6.671465 0.00 
1 1 1 11  9  7  o 300.5474 3.346278 369.4942  338.9 -22.92545      6.692556 0.97 
1 1 1 11  9  8  o 183.0666 2.953487 268.4670  157.3 18.43703       5.906974 0.94 
1 1 1 11  9  9  o 231.3436 2.753627 277.5363  136.2 -13.37546      5.507254 0.96 
1 1 1 11  9  10 o 226.4300 2.846335 298.4979  303.3 11.50060       5.692669 0.97 
1 1 1 11  9  11 o 284.0271 2.972022 418.8383  244.8 1.361176       5.944045 0.99 
1 1 1 11  9  12 o 202.0568 3.909300 443.2155  85.5  -37.36031      7.818601 0.98 
1 1 1 11  9  13 o 154.9665 3.439169 175.7226  91.8  -27.38988      6.878339 0.94 
1 1 1 11  9  14 o 133.9644 4.489089 237.5902  95.2  -5.662903      8.978179 0.96 
1 1 1 11  9  15 o 135.8388 4.516461 130.5130  319.7 18.33641       9.032922 0.93 
1 1 1 11  9  16 o 160.4847 4.328596 197.6533  217.2 33.34361       8.657191 0.97 
1 1 1 11  9  17 o 103.6946 5.734764 155.5287  136.3 -4.626724      11.46953 0.94 
1 1 1 11  9  18 o 169.2798 4.757724 256.5412  231.8 36.44193       9.515448 0.98 
1 1 1 11  9  19 o 188.9093 4.391312 198.6824  233.3 15.38571       8.782623 0.98 
1 1 1 11  9  20 o 69.14384 9.343216 172.1626  98.3  -8.219978      18.68643 0.94 
1 1 1 11  9  21 o 195.4865 3.913599 192.6969  345.3 13.57639       7.827198 0.98 
1 1 1 11  9  22 o 78.28710 7.820590 63.57278  340.4 4.552597       15.64118 0.82 
1 1 1 11  9  23 o 43.34226 10.49598 5.967517  277.1 22.01765       20.99196 0.09 
1 1 1 11  9  24 o 70.71944 10.55050 40.79082  244.6 -6.382454      21.10100 0.77 
1 1 1 11  9  25 o 35.18525 10.96618 60.48266  33.6  1.912014       21.93235 0.73 
1 1 1 11  9  26 o 113.9937 9.623960 181.3710  103.1 -4.495872      19.24792 0.98 
1 1 1 11  9  27 o 36.06620 11.52723 67.83228  84.4  -9.601860      23.05446 0.79 
1 1 1 11  9  28 o 33.10836 10.82976 30.14970  198.9 ?              ?        0.54 
1 1 1 11  11 0  o 235.6959 3.149405 352.8198  235.5 22.08022       6.298810 0.98 
1 1 1 11  11 1  o 399.7640 4.056503 608.7856  143.7 38.12399       8.113006 0.99 
1 1 1 11  11 2  o 143.9047 3.584994 212.7887  19.4  -9.697311      7.169988 0.95 
1 1 1 11  11 3  o 233.5820 3.194949 261.9236  95.3  5.507797       6.389897 0.98 
1 1 1 11  11 4  o 141.7929 3.262212 234.7614  165.0 -19.78722      6.524425 0.95 
1 1 1 11  11 5  o 56.26994 5.564959 98.43111  163.0 -11.26007      11.12992 0.68 
1 1 1 11  11 6  o 62.44101 5.284637 148.4730  0.7   -9.612297      10.56927 0.81 
1 1 1 11  11 7  o 155.8119 3.174960 231.8204  72.1  23.59476       6.349919 0.96 
1 1 1 11  11 8  o 97.42168 3.706143 191.4236  257.4 -12.04086      7.412285 0.92 
1 1 1 11  11 9  o 195.6559 2.900749 240.5271  301.0 5.904877       5.801498 0.97 
1 1 1 11  11 10 o 90.44003 3.499734 69.00790  175.2 -0.7622528     6.999468 0.80 
1 1 1 11  11 11 o 150.1856 2.662864 249.5367  37.8  52.07165       5.325728 0.98 
1 1 1 11  11 12 o 57.12009 5.271026 51.55422  227.9 -32.44349      10.54205 0.63 
1 1 1 11  11 13 o 127.9612 4.695759 194.6642  238.6 -8.166710      9.391518 0.97 
1 1 1 11  11 14 o 103.2922 5.897185 171.8662  234.7 -3.208168      11.79437 0.96 
1 1 1 11  11 15 o 120.2823 5.693151 162.1533  325.4 -14.33659      11.38630 0.97 
1 1 1 11  11 16 f 197.1365 4.914950 334.4510  358.3 28.68695       9.829900 0.00 
1 1 1 11  11 17 o 110.3928 6.176506 150.4241  271.0 -2.512985      12.35301 0.96 
1 1 1 11  11 18 o 32.42929 10.01555 73.51244  303.4 3.315022       20.03110 0.57 
1 1 1 11  11 19 o 36.79392 11.33288 75.13450  288.4 -11.36843      22.66576 0.65 
1 1 1 11  11 20 o 77.67798 10.57663 96.12463  295.2 -38.51112      21.15325 0.90 
1 1 1 11  11 21 o 47.09561 10.76462 81.32717  286.2 21.30746       21.52924 0.83 
1 1 1 11  11 22 f 58.72852 12.55011 81.21313  273.3 13.72752       25.10023 0.00 
1 1 1 11  11 23 o 43.99680 12.88047 53.48711  124.1 -28.34189      25.76093 0.77 
1 1 1 11  11 24 o 67.93909 13.49236 85.96621  174.4 -6.721153      26.98473 0.91 
1 1 1 11  11 25 o 52.05378 12.88340 132.0686  213.7 9.870659       25.76679 0.93 
1 1 1 11  11 26 o 85.41754 12.16617 137.7368  146.5 ?              ?        0.97 
1 1 1 11  13 0  o 167.8307 5.039391 271.4977  10.2  4.902771       10.07878 0.98 
1 1 1 11  13 1  o 198.0298 3.936974 300.2142  210.7 24.77525       7.873949 0.99 
1 1 1 11  13 2  o 238.4954 3.312290 417.8652  226.0 38.07155       6.624580 0.99 
1 1 1 11  13 3  o 38.52389 9.015725 48.38074  188.3 7.726593       18.03145 0.47 
1 1 1 11  13 4  o 113.1296 4.195348 187.3676  191.1 -11.00454      8.390696 0.96 
1 1 1 11  13 5  o 158.6949 3.320045 328.1100  143.7 16.07869       6.640090 0.98 
1 1 1 11  13 6  o 149.6222 3.657514 234.2589  25.0  -17.87042      7.315028 0.98 
1 1 1 11  13 7  o 110.0659 4.186122 162.4903  215.5 12.74717       8.372244 0.96 
1 1 1 11  13 8  o 33.89463 9.090724 100.1225  263.6 -1.121174      18.18145 0.76 
1 1 1 11  13 9  o 72.69984 6.056746 122.7091  10.4  -18.87496      12.11349 0.93 
1 1 1 11  13 10 o 95.86307 4.166913 149.7309  114.4 17.97646       8.333826 0.97 
1 1 1 11  13 11 o 110.8473 3.536471 220.9471  184.0 11.13966       7.072941 0.98 
1 1 1 11  13 12 o 79.53922 3.996060 182.6280  100.9 -2.262390      7.992119 0.95 
1 1 1 11  13 13 o 71.11066 9.738176 130.2315  24.7  11.06787       19.47635 0.91 
1 1 1 11  13 14 o 184.5552 4.810333 258.8659  74.0  -9.407501      9.620666 0.99 
1 1 1 11  13 15 o 55.75029 10.62770 129.5674  95.7  -2.679722      21.25539 0.90 
1 1 1 11  13 16 o 53.35207 9.548586 50.55581  73.4  22.04589       19.09717 0.73 
1 1 1 11  13 17 o 99.24066 7.844862 143.0373  112.6 -4.317863      15.68972 0.97 
1 1 1 11  13 18 o 48.00738 11.81455 62.64811  137.0 -23.04014      23.62909 0.82 
1 1 1 11  13 19 o 56.82483 10.16274 112.3170  86.7  18.31134       20.32549 0.94 
1 1 1 11  13 20 o 44.40038 11.05321 101.9711  101.6 8.493450       22.10641 0.90 
1 1 1 11  13 21 o 75.79756 11.99950 121.2080  69.7  15.05109       23.99899 0.95 
1 1 1 11  13 22 o 46.69985 12.26791 69.76642  110.7 ?              ?        0.87 
1 1 1 11  13 23 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 11  15 0  o 140.4699 3.961242 238.5706  22.7  10.89934       7.922485 0.98 
1 1 1 11  15 1  o 100.7068 5.252931 156.5502  328.1 19.59535       10.50586 0.96 
1 1 1 11  15 2  o 44.83181 10.93101 15.65574  353.0 21.72594       21.86202 0.22 
1 1 1 11  15 3  o 123.1905 4.947149 200.5514  315.2 15.73499       9.894299 0.97 
1 1 1 11  15 4  o 55.74326 9.018944 83.34543  319.7 33.79824       18.03789 0.83 
1 1 1 11  15 5  o 135.2884 4.749825 230.6285  118.1 5.724319       9.499650 0.98 
1 1 1 11  15 6  o 143.0164 4.707770 208.3845  123.9 -9.247803      9.415540 0.98 
1 1 1 11  15 7  o 74.84811 7.994630 113.4025  130.7 -19.44297      15.98926 0.92 
1 1 1 11  15 8  o 124.5579 4.933290 202.2012  166.5 -16.85278      9.866580 0.98 
1 1 1 11  15 9  o 38.98360 10.54473 81.90379  211.6 3.465069       21.08945 0.78 
1 1 1 11  15 10 o 45.20942 9.055893 125.4046  232.6 -25.40428      18.11179 0.90 
1 1 1 11  15 11 o 111.8364 3.921020 141.5715  130.4 -16.03291      7.842039 0.97 
1 1 1 11  15 12 o 35.68635 8.705647 31.77544  26.2  6.618950       17.41129 0.56 
1 1 1 11  15 13 o 111.9007 9.748383 202.3690  243.3 13.19274       19.49677 0.98 
1 1 1 11  15 14 o 56.36590 12.08236 88.57329  193.3 2.361614       24.16473 0.91 
1 1 1 11  15 15 o 36.62688 12.26683 88.86736  102.1 -4.490509      24.53366 0.86 
1 1 1 11  15 16 o 42.84996 19.53962 125.7580  94.8  ?              ?        0.87 
1 1 1 11  15 17 o 35.10870 11.94185 83.21488  290.4 10.48825       23.88371 0.85 
1 1 1 11  15 18 o 34.50061 11.94112 46.93135  171.1 ?              ?        0.73 
1 1 1 11  17 0  o 49.34762 11.04932 96.22608  266.6 25.12271       22.09863 0.92 
1 1 1 11  17 1  o 70.68703 7.724922 118.5163  305.2 23.90735       15.44984 0.96 
1 1 1 11  17 2  o 47.70523 9.955009 148.4220  112.1 -20.18053      19.91002 0.95 
1 1 1 11  17 3  o 238.2845 4.201326 452.2237  103.3 -11.00342      8.402652 1.00 
1 1 1 11  17 4  o 127.2339 10.48390 264.9338  88.8  12.53040       20.96780 0.99 
1 1 1 11  17 5  o 33.54563 10.48901 24.36810  161.9 1.159622       20.97802 0.49 
1 1 1 11  17 6  o 39.54121 11.04296 106.0443  303.2 -7.390934      22.08592 0.90 
1 1 1 11  17 7  o 80.59601 9.458549 171.8868  265.2 -10.65865      18.91710 0.97 
1 1 1 11  17 8  o 35.40224 10.20060 24.33550  230.0 -17.37907      20.40120 0.51 
1 1 1 11  17 9  o 35.14721 10.50128 112.5067  31.3  -2.714966      21.00257 0.91 
1 1 1 11  17 10 o 44.32023 9.568191 100.7715  44.6  -27.51109      19.13638 0.93 
1 1 1 11  17 11 f 29.13648 8.823833 31.84523  37.6  ?              ?        0.00 
1 1 1 11  17 12 x ?        ?        118.4530  83.8  ?              ?        0.00 
1 1 1 12  0  0  o 570.2241 6.927864 1474.328  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  1  o 61.44828 3.202835 306.2327  180.0 0.000000       0.000000 0.24 
1 1 1 12  0  2  o 548.2858 5.646688 588.2195  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  3  o 291.3333 3.664910 619.2712  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  4  o 90.65906 2.358140 322.3039  180.0 0.000000       0.000000 0.61 
1 1 1 12  0  5  o 102.0725 2.705496 131.5087  180.0 0.000000       0.000000 0.71 
1 1 1 12  0  6  o 41.85886 4.556849 399.5917  0.0   0.000000       0.000000 0.11 
1 1 1 12  0  7  o 597.7821 6.965518 1376.393  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  8  o 496.4684 5.716714 632.7997  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  9  o 377.2918 5.755152 597.0075  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  10 o 164.2900 3.848532 442.7743  0.0   0.000000       0.000000 0.82 
1 1 1 12  0  11 o 682.2665 8.907396 1061.115  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  12 o 79.29920 4.517170 294.2518  180.0 0.000000       0.000000 0.20 
1 1 1 12  0  13 o 292.0562 4.814739 250.8672  0.0   0.000000       0.000000 0.99 
1 1 1 12  0  14 o 239.4694 5.093619 313.2827  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  15 o 458.1446 6.487197 541.2117  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  16 o 432.5891 6.376988 602.6195  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  17 o 174.7883 4.586812 240.5508  180.0 0.000000       0.000000 0.99 
1 1 1 12  0  18 o 182.8589 4.627460 317.7090  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  19 o 428.9666 6.472478 673.8986  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  20 o 231.5309 5.153387 271.5296  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  21 o 330.7228 5.893949 467.6454  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  22 o 83.30521 8.038818 62.87918  180.0 0.000000       0.000000 0.80 
1 1 1 12  0  23 o 184.4680 5.798603 306.3508  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  24 o 194.9523 5.897337 252.1191  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  25 o 269.5916 5.911937 310.8953  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  26 o 218.2874 6.696287 276.2223  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  27 o 167.2712 7.207311 145.6259  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  28 o 45.49901 21.30056 8.752270  180.0 0.000000       0.000000 0.11 
1 1 1 12  0  29 o 25.12560 16.61481 32.37840  180.0 0.000000       0.000000 0.32 
1 1 1 12  0  30 o 99.67912 12.83342 148.0657  0.0   0.000000       0.000000 1.00 
1 1 1 12  0  31 o 154.8027 10.02614 146.3086  180.0 0.000000       0.000000 1.00 
1 1 1 12  0  32 o 22.88054 16.23131 0.9516066 0.0   ?              ?        0.01 
1 1 1 12  2  0  o 1176.034 8.419499 1759.313  354.3 -128.5300      16.83900 1.00 
1 1 1 12  2  1  o 259.2374 2.802444 1430.888  268.6 9.536667       5.604889 0.95 
1 1 1 12  2  2  o 770.0150 5.884247 949.3044  126.4 -24.77472      11.76849 0.99 
1 1 1 12  2  3  f 559.7943 4.611486 180.9520  18.1  -20.06879      9.222972 0.00 
1 1 1 12  2  4  o 510.8015 3.997197 923.2003  331.1 -36.32849      7.994394 0.99 
1 1 1 12  2  5  f 313.1959 3.062176 545.6414  54.9  -6.975464      6.124351 0.00 
1 1 1 12  2  6  o 228.0993 2.410503 324.8678  293.8 25.17529       4.821006 0.92 
1 1 1 12  2  7  o 440.6470 3.628161 544.0399  50.2  -47.48755      7.256321 0.97 
1 1 1 12  2  8  o 345.6058 3.363658 206.3892  334.0 -4.482880      6.727315 0.93 
1 1 1 12  2  9  o 333.0196 3.311950 893.6202  334.9 26.61639       6.623900 0.97 
1 1 1 12  2  10 o 597.1580 5.132942 891.1989  106.3 -8.551392      10.26588 0.99 
1 1 1 12  2  11 o 319.4288 3.275199 440.4860  301.7 -17.69852      6.550397 0.94 
1 1 1 12  2  12 o 572.3984 4.908070 945.5124  196.0 -61.03821      9.816139 0.99 
1 1 1 12  2  13 o 295.1529 3.037920 251.9233  41.1  -20.52588      6.075841 0.91 
1 1 1 12  2  14 o 367.6239 3.797378 423.8482  103.5 -13.40564      7.594756 0.96 
1 1 1 12  2  15 o 586.3800 5.562312 776.7455  75.6  5.737000       11.12462 0.99 
1 1 1 12  2  16 o 470.6949 4.542780 592.4396  113.5 12.59192       9.085561 0.98 
1 1 1 12  2  17 o 633.0707 8.120707 901.3947  159.8 ?              ?        0.99 
1 1 1 12  2  18 o 201.8789 3.202930 276.3486  13.2  78.54105       6.405861 0.95 
1 1 1 12  2  19 o 316.1002 3.730597 490.5122  70.0  1.956177       7.461193 0.99 
1 1 1 12  2  20 o 171.8143 3.683952 287.7832  44.8  -19.16357      7.367903 0.96 
1 1 1 12  2  21 o 39.20280 8.462616 56.76427  123.0 30.50064       16.92523 0.33 
1 1 1 12  2  22 o 264.5407 5.193637 394.6655  75.3  43.55226       10.38727 0.99 
1 1 1 12  2  23 o 186.6299 4.020922 203.5756  35.4  -15.72717      8.041844 0.97 
1 1 1 12  2  24 o 219.6892 4.218198 377.7824  260.6 -20.59232      8.436397 0.99 
1 1 1 12  2  25 o 94.51432 6.769277 140.6818  277.8 26.23505       13.53855 0.95 
1 1 1 12  2  26 o 193.3298 4.764849 230.2114  93.6  -8.061371      9.529697 0.98 
1 1 1 12  2  27 o 162.2314 4.945450 198.0916  87.5  -5.228729      9.890901 0.97 
1 1 1 12  2  28 f 53.15199 11.38273 37.97033  356.2 -26.21268      22.76547 0.00 
1 1 1 12  2  29 o 181.5500 5.518642 235.4009  222.9 9.993286       11.03728 0.99 
1 1 1 12  2  30 o 36.23367 11.48287 16.58759  15.6  -10.72233      22.96575 0.30 
1 1 1 12  2  31 o 43.72936 12.19955 25.61571  42.3  -24.53625      24.39911 0.49 
1 1 1 12  2  32 o 45.45103 13.10885 20.74794  173.7 ?              ?        0.46 
1 1 1 12  4  0  o 255.6892 3.089665 376.8401  25.0  47.23523       6.179330 0.94 
1 1 1 12  4  1  o 293.5618 3.282222 613.2123  120.8 -27.86359      6.564444 0.94 
1 1 1 12  4  2  f 269.6473 3.464511 277.5866  339.1 63.49318       6.929022 0.00 
1 1 1 12  4  3  o 168.8347 2.701410 420.6890  205.3 -52.80186      5.402821 0.81 
1 1 1 12  4  4  o 467.2960 4.797334 708.1764  166.4 22.62048       9.594668 0.98 
1 1 1 12  4  5  o 567.2785 4.988939 932.5776  338.9 11.36292       9.977878 0.99 
1 1 1 12  4  6  o 702.9341 5.993735 942.0868  9.5   28.06494       11.98747 0.99 
1 1 1 12  4  7  o 690.0759 5.799104 1057.145  161.4 -40.36249      11.59821 0.99 
1 1 1 12  4  8  o 154.8547 2.258999 188.5065  135.8 -74.13890      4.517999 0.68 
1 1 1 12  4  9  o 324.0589 3.296313 499.7484  355.2 1.750671       6.592625 0.96 
1 1 1 12  4  10 o 308.8730 3.470138 486.2142  234.5 -20.45090      6.940277 0.95 
1 1 1 12  4  11 o 375.5348 3.779114 334.7864  317.4 -45.05292      7.558228 0.95 
1 1 1 12  4  12 o 509.0883 4.299354 728.3614  60.1  22.20813       8.598707 0.98 
1 1 1 12  4  13 o 335.8005 4.181028 378.9138  97.7  3.815460       8.362057 0.95 
1 1 1 12  4  14 o 78.43076 4.043240 63.40002  25.7  -25.72131      8.086479 0.26 
1 1 1 12  4  15 o 41.31361 6.361166 59.37866  277.1 29.17692       12.72233 0.15 
1 1 1 12  4  16 o 179.3563 3.119302 249.8590  149.6 -20.79405      6.238603 0.92 
1 1 1 12  4  17 o 110.8060 3.706311 215.5356  215.7 25.75071       7.412623 0.89 
1 1 1 12  4  18 o 102.6857 3.881903 71.38487  330.6 14.90660       7.763806 0.71 
1 1 1 12  4  19 o 51.87266 6.766453 50.58878  75.1  3.892262       13.53291 0.36 
1 1 1 12  4  20 o 135.4716 3.504430 175.5246  36.8  -9.217346      7.008860 0.94 
1 1 1 12  4  21 o 218.1361 3.371078 300.8190  80.4  9.972351       6.742156 0.98 
1 1 1 12  4  22 o 177.3128 3.812117 261.6036  79.5  20.17039       7.624235 0.98 
1 1 1 12  4  23 o 90.32183 7.249763 149.9398  49.5  -3.780655      14.49953 0.93 
1 1 1 12  4  24 o 195.9920 3.979451 287.3769  170.6 -30.57570      7.958902 0.99 
1 1 1 12  4  25 o 487.7635 5.436215 648.4684  144.0 16.39893       10.87243 1.00 
1 1 1 12  4  26 o 202.7138 5.022738 255.6539  142.7 -15.19640      10.04548 0.98 
1 1 1 12  4  27 o 101.8266 7.748771 175.6893  150.1 36.02411       15.49754 0.96 
1 1 1 12  4  28 o 199.5375 4.857502 236.9434  102.9 2.505676       9.715003 0.99 
1 1 1 12  4  29 o 143.0511 6.579906 228.7652  76.7  -14.27269      13.15981 0.99 
1 1 1 12  4  30 o 77.66855 12.02722 104.4517  10.5  14.39132       24.05443 0.94 
1 1 1 12  4  31 o 49.06245 13.64575 107.4112  186.6 4.677441       27.29150 0.90 
1 1 1 12  6  0  o 292.3135 3.255917 600.1786  30.5  -91.12027      6.511835 0.95 
1 1 1 12  6  1  o 209.0767 3.701109 529.8204  92.6  ?              ?        0.90 
1 1 1 12  6  2  o 514.7501 5.018062 689.6345  200.9 45.69400       10.03612 0.98 
1 1 1 12  6  3  o 144.8853 2.571438 309.9076  84.9  -62.66133      5.142876 0.81 
1 1 1 12  6  4  o 302.2145 3.434666 479.0141  352.1 67.41580       6.869332 0.93 
1 1 1 12  6  5  o 723.9025 6.589324 994.1904  170.2 19.42590       13.17865 0.99 
1 1 1 12  6  6  o 556.8108 5.990210 763.0029  156.5 19.36420       11.98042 0.98 
1 1 1 12  6  7  o 282.5726 2.941533 452.5666  27.0  -4.856079      5.883067 0.95 
1 1 1 12  6  8  o 658.5442 5.488830 900.8052  313.8 46.50122       10.97766 0.99 
1 1 1 12  6  9  o 214.2046 2.629419 364.0386  181.0 -5.265656      5.258838 0.89 
1 1 1 12  6  10 o 553.8505 4.578320 650.4887  187.0 24.46570       9.156639 0.98 
1 1 1 12  6  11 o 240.1913 3.679928 527.7811  97.0  -1.663849      7.359855 0.95 
1 1 1 12  6  12 o 491.9120 4.392137 786.0675  65.7  4.422607       8.784274 0.99 
1 1 1 12  6  13 o 513.8301 4.608134 938.7928  317.4 -10.21155      9.216268 0.99 
1 1 1 12  6  14 o 256.3430 2.858169 417.7786  261.0 1.614609       5.716337 0.97 
1 1 1 12  6  15 o 52.47977 6.639770 127.4270  41.4  39.72292       13.27954 0.57 
1 1 1 12  6  16 o 48.80939 7.831934 82.85493  75.0  -14.81083      15.66387 0.51 
1 1 1 12  6  17 o 171.4629 3.180130 170.8222  347.1 -0.2677002     6.360260 0.94 
1 1 1 12  6  18 o 189.3415 3.324994 369.3644  64.9  18.65622       6.649987 0.98 
1 1 1 12  6  19 o 68.83160 7.640033 133.1071  68.4  25.45802       15.28007 0.86 
1 1 1 12  6  20 o 78.63461 6.474939 151.7378  354.4 30.93122       12.94988 0.91 
1 1 1 12  6  21 f 87.03444 5.713513 199.5563  146.5 24.76331       11.42703 0.00 
1 1 1 12  6  22 o 103.4840 6.532448 150.8791  189.3 9.242477       13.06490 0.95 
1 1 1 12  6  23 o 194.9666 3.722964 226.6394  279.8 -21.87253      7.445927 0.98 
1 1 1 12  6  24 o 192.5121 4.071731 270.3123  289.0 0.1732941      8.143461 0.98 
1 1 1 12  6  25 o 107.7453 6.677955 118.4544  301.3 -9.128380      13.35591 0.93 
1 1 1 12  6  26 o 128.1051 5.643455 169.0662  319.3 15.62254       11.28691 0.97 
1 1 1 12  6  27 o 43.14537 10.56344 84.69414  6.8   17.71652       21.12689 0.83 
1 1 1 12  6  28 o 87.44934 8.700798 129.2745  163.6 -41.44170      17.40160 0.96 
1 1 1 12  6  29 f 69.82610 10.94866 85.24929  238.5 -24.76365      21.89731 0.00 
1 1 1 12  6  30 o 38.62361 11.46456 78.32295  23.8  4.877907       22.92912 0.84 
1 1 1 12  8  0  o 412.8832 3.974551 667.2367  201.5 -20.09384      7.949103 0.98 
1 1 1 12  8  1  o 184.0937 2.735922 394.1259  46.6  49.35699       5.471845 0.91 
1 1 1 12  8  2  o 298.0301 3.240422 288.1459  279.4 -20.95068      6.480843 0.94 
1 1 1 12  8  3  o 658.4833 5.800195 972.3431  271.2 3.572815       11.60039 0.99 
1 1 1 12  8  4  f 473.7185 4.618209 534.4704  258.5 -33.24194      9.236419 0.00 
1 1 1 12  8  5  f 506.6578 4.793774 747.7949  319.7 11.17795       9.587548 0.00 
1 1 1 12  8  6  o 64.90904 4.304696 79.72501  221.8 -7.932785      8.609392 0.29 
1 1 1 12  8  7  o 315.1348 3.435334 620.7982  252.3 -48.62927      6.870668 0.97 
1 1 1 12  8  8  f 256.7477 2.858753 524.6760  213.9 -22.11829      5.717507 0.00 
1 1 1 12  8  9  o 397.0042 3.750103 453.2583  343.1 25.02554       7.500206 0.98 
1 1 1 12  8  10 o 236.0709 2.922228 363.9110  102.2 -4.368637      5.844457 0.96 
1 1 1 12  8  11 o 260.0167 2.848614 503.9841  170.3 -15.16504      5.697227 0.98 
1 1 1 12  8  12 o 108.8469 5.123879 175.7486  51.9  9.099205       10.24776 0.89 
1 1 1 12  8  13 o 157.4493 3.547038 232.5625  264.1 -13.56465      7.094076 0.96 
1 1 1 12  8  14 o 132.7741 4.282531 223.8691  90.6  12.51257       8.565062 0.95 
1 1 1 12  8  15 o 258.7484 4.127228 358.8080  5.1   -0.4040527     8.254457 0.98 
1 1 1 12  8  16 o 37.88727 9.753430 58.06800  337.1 0.5563812      19.50686 0.38 
1 1 1 12  8  17 o 113.2667 5.224326 113.7598  301.7 4.094887       10.44865 0.92 
1 1 1 12  8  18 o 69.87492 7.828924 118.4580  208.0 53.42130       15.65785 0.87 
1 1 1 12  8  19 o 92.20016 5.578312 121.7692  263.3 -25.59090      11.15662 0.92 
1 1 1 12  8  20 o 116.3437 5.485242 206.0495  24.3  14.72118       10.97048 0.97 
1 1 1 12  8  21 o 38.76546 10.49369 71.96046  261.9 -1.789368      20.98738 0.68 
1 1 1 12  8  22 o 50.12351 10.74349 119.5715  237.8 14.51641       21.48699 0.82 
1 1 1 12  8  23 o 161.5619 4.425545 191.5897  17.5  -24.25609      8.851089 0.97 
1 1 1 12  8  24 o 143.8151 5.640751 181.4222  347.8 -12.57458      11.28150 0.97 
1 1 1 12  8  25 o 86.31358 8.149249 123.9685  61.8  -9.364616      16.29850 0.95 
1 1 1 12  8  26 o 165.6380 4.989555 218.5440  100.1 16.28093       9.979111 0.99 
1 1 1 12  8  27 o 83.58101 10.27855 103.6350  36.5  15.82668       20.55710 0.95 
1 1 1 12  8  28 o 43.76565 12.41335 88.69743  332.7 1.954144       24.82670 0.87 
1 1 1 12  8  29 o 43.50573 12.30858 85.20235  48.3  ?              ?        0.88 
1 1 1 12  10 0  o 444.5766 4.186797 650.2159  295.3 15.58893       8.373593 0.99 
1 1 1 12  10 1  o 112.3357 3.114727 140.1991  143.9 37.12550       6.229454 0.76 
1 1 1 12  10 2  o 314.9254 3.455073 484.8969  298.9 -16.72934      6.910146 0.98 
1 1 1 12  10 3  o 275.5182 3.858144 408.0032  354.1 -10.34320      7.716287 0.97 
1 1 1 12  10 4  o 91.84354 4.092231 151.4606  116.0 22.60272       8.184462 0.77 
1 1 1 12  10 5  o 79.52704 3.841944 134.8174  14.3  -42.63377      7.683887 0.75 
1 1 1 12  10 6  f 161.3832 2.915936 201.1747  275.8 -44.30330      5.831873 0.00 
1 1 1 12  10 7  o 174.2982 2.902474 284.0817  347.9 -15.20580      5.804947 0.97 
1 1 1 12  10 8  o 202.6949 2.942863 426.2901  341.8 -23.26869      5.885725 0.98 
1 1 1 12  10 9  o 116.1592 2.724492 94.66335  106.1 -20.89767      5.448983 0.86 
1 1 1 12  10 10 o 201.3104 2.685281 328.5729  300.3 -1.639694      5.370562 0.98 
1 1 1 12  10 11 o 248.1620 2.915369 474.5469  255.0 -12.80717      5.830739 0.99 
1 1 1 12  10 12 o 164.5245 2.793933 280.7615  238.8 1.327042       5.587866 0.97 
1 1 1 12  10 13 o 216.9104 4.043887 287.6925  139.6 31.50105       8.087774 0.98 
1 1 1 12  10 14 f 70.21558 9.562658 146.2296  98.6  -1.196266      19.12532 0.00 
1 1 1 12  10 15 o 52.80146 8.481366 105.0386  321.9 31.32058       16.96273 0.81 
1 1 1 12  10 16 o 29.29481 9.642858 43.82267  7.5   -12.30172      19.28572 0.36 
1 1 1 12  10 17 o 187.2930 4.135345 233.8303  132.6 5.161102       8.270691 0.99 
1 1 1 12  10 18 o 46.03156 11.26681 38.40649  115.3 -15.39772      22.53362 0.52 
1 1 1 12  10 19 o 59.79730 10.59144 99.97112  89.8  -21.95933      21.18289 0.84 
1 1 1 12  10 20 o 175.2907 5.287804 292.6240  129.8 -13.50995      10.57561 0.98 
1 1 1 12  10 21 o 48.05785 11.87414 77.90386  185.6 -11.62574      23.74828 0.76 
1 1 1 12  10 22 f 49.01791 10.94607 19.90830  305.5 22.72667       21.89214 0.00 
1 1 1 12  10 23 o 46.25668 12.00728 62.51118  165.5 -14.34403      24.01457 0.79 
1 1 1 12  10 24 f 42.22731 12.66864 48.92206  163.9 0.9340668      25.33729 0.00 
1 1 1 12  10 25 o 94.90968 7.723825 116.1268  250.4 -2.132240      15.44765 0.96 
1 1 1 12  10 26 o 53.58149 12.31612 92.75759  215.0 24.94790       24.63224 0.91 
1 1 1 12  10 27 o 55.17858 12.98471 130.8014  324.4 ?              ?        0.94 
1 1 1 12  12 0  o 138.3767 3.254221 242.9666  207.7 21.80732       6.508442 0.96 
1 1 1 12  12 1  o 173.4798 4.409282 308.9019  123.9 ?              ?        0.97 
1 1 1 12  12 2  o 184.5198 3.600922 346.2971  334.6 -16.12039      7.201843 0.98 
1 1 1 12  12 3  o 188.1640 3.063245 349.1667  275.6 34.38077       6.126489 0.98 
1 1 1 12  12 4  o 84.49252 4.361261 165.6914  186.6 -1.720642      8.722523 0.91 
1 1 1 12  12 5  o 158.1975 3.581699 289.0343  161.1 -5.235901      7.163399 0.98 
1 1 1 12  12 6  o 206.2382 3.340717 292.8649  34.8  -37.50056      6.681435 0.98 
1 1 1 12  12 7  o 131.4947 3.831012 234.7190  186.3 27.27838       7.662025 0.97 
1 1 1 12  12 8  f 192.8535 3.289748 284.1168  135.3 6.441528       6.579496 0.00 
1 1 1 12  12 9  o 111.9319 3.820131 148.3501  60.0  -12.37756      7.640261 0.95 
1 1 1 12  12 10 o 114.1899 3.609336 181.8855  26.0  21.85744       7.218672 0.96 
1 1 1 12  12 11 o 193.6691 2.982627 346.7424  306.5 -10.90630      5.965253 0.99 
1 1 1 12  12 12 o 206.8802 2.909588 270.3455  314.9 -12.16176      5.819176 0.99 
1 1 1 12  12 13 o 28.33592 9.323484 19.02452  2.1   -16.15951      18.64697 0.23 
1 1 1 12  12 14 f 156.5371 5.419243 287.2349  121.4 -19.96915      10.83849 0.00 
1 1 1 12  12 15 o 55.20903 9.962196 157.6266  143.0 11.43077       19.92439 0.90 
1 1 1 12  12 16 o 137.2101 5.356463 216.3058  248.6 -5.463394      10.71293 0.98 
1 1 1 12  12 17 o 68.78291 10.80417 114.7107  264.6 -3.021500      21.60834 0.90 
1 1 1 12  12 18 f 129.4201 5.669357 189.5238  260.4 -33.56080      11.33871 0.00 
1 1 1 12  12 19 o 35.13336 11.41740 66.40390  177.6 -24.76509      22.83480 0.72 
1 1 1 12  12 20 o 76.74411 10.99438 79.70927  112.2 -32.12376      21.98877 0.92 
1 1 1 12  12 21 o 76.25159 11.99588 101.0426  12.4  31.69157       23.99176 0.94 
1 1 1 12  12 22 o 80.59756 11.30972 132.5639  276.1 -2.938904      22.61944 0.96 
1 1 1 12  12 23 o 42.80199 13.01806 37.69880  205.8 -28.36758      26.03612 0.67 
1 1 1 12  12 24 o 42.71018 12.58891 39.88360  41.6  ?              ?        0.72 
1 1 1 12  14 0  o 99.53133 4.919816 190.7994  105.5 37.87452       9.839632 0.97 
1 1 1 12  14 1  o 53.05284 8.180555 122.2526  248.0 -16.73934      16.36111 0.90 
1 1 1 12  14 2  o 93.78661 5.494941 161.4289  218.3 19.23452       10.98988 0.96 
1 1 1 12  14 3  o 65.27144 6.971117 119.3032  180.7 -10.25062      13.94223 0.93 
1 1 1 12  14 4  o 106.9727 5.195199 177.2362  223.9 -32.33657      10.39040 0.97 
1 1 1 12  14 5  o 84.73282 6.130768 103.5111  155.2 -16.06155      12.26154 0.94 
1 1 1 12  14 6  o 99.90097 7.489397 80.37032  359.7 -40.66437      14.97879 0.92 
1 1 1 12  14 7  o 54.40553 9.565030 62.35920  227.8 2.854221       19.13006 0.77 
1 1 1 12  14 8  o 46.34456 9.224689 100.5423  227.8 10.21652       18.44938 0.82 
1 1 1 12  14 9  o 53.58545 11.85738 85.10640  146.6 14.11289       23.71476 0.80 
1 1 1 12  14 10 o 38.54425 9.308097 44.29277  43.5  -15.18674      18.61619 0.51 
1 1 1 12  14 11 o 62.32892 6.150838 104.8733  352.8 -8.877129      12.30168 0.90 
1 1 1 12  14 12 o 76.05034 5.043138 62.45081  77.6  -9.182640      10.08628 0.87 
1 1 1 12  14 13 o 52.05616 6.434270 31.12828  292.8 -11.54969      12.86854 0.61 
1 1 1 12  14 14 o 40.74984 11.03202 112.7395  94.8  -4.152332      22.06404 0.88 
1 1 1 12  14 15 o 99.91121 7.795820 103.3975  258.6 -26.21134      15.59164 0.96 
1 1 1 12  14 16 o 67.82294 11.37860 116.9481  287.8 -6.527298      22.75720 0.95 
1 1 1 12  14 17 o 47.85916 11.67354 29.77298  270.5 -8.493179      23.34709 0.65 
1 1 1 12  14 18 o 94.72296 10.49891 132.3351  124.2 -8.782280      20.99782 0.97 
1 1 1 12  14 19 o 41.37180 11.82477 5.769875  89.0  -29.66252      23.64954 0.15 
1 1 1 12  14 20 o 46.01507 10.41437 125.3257  314.7 ?              ?        0.94 
1 1 1 12  16 0  o 98.03810 6.182039 223.4563  106.6 2.619217       12.36408 0.98 
1 1 1 12  16 1  f 63.55499 9.238660 88.57277  103.8 -4.377712      18.47732 0.00 
1 1 1 12  16 2  o 106.8721 5.802400 202.7358  282.3 29.76711       11.60480 0.98 
1 1 1 12  16 3  o 124.6174 5.115931 217.5305  333.1 27.63094       10.23186 0.98 
1 1 1 12  16 4  o 46.39265 10.76054 31.80430  213.5 20.50490       21.52107 0.58 
1 1 1 12  16 5  o 205.6126 4.204543 365.7962  171.3 10.45801       8.409085 0.99 
1 1 1 12  16 6  o 49.13957 11.46860 105.9405  204.8 9.263622       22.93721 0.90 
1 1 1 12  16 7  o 47.17773 11.12285 91.27602  244.8 3.687836       22.24570 0.89 
1 1 1 12  16 8  f 37.72839 10.55550 48.68967  179.1 6.152660       21.11101 0.00 
1 1 1 12  16 9  o 81.65189 8.099432 143.4550  64.0  -25.98444      16.19886 0.97 
1 1 1 12  16 10 o 53.71611 9.127809 93.07099  32.6  -33.34103      18.25562 0.93 
1 1 1 12  16 11 o 78.99937 5.844252 135.9786  281.4 -13.67614      11.68850 0.97 
1 1 1 12  16 12 o 39.58582 8.999836 57.46781  321.8 14.70743       17.99967 0.83 
1 1 1 12  16 13 o 51.96133 13.07234 48.53012  55.3  -28.41642      26.14468 0.81 
1 1 1 12  16 14 o 40.63717 12.58924 35.72718  261.4 ?              ?        0.67 
1 1 1 12  16 15 o 44.40786 14.00918 56.48096  63.8  ?              ?        0.81 
1 1 1 12  18 0  o 97.19761 7.528864 144.4947  226.3 -1.104156      15.05773 0.98 
1 1 1 12  18 1  o 58.40239 10.79406 136.5586  278.3 -9.336987      21.58811 0.96 
1 1 1 12  18 2  o 34.70169 10.50317 36.20048  120.1 ?              ?        0.68 
1 1 1 12  18 3  o 35.31199 10.48281 39.13636  90.9  ?              ?        0.71 
1 1 1 12  18 4  o 37.69096 10.89864 123.6716  347.7 ?              ?        0.93 
1 1 1 12  18 5  o 37.48788 12.39164 44.07404  18.9  ?              ?        0.73 
1 1 1 12  18 6  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 13  1  0  o 549.9880 4.611629 666.6686  66.4  -95.41660      9.223259 0.99 
1 1 1 13  1  1  o 305.9882 3.015630 344.3509  199.5 -38.06061      6.031260 0.81 
1 1 1 13  1  2  o 626.2833 4.926651 1011.466  93.0  -109.9095      9.853302 0.99 
1 1 1 13  1  3  o 188.3556 2.029558 310.4615  160.6 34.50854       4.059116 0.88 
1 1 1 13  1  4  o 271.1021 2.596980 1008.368  256.1 56.53633       5.193961 0.96 
1 1 1 13  1  5  o 414.9333 3.367165 1314.791  99.6  -21.26462      6.734330 0.98 
1 1 1 13  1  6  o 416.2875 3.399736 1007.036  285.3 7.373169       6.799472 0.97 
1 1 1 13  1  7  o 423.0337 4.125967 651.2980  55.5  -17.53455      8.251934 0.97 
1 1 1 13  1  8  o 177.5268 2.537923 438.2496  61.0  -20.96672      5.075846 0.74 
1 1 1 13  1  9  o 382.1408 3.855367 440.8186  62.3  -27.76425      7.710734 0.96 
1 1 1 13  1  10 o 557.7441 4.969993 901.1538  118.3 28.33270       9.939985 0.98 
1 1 1 13  1  11 o 257.8899 3.967743 225.6515  72.5  19.35379       7.935486 0.90 
1 1 1 13  1  12 o 774.9045 7.031297 1110.877  205.6 32.29089       14.06259 0.99 
1 1 1 13  1  13 o 410.2740 5.338315 418.8900  222.1 9.705261       10.67663 0.96 
1 1 1 13  1  14 o 697.4755 7.837410 806.8049  180.9 -32.34583      15.67482 0.99 
1 1 1 13  1  15 o 339.9873 3.715694 476.2159  323.7 -31.50922      7.431389 0.96 
1 1 1 13  1  16 o 324.0952 4.731345 425.7816  70.0  -18.75339      9.462689 0.96 
1 1 1 13  1  17 o 394.4556 4.315770 490.5306  115.4 8.354584       8.631540 0.98 
1 1 1 13  1  18 f 356.9786 4.062688 460.5235  193.2 -19.67761      8.125376 0.00 
1 1 1 13  1  19 o 182.6309 3.495031 186.8882  247.2 -5.919983      6.990062 0.95 
1 1 1 13  1  20 o 79.86211 5.491570 127.0622  56.9  -20.91558      10.98314 0.78 
1 1 1 13  1  21 o 60.91211 9.101958 40.96086  13.7  37.86758       18.20392 0.41 
1 1 1 13  1  22 o 62.25697 8.145273 151.2951  289.0 -27.06572      16.29055 0.87 
1 1 1 13  1  23 f 114.2871 5.115620 168.3451  350.2 -6.972572      10.23124 0.00 
1 1 1 13  1  24 o 136.8488 5.858398 187.3253  237.3 0.9182892      11.71680 0.97 
1 1 1 13  1  25 o 112.6518 6.380057 188.1696  133.8 -45.25650      12.76011 0.96 
1 1 1 13  1  26 o 147.9896 6.056632 118.9115  331.8 -7.602386      12.11326 0.94 
1 1 1 13  1  27 o 83.24120 9.418113 137.2519  62.6  21.26229       18.83623 0.92 
1 1 1 13  1  28 o 56.15685 12.57757 26.56525  172.5 13.70753       25.15514 0.44 
1 1 1 13  1  29 f 47.88597 13.34386 111.5561  357.5 -6.789787      26.68773 0.00 
1 1 1 13  1  30 o 106.6589 8.926098 159.6262  349.6 19.71721       17.85220 0.97 
1 1 1 13  1  31 o 90.85826 10.27992 122.8460  224.0 14.40216       20.55984 0.96 
1 1 1 13  1  32 o 67.67989 14.38623 127.8920  226.1 ?              ?        0.94 
1 1 1 13  3  0  o 231.7930 2.817266 569.4680  49.4  -57.72957      5.634531 0.92 
1 1 1 13  3  1  o 458.0224 4.371003 606.0963  345.5 -41.93073      8.742005 0.98 
1 1 1 13  3  2  o 151.7198 2.775355 64.69649  21.1  70.64391       5.550711 0.77 
1 1 1 13  3  3  o 363.1100 3.767252 534.6563  216.5 -18.62314      7.534505 0.97 
1 1 1 13  3  4  o 237.8229 2.925026 605.5883  189.4 18.83241       5.850051 0.84 
1 1 1 13  3  5  o 476.7220 4.555661 1169.237  34.5  21.76303       9.111321 0.98 
1 1 1 13  3  6  o 547.4818 4.388129 674.0663  26.6  -10.60376      8.776258 0.98 
1 1 1 13  3  7  o 400.6089 3.512670 412.7566  39.0  69.62271       7.025341 0.97 
1 1 1 13  3  8  o 344.2181 2.931906 282.7506  170.2 28.25839       5.863811 0.95 
1 1 1 13  3  9  o 580.3320 6.521117 919.5533  236.5 -21.00995      13.04223 0.99 
1 1 1 13  3  10 o 145.1421 2.361264 177.2272  338.6 -8.513138      4.722528 0.77 
1 1 1 13  3  11 o 911.3590 7.231616 1439.705  358.6 -63.83301      14.46323 0.99 
1 1 1 13  3  12 o 701.2432 5.739186 1043.450  66.2  -5.514648      11.47837 0.99 
1 1 1 13  3  13 o 759.1748 6.155719 1064.375  26.3  -1.567078      12.31144 0.99 
1 1 1 13  3  14 o 213.8659 2.710774 200.0546  127.4 6.423462       5.421549 0.82 
1 1 1 13  3  15 o 193.3196 2.846753 202.3778  77.3  -3.258972      5.693505 0.89 
1 1 1 13  3  16 o 262.2855 4.883221 402.2848  346.6 ?              ?        0.97 
1 1 1 13  3  17 f 232.5020 3.003262 344.9201  38.3  22.35780       6.006524 0.00 
1 1 1 13  3  18 o 192.8344 4.505667 295.4692  10.4  -8.398560      9.011333 0.97 
1 1 1 13  3  19 o 30.55189 9.382382 123.3519  245.6 -5.929518      18.76476 0.47 
1 1 1 13  3  20 o 63.34637 7.493646 90.26920  171.2 21.68590       14.98729 0.66 
1 1 1 13  3  21 o 130.8142 4.433848 144.8766  85.8  22.84267       8.867696 0.94 
1 1 1 13  3  22 o 240.2240 4.031502 334.9565  38.8  -10.03857      8.063004 0.99 
1 1 1 13  3  23 o 274.1118 3.992970 336.6926  23.3  10.31046       7.985940 0.99 
1 1 1 13  3  24 o 70.77682 9.549174 61.99846  156.5 -25.31163      19.09835 0.82 
1 1 1 13  3  25 o 131.2919 5.508906 198.2879  12.3  -10.05632      11.01781 0.97 
1 1 1 13  3  26 o 124.0413 6.330759 191.2004  206.7 22.33013       12.66152 0.96 
1 1 1 13  3  27 o 96.31117 8.000669 129.4931  139.8 -10.71622      16.00134 0.93 
1 1 1 13  3  28 o 57.19689 11.86380 57.21400  352.1 -30.24855      23.72760 0.77 
1 1 1 13  3  29 o 45.46163 12.39854 81.87356  300.3 11.32648       24.79709 0.85 
1 1 1 13  3  30 o 48.19114 13.04144 69.29620  49.8  -12.37850      26.08288 0.83 
1 1 1 13  3  31 o 40.82236 12.43429 43.50879  42.0  3.687496       24.86857 0.68 
1 1 1 13  3  32 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 13  5  0  o 590.5229 5.179593 890.5281  98.7  -16.21545      10.35919 0.99 
1 1 1 13  5  1  o 248.0549 3.132775 637.1736  237.6 114.5456       6.265550 0.95 
1 1 1 13  5  2  o 190.4120 3.736920 246.9409  226.2 ?              ?        0.63 
1 1 1 13  5  3  o 540.6510 5.415847 1035.836  252.4 2.382690       10.83169 0.99 
1 1 1 13  5  4  f 693.9807 6.581398 1479.387  208.1 -21.87085      13.16280 0.00 
1 1 1 13  5  5  o 167.1469 4.150632 77.47496  110.7 ?              ?        0.44 
1 1 1 13  5  6  o 522.9092 4.798879 941.2715  314.6 17.58319       9.597757 0.98 
1 1 1 13  5  7  f 858.1892 6.924402 1182.630  241.5 28.83502       13.84880 0.00 
1 1 1 13  5  8  o 485.8953 4.311058 636.0299  255.7 29.64651       8.622116 0.98 
1 1 1 13  5  9  o 166.2013 2.594962 140.2228  3.5   35.04907       5.189923 0.50 
1 1 1 13  5  10 o 419.3272 4.940438 598.3519  193.2 55.34119       9.880877 0.97 
1 1 1 13  5  11 o 472.7500 4.249003 603.7375  104.3 -28.98456      8.498006 0.98 
1 1 1 13  5  12 o 401.1238 3.820706 397.2462  95.3  -10.50632      7.641411 0.96 
1 1 1 13  5  13 o 343.2055 3.422412 432.7347  309.6 -12.61713      6.844825 0.96 
1 1 1 13  5  14 o 104.8032 4.073661 7.771714  343.2 ?              ?        0.05 
1 1 1 13  5  15 o 177.2469 2.945127 243.8374  98.4  -15.69241      5.890254 0.93 
1 1 1 13  5  16 o 204.1337 2.893724 380.1389  129.2 7.075912       5.787448 0.97 
1 1 1 13  5  17 o 112.9111 4.319558 143.8299  355.8 2.392014       8.639115 0.88 
1 1 1 13  5  18 f 94.91074 3.983240 217.7994  16.4  1.689545       7.966481 0.00 
1 1 1 13  5  19 f 65.15802 7.149453 212.3237  163.8 64.16117       14.29891 0.00 
1 1 1 13  5  20 o 97.45478 5.813108 107.8628  214.9 -32.53438      11.62622 0.89 
1 1 1 13  5  21 o 41.41230 9.268729 68.15408  57.0  -17.05615      18.53746 0.56 
1 1 1 13  5  22 o 37.70874 9.675161 53.63029  358.8 -4.273746      19.35032 0.49 
1 1 1 13  5  23 o 86.03232 6.453789 157.3488  20.0  6.226341       12.90758 0.95 
1 1 1 13  5  24 o 29.44814 9.343033 49.64882  92.4  -1.674406      18.68607 0.38 
1 1 1 13  5  25 o 195.7965 4.059733 216.5786  116.8 -20.03690      8.119466 0.98 
1 1 1 13  5  26 o 28.58916 9.227390 26.43583  2.8   -7.288469      18.45478 0.23 
1 1 1 13  5  27 o 107.1986 6.932295 116.5295  35.6  5.157280       13.86459 0.95 
1 1 1 13  5  28 o 152.7098 5.550072 208.4655  55.5  -44.06996      11.10014 0.99 
1 1 1 13  5  29 o 90.29477 8.703882 99.58128  73.5  -1.334541      17.40776 0.95 
1 1 1 13  5  30 o 46.43923 10.38108 54.28680  317.2 32.71095       20.76216 0.80 
1 1 1 13  5  31 o 74.70943 11.59953 123.1489  175.8 ?              ?        0.96 
1 1 1 13  7  0  o 478.5178 4.521176 643.4651  61.8  -7.164795      9.042353 0.98 
1 1 1 13  7  1  o 524.1385 4.955549 892.7003  333.9 9.998108       9.911098 0.98 
1 1 1 13  7  2  o 760.0657 6.770695 1036.755  266.0 -0.1324463     13.54139 0.99 
1 1 1 13  7  3  o 363.4586 3.911078 642.3510  245.4 12.96408       7.822155 0.97 
1 1 1 13  7  4  o 214.6063 4.310316 279.8536  19.1  ?              ?        0.91 
1 1 1 13  7  5  o 553.8824 5.249023 988.9049  325.8 39.11328       10.49805 0.99 
1 1 1 13  7  6  o 120.6706 3.251686 172.4606  56.6  75.01611       6.503372 0.57 
1 1 1 13  7  7  o 109.3346 2.814396 188.4002  49.1  15.21340       5.628793 0.54 
1 1 1 13  7  8  o 629.5386 5.241536 932.6840  55.0  42.96985       10.48307 0.99 
1 1 1 13  7  9  o 330.8421 3.258774 417.2566  293.5 51.71295       6.517549 0.96 
1 1 1 13  7  10 o 418.6064 3.848195 693.2276  282.1 36.92291       7.696390 0.98 
1 1 1 13  7  11 f 368.1536 3.475668 382.8810  215.0 28.43634       6.951336 0.00 
1 1 1 13  7  12 o 364.7146 4.555977 556.8701  136.1 -32.36551      9.111954 0.98 
1 1 1 13  7  13 o 69.89175 6.054361 166.5912  185.0 -12.21777      12.10872 0.75 
1 1 1 13  7  14 o 80.62102 5.931460 130.6756  7.6   -7.550163      11.86292 0.83 
1 1 1 13  7  15 o 228.1240 3.076552 336.3551  48.0  -3.081650      6.153104 0.98 
1 1 1 13  7  16 o 229.7284 3.190348 319.6127  201.1 -1.697510      6.380696 0.98 
1 1 1 13  7  17 o 66.94367 7.662786 100.2045  250.2 34.37761       15.32557 0.76 
1 1 1 13  7  18 o 32.46048 8.703348 135.3002  59.2  6.020895       17.40670 0.70 
1 1 1 13  7  19 o 182.4296 3.347789 285.0177  314.9 2.571686       6.695577 0.98 
1 1 1 13  7  20 o 124.6979 4.329661 238.8051  328.2 -9.099281      8.659322 0.97 
1 1 1 13  7  21 o 99.07956 5.311864 135.1053  209.5 -22.91869      10.62373 0.95 
1 1 1 13  7  22 o 222.9638 4.289656 393.2115  169.9 -5.704376      8.579312 0.99 
1 1 1 13  7  23 f 152.2086 4.639663 247.7217  139.1 -8.102142      9.279325 0.00 
1 1 1 13  7  24 o 85.24174 8.171219 101.8939  39.1  16.63120       16.34244 0.90 
1 1 1 13  7  25 o 82.31482 8.474223 139.0073  317.3 30.93905       16.94845 0.94 
1 1 1 13  7  26 o 59.31045 11.94045 82.14541  51.4  -18.68460      23.88090 0.87 
1 1 1 13  7  27 o 37.39006 11.26789 92.56774  112.9 -0.4305954     22.53578 0.85 
1 1 1 13  7  28 o 38.99095 11.64656 17.07979  135.1 -5.916573      23.29312 0.33 
1 1 1 13  7  29 o 38.54263 11.80187 53.61863  123.5 -3.249413      23.60374 0.76 
1 1 1 13  9  0  o 210.5393 5.238496 436.3684  289.8 ?              ?        0.94 
1 1 1 13  9  1  o 275.5674 3.001281 425.8341  307.2 6.838959       6.002562 0.95 
1 1 1 13  9  2  o 435.6048 4.152840 603.5908  325.9 -45.23071      8.305679 0.98 
1 1 1 13  9  3  o 172.6746 2.829731 206.0459  55.1  52.26811       5.659461 0.85 
1 1 1 13  9  4  o 144.2732 2.892396 115.2430  91.0  33.36420       5.784792 0.68 
1 1 1 13  9  5  o 320.2153 3.968052 483.3098  257.9 -29.15601      7.936104 0.97 
1 1 1 13  9  6  o 187.9764 3.005585 214.1740  208.8 -82.41083      6.011170 0.90 
1 1 1 13  9  7  o 74.08955 4.310314 82.83427  225.6 15.00621       8.620627 0.43 
1 1 1 13  9  8  o 200.9880 2.673529 370.3078  76.5  29.83511       5.347059 0.96 
1 1 1 13  9  9  o 71.77778 4.662169 200.9877  20.0  29.12031       9.324337 0.85 
1 1 1 13  9  10 o 195.3209 2.653010 139.8817  255.8 -26.36884      5.306020 0.94 
1 1 1 13  9  11 o 100.7519 3.463238 138.7048  154.4 -23.01391      6.926476 0.88 
1 1 1 13  9  12 o 53.07825 6.734660 110.6607  220.3 -25.07994      13.46932 0.68 
1 1 1 13  9  13 o 297.3274 3.972627 493.9900  235.3 -46.87384      7.945253 0.99 
1 1 1 13  9  14 o 99.67788 5.587131 198.1637  59.7  2.340607       11.17426 0.93 
1 1 1 13  9  15 o 144.8151 4.203962 236.6691  83.2  -0.6478729     8.407925 0.97 
1 1 1 13  9  16 o 30.21032 9.069317 99.70360  327.7 -9.919746      18.13863 0.61 
1 1 1 13  9  17 o 34.70314 10.33640 89.14160  344.7 -4.212822      20.67279 0.63 
1 1 1 13  9  18 o 57.25745 9.738820 153.8704  151.3 25.03574       19.47764 0.91 
1 1 1 13  9  19 o 65.16516 10.59630 129.5607  89.7  18.19734       21.19260 0.92 
1 1 1 13  9  20 o 52.93348 11.44732 79.28468  86.9  -8.880230      22.89463 0.76 
1 1 1 13  9  21 o 246.7776 4.089194 366.9220  188.6 11.42886       8.178389 0.99 
1 1 1 13  9  22 o 107.4143 6.996534 159.8130  237.4 -3.631607      13.99307 0.96 
1 1 1 13  9  23 o 50.00433 11.94475 101.1387  238.3 3.931293       23.88949 0.86 
1 1 1 13  9  24 o 60.29980 11.77686 74.62132  357.8 -30.02880      23.55372 0.87 
1 1 1 13  9  25 o 41.40315 12.59425 16.43588  135.7 -18.53654      25.18851 0.34 
1 1 1 13  9  26 o 36.16673 11.24615 37.63863  248.3 4.222401       22.49230 0.60 
1 1 1 13  9  27 o 45.48530 12.89067 33.19157  53.8  -4.810268      25.78135 0.64 
1 1 1 13  9  28 x ?        ?        52.59612  53.1  ?              ?        0.00 
1 1 1 13  11 0  o 201.8887 3.663854 389.5852  206.8 -14.41989      7.327709 0.98 
1 1 1 13  11 1  o 194.0455 2.985950 326.9766  240.5 1.767700       5.971900 0.98 
1 1 1 13  11 2  o 294.4231 3.841726 465.7730  249.6 6.202484       7.683452 0.99 
1 1 1 13  11 3  o 183.0579 3.081435 316.3271  254.1 11.12355       6.162870 0.97 
1 1 1 13  11 4  o 90.56915 4.090412 191.1313  153.4 -10.83235      8.180823 0.91 
1 1 1 13  11 5  o 167.1525 3.145476 318.7803  138.3 -33.53358      6.290952 0.97 
1 1 1 13  11 6  o 48.01437 8.025323 112.2476  5.3   22.85496       16.05065 0.67 
1 1 1 13  11 7  o 42.45047 7.609284 35.32684  215.6 -3.932678      15.21857 0.25 
1 1 1 13  11 8  o 203.8014 3.116672 359.3141  49.4  -4.647964      6.233344 0.98 
1 1 1 13  11 9  o 122.5910 3.311587 251.0631  124.6 30.13357       6.623175 0.96 
1 1 1 13  11 10 o 94.95608 4.190472 156.2924  268.2 21.36177       8.380943 0.93 
1 1 1 13  11 11 o 254.0608 3.055198 415.8170  284.0 31.32732       6.110396 0.99 
1 1 1 13  11 12 o 175.3525 2.886176 309.1463  32.5  -13.69415      5.772351 0.98 
1 1 1 13  11 13 o 176.9291 4.460653 388.1248  119.4 -9.177780      8.921307 0.99 
1 1 1 13  11 14 f 201.0360 4.126884 383.1861  227.3 31.20647       8.253768 0.00 
1 1 1 13  11 15 o 58.30323 9.774808 108.7622  285.8 27.51357       19.54962 0.90 
1 1 1 13  11 16 f 119.3395 6.413885 184.9242  141.4 -21.86803      12.82777 0.00 
1 1 1 13  11 17 o 155.1520 5.528544 222.6425  121.3 -6.200867      11.05709 0.98 
1 1 1 13  11 18 o 89.39327 9.788448 139.2771  317.2 27.07455       19.57690 0.93 
1 1 1 13  11 19 o 177.7694 5.807077 213.1391  40.9  -11.60539      11.61415 0.98 
1 1 1 13  11 20 o 67.58772 10.72673 103.1877  106.3 7.919250       21.45346 0.91 
1 1 1 13  11 21 o 59.16615 12.99521 103.2351  275.0 -7.557499      25.99043 0.90 
1 1 1 13  11 22 o 65.57512 12.51614 161.9716  301.7 -5.949612      25.03228 0.96 
1 1 1 13  11 23 o 46.33866 13.21010 43.11446  6.5   -18.40258      26.42020 0.72 
1 1 1 13  11 24 o 71.07912 12.08245 105.3716  50.5  -17.48280      24.16490 0.94 
1 1 1 13  11 25 o 39.41320 12.70045 73.91550  127.9 ?              ?        0.84 
1 1 1 13  13 0  o 315.4263 4.085212 532.9865  12.4  0.7513428E-01  8.170424 1.00 
1 1 1 13  13 1  o 104.8772 4.325683 232.1002  9.7   21.00553       8.651365 0.97 
1 1 1 13  13 2  o 134.2777 3.918167 237.8480  92.8  6.318207       7.836335 0.97 
1 1 1 13  13 3  o 113.5250 4.266865 213.0578  162.8 22.50134       8.533730 0.97 
1 1 1 13  13 4  o 117.7446 4.349444 162.2069  281.4 -15.06482      8.698889 0.96 
1 1 1 13  13 5  o 106.8010 4.506213 268.9103  322.2 -13.48229      9.012425 0.97 
1 1 1 13  13 6  o 32.55749 9.186307 23.10115  194.8 -2.933975      18.37261 0.24 
1 1 1 13  13 7  o 98.43275 4.842628 213.2737  106.3 -18.49565      9.685255 0.97 
1 1 1 13  13 8  o 125.4900 3.983734 202.4082  302.9 -5.538673      7.967468 0.98 
1 1 1 13  13 9  o 54.58867 8.483893 134.4512  47.9  -11.22729      16.96779 0.92 
1 1 1 13  13 10 o 75.60753 5.431791 180.8465  28.3  8.030350       10.86358 0.96 
1 1 1 13  13 11 o 53.05927 6.863770 131.0321  336.8 -20.77681      13.72754 0.90 
1 1 1 13  13 12 o 145.6788 3.026343 200.3409  301.0 3.522552       6.052686 0.97 
1 1 1 13  13 13 o 236.6679 2.904725 347.3745  308.4 26.41490       5.809450 0.99 
1 1 1 13  13 14 o 45.27940 11.39884 88.51975  50.9  -21.49360      22.79769 0.78 
1 1 1 13  13 15 o 54.20816 11.26237 98.92389  167.4 -35.40686      22.52475 0.86 
1 1 1 13  13 16 o 124.7221 6.447320 181.4807  315.6 -12.30565      12.89464 0.98 
1 1 1 13  13 17 o 129.6839 7.631963 201.1444  327.0 17.93047       15.26393 0.98 
1 1 1 13  13 18 o 76.94532 11.53088 62.58301  247.6 17.46362       23.06176 0.90 
1 1 1 13  13 19 o 142.8210 7.239490 178.9930  234.4 -2.825058      14.47898 0.99 
1 1 1 13  13 20 o 104.0933 8.892380 185.8224  229.7 -34.95740      17.78476 0.98 
1 1 1 13  13 21 o 40.33685 11.96281 77.69764  21.7  -0.7481613     23.92562 0.86 
1 1 1 13  13 22 o 44.98186 11.25889 122.4824  15.3  ?              ?        0.93 
1 1 1 13  15 0  o 136.2641 4.849614 251.3936  190.5 -5.809341      9.699227 0.98 
1 1 1 13  15 1  o 203.9808 3.939810 366.1014  120.0 24.27052       7.879619 0.99 
1 1 1 13  15 2  o 107.0372 5.214494 150.2037  197.9 15.23921       10.42899 0.96 
1 1 1 13  15 3  o 167.9022 7.410232 280.0879  283.1 39.18387       14.82046 0.99 
1 1 1 13  15 4  o 190.7247 4.088828 313.9715  333.3 -3.871857      8.177656 0.99 
1 1 1 13  15 5  o 53.38235 10.65628 6.671116  339.0 -13.12053      21.31256 0.13 
1 1 1 13  15 6  o 88.80788 6.732985 173.2207  51.2  21.89567       13.46597 0.96 
1 1 1 13  15 7  o 105.2682 5.871955 136.8414  7.2   -7.822327      11.74391 0.96 
1 1 1 13  15 8  o 55.92334 9.973596 63.54489  92.0  5.518681       19.94719 0.81 
1 1 1 13  15 9  o 75.33744 7.805161 106.4418  197.3 18.05064       15.61032 0.93 
1 1 1 13  15 10 o 55.27172 9.408199 66.78690  194.6 -10.72808      18.81640 0.86 
1 1 1 13  15 11 o 43.05967 9.015722 47.52248  148.8 -6.597977      18.03144 0.75 
1 1 1 13  15 12 o 61.72838 7.043724 84.53244  79.1  18.37186       14.08745 0.93 
1 1 1 13  15 13 o 78.62264 5.069492 151.8348  3.4   -14.29265      10.13898 0.97 
1 1 1 13  15 14 o 60.85719 11.56567 135.7774  319.6 15.35705       23.13134 0.95 
1 1 1 13  15 15 o 43.22206 12.45587 67.23618  181.8 -20.50178      24.91173 0.83 
1 1 1 13  15 16 o 21.16298 9.714958 32.69508  179.8 ?              ?        0.44 
1 1 1 13  15 17 o 35.76730 11.55141 34.32631  166.6 ?              ?        0.64 
1 1 1 13  15 18 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 13  17 0  o 36.19220 10.65837 20.13413  205.8 16.84437       21.31674 0.44 
1 1 1 13  17 1  o 65.31851 9.304702 92.16657  324.9 48.40113       18.60940 0.94 
1 1 1 13  17 2  o 101.7169 8.513726 168.8064  293.5 28.25057       17.02745 0.98 
1 1 1 13  17 3  o 77.53557 9.721516 143.2071  217.2 -5.291977      19.44303 0.97 
1 1 1 13  17 4  o 68.60655 11.04824 125.4873  172.1 -11.61312      22.09647 0.95 
1 1 1 13  17 5  o 87.39633 8.335495 169.2979  98.3  10.19852       16.67099 0.98 
1 1 1 13  17 6  o 38.15247 10.59229 49.94141  159.1 -17.50434      21.18458 0.77 
1 1 1 13  17 7  o 36.26564 10.87725 59.74410  218.7 -4.571419      21.75449 0.80 
1 1 1 13  17 8  o 53.12136 10.13462 47.50148  225.1 -37.45724      20.26925 0.85 
1 1 1 13  17 9  o 34.59696 10.63501 53.65388  126.5 -3.511417      21.27002 0.78 
1 1 1 13  17 10 o 40.54720 9.555770 46.02708  264.5 ?              ?        0.81 
1 1 1 13  17 11 x ?        ?        195.7101  243.4 ?              ?        0.00 
1 1 1 14  0  0  o 235.3339 3.781678 1120.303  0.0   0.000000       0.000000 1.00 
1 1 1 14  0  1  o 171.0987 2.704691 714.4390  0.0   0.000000       0.000000 1.00 
1 1 1 14  0  2  o 182.0679 2.883902 575.6390  180.0 0.000000       0.000000 1.00 
1 1 1 14  0  3  o 290.6214 4.164176 296.7400  0.0   0.000000       0.000000 0.99 
1 1 1 14  0  4  o 224.4874 3.726676 929.0952  0.0   0.000000       0.000000 0.97 
1 1 1 14  0  5  o 73.15676 2.560047 263.0764  180.0 0.000000       0.000000 0.46 
1 1 1 14  0  6  o 564.9095 6.599123 140.4820  180.0 0.000000       0.000000 1.00 
1 1 1 14  0  7  o 21.07757 9.304600 34.17605  0.0   0.000000       0.000000 0.09 
1 1 1 14  0  8  o 18.69503 9.539248 316.7992  180.0 0.000000       0.000000 0.13 
1 1 1 14  0  9  o 216.7810 3.407338 71.88320  180.0 0.000000       0.000000 0.89 
1 1 1 14  0  10 o 629.4190 6.855444 857.5637  180.0 0.000000       0.000000 1.00 
1 1 1 14  0  11 o 173.7485 3.997633 153.4418  180.0 0.000000       0.000000 0.69 
1 1 1 14  0  12 o 243.9840 4.779692 399.2150  0.0   0.000000       0.000000 0.99 
1 1 1 14  0  13 o 126.3688 4.304407 353.3736  0.0   0.000000       0.000000 0.87 
1 1 1 14  0  14 o 432.1649 6.383259 354.7000  180.0 0.000000       0.000000 1.00 
1 1 1 14  0  15 o 154.3575 4.329195 294.2552  0.0   0.000000       0.000000 0.92 
1 1 1 14  0  16 o 317.0845 5.389207 453.9185  180.0 0.000000       0.000000 1.00 
1 1 1 14  0  17 o 57.83298 10.73620 22.93783  0.0   0.000000       0.000000 0.12 
1 1 1 14  0  18 o 102.7269 5.928885 142.4775  0.0   0.000000       0.000000 0.92 
1 1 1 14  0  19 o 342.5363 5.872260 561.7484  0.0   0.000000       0.000000 1.00 
1 1 1 14  0  20 o 39.72275 16.09200 10.06493  180.0 0.000000       0.000000 0.07 
1 1 1 14  0  21 f 159.9459 5.015657 126.5648  0.0   0.000000       0.000000 0.00 
1 1 1 14  0  22 o 244.3919 5.246136 303.6852  0.0   0.000000       0.000000 1.00 
1 1 1 14  0  23 o 386.6138 8.452185 516.5538  0.0   0.000000       0.000000 1.00 
1 1 1 14  0  24 o 87.78219 9.304550 78.89052  180.0 0.000000       0.000000 0.98 
1 1 1 14  0  25 o 61.37336 17.26187 107.1565  0.0   0.000000       0.000000 0.96 
1 1 1 14  0  26 o 96.96406 11.26573 175.1346  180.0 0.000000       0.000000 1.00 
1 1 1 14  0  27 o 160.2254 7.529699 122.7032  0.0   0.000000       0.000000 1.00 
1 1 1 14  0  28 o 69.67336 18.51319 89.46155  180.0 0.000000       0.000000 0.97 
1 1 1 14  0  29 o 33.40038 19.78855 7.880689  180.0 0.000000       0.000000 0.11 
1 1 1 14  0  30 o 18.49041 13.36270 0.6901248 180.0 0.000000       0.000000 0.01 
1 1 1 14  0  31 o 23.77719 16.48336 69.44718  180.0 0.000000       0.000000 0.71 
1 1 1 14  0  32 o 92.28678 15.53523 92.76451  180.0 ?              ?        1.00 
1 1 1 14  2  0  f 163.8686 2.149726 504.2390  304.5 -3.799438      4.299451 0.00 
1 1 1 14  2  1  f 455.4399 4.054569 765.8285  281.2 -90.92001      8.109138 0.00 
1 1 1 14  2  2  o 184.6500 2.293990 708.9072  17.1  24.83987       4.587979 0.91 
1 1 1 14  2  3  o 258.6166 2.775225 821.1271  124.3 44.97543       5.550451 0.96 
1 1 1 14  2  4  o 131.5521 2.201831 554.2239  204.8 -7.437263      4.403661 0.83 
1 1 1 14  2  5  o 244.2701 2.410248 270.4225  356.7 -54.56096      4.820496 0.95 
1 1 1 14  2  6  o 174.0938 2.202349 499.5844  163.3 25.48431       4.404698 0.85 
1 1 1 14  2  7  o 627.7101 4.757554 599.2534  111.8 122.7584       9.515107 0.98 
1 1 1 14  2  8  o 363.5172 3.577549 708.5563  116.0 110.1354       7.155099 0.97 
1 1 1 14  2  9  f 111.9158 2.421677 571.3073  241.1 -32.41595      4.843354 0.00 
1 1 1 14  2  10 o 752.9679 6.070937 941.6690  249.2 -9.791382      12.14187 0.99 
1 1 1 14  2  11 o 538.7308 4.673450 733.6257  10.4  -35.52319      9.346900 0.98 
1 1 1 14  2  12 o 367.0551 3.558423 512.0104  2.0   -20.13199      7.116846 0.96 
1 1 1 14  2  13 o 495.3947 4.391131 759.4744  26.5  36.12219       8.782262 0.98 
1 1 1 14  2  14 o 586.3270 4.886312 732.2476  112.0 -18.13898      9.772625 0.98 
1 1 1 14  2  15 o 114.8775 3.175288 247.1774  34.8  -11.97153      6.350576 0.80 
1 1 1 14  2  16 o 115.3198 3.610416 185.5167  325.1 15.26073       7.220832 0.79 
1 1 1 14  2  17 o 377.2261 4.104502 518.7394  17.5  -2.357758      8.209004 0.99 
1 1 1 14  2  18 o 340.7864 4.557113 512.6708  210.1 40.88794       9.114226 0.99 
1 1 1 14  2  19 o 111.8858 4.186245 250.7327  93.1  7.029152       8.372491 0.93 
1 1 1 14  2  20 o 266.8683 3.766744 450.0963  45.4  -24.71890      7.533489 0.99 
1 1 1 14  2  21 o 98.78977 5.475783 155.0150  143.0 13.22359       10.95157 0.92 
1 1 1 14  2  22 o 161.2306 4.211086 190.7508  214.6 18.29764       8.422173 0.97 
1 1 1 14  2  23 o 43.55068 10.58782 82.17988  92.9  -9.353355      21.17564 0.66 
1 1 1 14  2  24 o 56.71022 10.21478 63.72675  239.4 11.08218       20.42956 0.76 
1 1 1 14  2  25 o 53.10342 11.31936 145.2835  273.5 -1.567631      22.63873 0.87 
1 1 1 14  2  26 o 38.73379 10.97550 6.104225  272.2 -17.23046      21.95100 0.06 
1 1 1 14  2  27 o 113.5037 6.751244 159.1981  62.7  14.94547       13.50249 0.96 
1 1 1 14  2  28 o 121.0935 8.591568 83.33361  341.8 -5.977661      17.18314 0.94 
1 1 1 14  2  29 o 106.6683 8.407166 145.6709  336.1 29.78356       16.81433 0.97 
1 1 1 14  2  30 o 138.8498 7.404358 188.9295  295.8 37.53017       14.80872 0.98 
1 1 1 14  2  31 o 53.59996 15.01398 99.12941  277.2 -6.930271      30.02795 0.90 
1 1 1 14  2  32 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 14  4  0  o 242.2598 2.860287 557.4705  254.8 9.170471       5.720575 0.93 
1 1 1 14  4  1  o 99.01555 2.514861 44.28851  84.4  -29.37618      5.029723 0.28 
1 1 1 14  4  2  o 461.5532 4.425767 502.9247  348.2 -40.80679      8.851535 0.98 
1 1 1 14  4  3  o 197.3561 2.964084 665.1239  60.1  45.88181       5.928168 0.92 
1 1 1 14  4  4  f 547.2758 5.658491 1196.851  150.9 23.88416       11.31698 0.00 
1 1 1 14  4  5  o 232.6894 2.823221 290.5250  294.0 58.81041       5.646443 0.88 
1 1 1 14  4  6  o 777.5902 6.561819 1341.607  334.0 -32.85797      13.12364 0.99 
1 1 1 14  4  7  o 363.6083 3.550843 629.1091  271.7 -29.16776      7.101685 0.97 
1 1 1 14  4  8  o 522.6501 4.085114 756.6243  140.1 13.20569       8.170228 0.98 
1 1 1 14  4  9  o 425.9498 3.511981 787.7256  221.1 -31.29599      7.023962 0.98 
1 1 1 14  4  10 o 294.5692 3.291934 482.2712  333.6 -17.86438      6.583867 0.95 
1 1 1 14  4  11 o 362.1722 3.554990 459.1530  28.3  -30.16312      7.109981 0.96 
1 1 1 14  4  12 o 508.7883 4.778206 797.1499  210.6 50.07584       9.556413 0.98 
1 1 1 14  4  13 o 234.9094 3.441014 379.2462  6.9   30.82201       6.882028 0.94 
1 1 1 14  4  14 o 239.1747 2.926551 266.8735  144.2 -38.37581      5.853102 0.92 
1 1 1 14  4  15 o 68.09808 5.150525 107.4361  239.6 -32.06176      10.30105 0.43 
1 1 1 14  4  16 o 202.8279 2.899668 328.6078  334.8 16.96762       5.799335 0.96 
1 1 1 14  4  17 o 247.3487 3.030253 307.7245  186.9 -12.28343      6.060506 0.98 
1 1 1 14  4  18 o 166.8244 3.127636 206.3390  197.5 26.53973       6.255272 0.95 
1 1 1 14  4  19 o 39.29708 8.752234 96.04103  164.3 -10.55930      17.50447 0.44 
1 1 1 14  4  20 o 88.51067 5.199259 88.72293  231.4 7.833611       10.39852 0.82 
1 1 1 14  4  21 o 113.8520 4.530745 189.1100  291.5 30.44661       9.061489 0.95 
1 1 1 14  4  22 o 108.1573 4.735811 152.1373  331.7 -26.49687      9.471622 0.94 
1 1 1 14  4  23 o 282.7213 3.983204 393.5280  17.7  27.23849       7.966408 0.99 
1 1 1 14  4  24 o 122.1905 5.089620 139.1055  311.9 6.766678       10.17924 0.95 
1 1 1 14  4  25 o 212.5909 3.810426 252.5462  18.2  19.36891       7.620852 0.98 
1 1 1 14  4  26 o 75.82934 8.574502 61.84610  296.9 -9.268417      17.14900 0.79 
1 1 1 14  4  27 o 123.2839 5.872859 170.5934  296.9 3.035683       11.74572 0.97 
1 1 1 14  4  28 o 104.7010 7.212957 125.8143  313.7 -26.28130      14.42591 0.96 
1 1 1 14  4  29 o 99.83669 9.735920 115.3482  84.5  19.24956       19.47184 0.96 
1 1 1 14  4  30 f 63.83587 12.77334 74.59645  100.2 -29.12381      25.54669 0.00 
1 1 1 14  4  31 o 39.61229 12.33713 69.76497  265.7 ?              ?        0.83 
1 1 1 14  6  0  o 549.6237 4.773418 1005.580  92.5  25.46521       9.546837 0.99 
1 1 1 14  6  1  o 526.8403 5.168292 911.4421  277.0 21.78546       10.33658 0.99 
1 1 1 14  6  2  o 661.2161 6.129653 1033.124  211.0 23.92023       12.25931 0.99 
1 1 1 14  6  3  o 320.0715 3.725451 318.0496  249.0 -15.08728      7.450901 0.94 
1 1 1 14  6  4  o 490.6857 4.945017 637.7410  5.1   31.37717       9.890034 0.98 
1 1 1 14  6  5  o 436.2613 5.575982 686.9600  9.4   97.97226       11.15196 0.98 
1 1 1 14  6  6  o 506.4323 4.672544 695.8670  110.5 -56.81668      9.345088 0.98 
1 1 1 14  6  7  o 404.6222 5.249091 560.1757  166.6 10.57620       10.49818 0.97 
1 1 1 14  6  8  o 221.6816 3.013943 332.1390  296.0 25.83409       6.027886 0.90 
1 1 1 14  6  9  o 179.8860 2.603427 299.7286  326.8 39.39343       5.206853 0.84 
1 1 1 14  6  10 o 450.9355 5.325587 414.1424  207.9 ?              ?        0.97 
1 1 1 14  6  11 o 364.6913 4.184397 599.5656  167.2 -26.44693      8.368794 0.98 
1 1 1 14  6  12 o 244.4204 3.629322 521.3503  112.3 -52.31319      7.258643 0.96 
1 1 1 14  6  13 o 100.7759 3.874386 141.2881  27.8  -27.80670      7.748772 0.76 
1 1 1 14  6  14 o 92.19107 4.224989 121.7604  331.5 22.00155       8.449979 0.73 
1 1 1 14  6  15 o 124.3656 3.409399 93.25295  84.3  -4.407410      6.818799 0.85 
1 1 1 14  6  16 f 308.3719 3.311678 435.3290  178.0 14.83185       6.623356 0.00 
1 1 1 14  6  17 o 210.8028 3.362128 400.8234  174.7 -31.57697      6.724255 0.98 
1 1 1 14  6  18 o 111.9049 3.962855 128.6560  130.6 -33.55140      7.925709 0.90 
1 1 1 14  6  19 o 240.7150 3.453539 351.2629  331.5 -18.97720      6.907078 0.99 
1 1 1 14  6  20 o 51.88338 9.249951 2.813151  140.2 7.988941       18.49990 0.04 
1 1 1 14  6  21 o 163.9197 3.695477 206.7271  161.5 -59.68900      7.390955 0.98 
1 1 1 14  6  22 o 240.5010 3.638502 301.6653  190.0 28.31508       7.277004 0.99 
1 1 1 14  6  23 o 153.7510 4.578333 266.5027  99.8  6.692184       9.156667 0.98 
1 1 1 14  6  24 o 188.5242 4.471223 281.9791  104.0 -6.679703      8.942447 0.98 
1 1 1 14  6  25 o 42.48109 10.74353 48.76846  174.0 -21.57721      21.48706 0.54 
1 1 1 14  6  26 o 97.96073 7.294839 157.3701  342.8 -39.50583      14.58968 0.96 
1 1 1 14  6  27 o 47.10117 12.05611 77.93611  26.5  -23.82589      24.11222 0.84 
1 1 1 14  6  28 o 84.70866 9.814110 108.1319  38.0  -31.86282      19.62822 0.95 
1 1 1 14  6  29 o 33.99878 10.97385 39.80991  173.3 -11.20705      21.94771 0.60 
1 1 1 14  6  30 o 43.77242 11.36506 90.43526  214.7 ?              ?        0.89 
1 1 1 14  8  0  o 215.8410 2.817538 228.0629  296.4 -34.46748      5.635077 0.89 
1 1 1 14  8  1  o 101.1822 4.389556 228.9263  168.0 0.4871902      8.779112 0.70 
1 1 1 14  8  2  o 299.7814 3.178097 448.3788  154.6 24.16904       6.356194 0.95 
1 1 1 14  8  3  o 169.8531 3.373985 91.99818  168.2 31.39384       6.747970 0.61 
1 1 1 14  8  4  o 335.9055 3.583224 558.6107  42.2  -24.69250      7.166448 0.97 
1 1 1 14  8  5  o 381.5346 3.888132 533.4266  339.0 -25.50464      7.776265 0.97 
1 1 1 14  8  6  o 206.2680 2.927768 231.8125  335.2 4.958893       5.855537 0.86 
1 1 1 14  8  7  o 88.22131 4.327024 259.5387  194.6 49.48016       8.654047 0.76 
1 1 1 14  8  8  o 109.0439 2.942814 128.1495  78.2  1.145493       5.885629 0.68 
1 1 1 14  8  9  o 255.1909 2.984005 412.3894  334.9 -17.08380      5.968010 0.97 
1 1 1 14  8  10 o 59.04270 4.882827 119.3518  356.8 18.50033       9.765655 0.48 
1 1 1 14  8  11 o 82.60071 4.503874 198.2204  129.0 48.02521       9.007749 0.85 
1 1 1 14  8  12 o 226.9046 2.885261 361.3123  186.3 0.9270172      5.770522 0.98 
1 1 1 14  8  13 o 282.9009 3.719847 495.4895  213.8 -19.29208      7.439695 0.99 
1 1 1 14  8  14 o 39.81028 9.217113 107.9435  357.8 -15.46232      18.43423 0.57 
1 1 1 14  8  15 o 122.7515 4.581382 156.8172  183.4 0.9720688      9.162765 0.93 
1 1 1 14  8  16 o 213.8869 3.909050 348.9545  216.1 11.06949       7.818099 0.99 
1 1 1 14  8  17 o 39.95939 10.28346 122.6812  216.2 -2.775673      20.56691 0.75 
1 1 1 14  8  18 o 130.3743 4.154775 227.3296  122.9 1.338379       8.309549 0.97 
1 1 1 14  8  19 o 59.79482 9.058057 82.74519  328.1 23.23500       18.11611 0.82 
1 1 1 14  8  20 o 146.4237 5.147115 215.9998  293.0 -18.20459      10.29423 0.98 
1 1 1 14  8  21 o 201.2809 4.176225 308.6813  174.1 -23.42192      8.352449 0.99 
1 1 1 14  8  22 o 238.2978 3.721030 303.4166  179.8 -20.67029      7.442059 0.99 
1 1 1 14  8  23 o 89.08163 9.779070 125.5451  192.1 9.465370       19.55814 0.93 
1 1 1 14  8  24 o 42.43830 11.52502 146.9526  21.7  -2.619644      23.05005 0.89 
1 1 1 14  8  25 o 36.39375 10.93283 27.00819  61.2  -20.30190      21.86566 0.43 
1 1 1 14  8  26 o 33.84312 10.79513 38.19965  141.7 -8.427025      21.59026 0.58 
1 1 1 14  8  27 o 55.69303 12.09830 96.35629  186.8 -6.547321      24.19660 0.91 
1 1 1 14  8  28 o 68.81199 12.54343 93.92164  272.4 ?              ?        0.93 
1 1 1 14  10 0  o 320.1229 3.466183 564.6688  166.5 -28.33273      6.932366 0.98 
1 1 1 14  10 1  o 178.7682 2.798246 213.0697  237.5 2.246094       5.596493 0.92 
1 1 1 14  10 2  o 252.9927 3.193646 255.3562  103.1 -0.1104431     6.387293 0.96 
1 1 1 14  10 3  o 226.3952 3.463815 436.9444  227.8 11.95952       6.927630 0.97 
1 1 1 14  10 4  o 159.1778 2.985034 165.1019  338.5 23.87566       5.970068 0.91 
1 1 1 14  10 5  o 182.5194 2.992715 216.9229  351.1 -16.51115      5.985431 0.95 
1 1 1 14  10 6  o 172.0065 3.141266 330.3474  63.5  43.09312       6.282532 0.97 
1 1 1 14  10 7  o 159.2478 2.910613 414.3046  191.9 -29.91090      5.821226 0.98 
1 1 1 14  10 8  o 141.3077 3.187548 243.7303  259.5 21.46379       6.375097 0.95 
1 1 1 14  10 9  o 416.9316 3.903898 644.5164  18.8  7.349945       7.807796 0.99 
1 1 1 14  10 10 o 209.3685 2.757327 319.5723  98.5  12.00217       5.514653 0.98 
1 1 1 14  10 11 o 244.5970 2.848785 476.3521  203.9 3.483139       5.697570 0.99 
1 1 1 14  10 12 o 279.9286 3.157804 461.8914  313.6 0.4588928      6.315607 0.99 
1 1 1 14  10 13 o 143.5263 4.937161 232.6910  342.9 34.12560       9.874322 0.97 
1 1 1 14  10 14 o 51.43664 9.268748 58.81424  210.4 -48.59264      18.53750 0.62 
1 1 1 14  10 15 o 141.1483 4.868217 219.7545  310.4 -21.79462      9.736433 0.97 
1 1 1 14  10 16 o 203.9246 4.413507 358.1226  314.1 -15.94139      8.827014 0.99 
1 1 1 14  10 17 o 119.1854 5.955938 164.8084  185.2 -40.99554      11.91188 0.97 
1 1 1 14  10 18 o 112.0867 6.968036 160.5696  248.9 -38.64693      13.93607 0.96 
1 1 1 14  10 19 o 102.3887 7.529154 148.7834  39.6  1.893623       15.05831 0.94 
1 1 1 14  10 20 o 128.7788 6.858793 161.7606  65.2  12.01094       13.71759 0.96 
1 1 1 14  10 21 o 102.6171 8.658517 123.0683  221.4 -17.19756      17.31703 0.95 
1 1 1 14  10 22 o 127.7566 7.015274 121.7556  297.4 -2.176773      14.03055 0.97 
1 1 1 14  10 23 o 42.74068 12.46083 67.56829  189.4 16.91616       24.92166 0.81 
1 1 1 14  10 24 o 41.07966 11.66576 68.52096  86.6  11.92025       23.33151 0.82 
1 1 1 14  10 25 o 76.38757 11.99746 164.3046  112.3 21.01399       23.99492 0.96 
1 1 1 14  10 26 o 33.32705 11.13553 46.31691  148.0 ?              ?        0.70 
1 1 1 14  12 0  o 114.3093 3.687413 135.0917  327.0 -21.16855      7.374825 0.91 
1 1 1 14  12 1  o 307.6245 3.697851 435.3072  181.2 -9.551178      7.395703 0.99 
1 1 1 14  12 2  o 116.9900 3.472326 270.8896  233.6 1.313004       6.944651 0.96 
1 1 1 14  12 3  o 34.56145 7.517951 74.91235  107.5 21.21848       15.03590 0.49 
1 1 1 14  12 4  o 53.68707 7.862563 155.3379  192.7 11.02459       15.72513 0.86 
1 1 1 14  12 5  o 51.58005 7.901823 171.6557  195.0 -4.277107      15.80365 0.88 
1 1 1 14  12 6  o 85.07270 4.542175 145.4442  349.5 -7.526260      9.084350 0.92 
1 1 1 14  12 7  o 152.7280 3.255367 251.4952  359.6 1.631393       6.510733 0.98 
1 1 1 14  12 8  o 226.0247 3.311759 374.4098  276.1 1.130737       6.623519 0.99 
1 1 1 14  12 9  o 253.6051 3.289922 446.5384  181.1 21.11206       6.579844 0.99 
1 1 1 14  12 10 o 311.6844 3.181992 495.9534  113.1 -0.4716187     6.363984 1.00 
1 1 1 14  12 11 o 152.9351 3.007683 219.1796  68.2  2.418777       6.015366 0.98 
1 1 1 14  12 12 o 155.0079 2.896231 245.1950  310.0 0.8070831      5.792462 0.99 
1 1 1 14  12 13 o 281.8947 3.331350 395.5643  327.0 -9.445953      6.662700 0.99 
1 1 1 14  12 14 o 229.3664 4.758715 334.7734  16.1  -3.619751      9.517429 0.99 
1 1 1 14  12 15 o 234.2098 4.379671 363.1989  88.4  -32.39064      8.759341 0.99 
1 1 1 14  12 16 o 43.43082 10.18557 53.29332  115.8 16.03787       20.37114 0.60 
1 1 1 14  12 17 o 43.10460 11.87922 91.61098  287.7 -9.412010      23.75844 0.79 
1 1 1 14  12 18 o 135.9711 7.047807 126.0005  84.4  11.49974       14.09561 0.97 
1 1 1 14  12 19 o 34.66206 10.83647 37.18066  111.4 1.464417       21.67295 0.54 
1 1 1 14  12 20 o 79.06836 11.80385 108.0146  233.0 30.45104       23.60770 0.95 
1 1 1 14  12 21 o 91.85501 9.760753 92.15166  39.5  -19.16168      19.52151 0.95 
1 1 1 14  12 22 o 48.59018 13.14612 35.84048  41.7  -33.37342      26.29225 0.68 
1 1 1 14  12 23 o 98.61766 10.20360 168.6626  244.8 ?              ?        0.98 
1 1 1 14  14 0  o 83.30220 6.436518 180.5793  353.3 -31.80417      12.87304 0.96 
1 1 1 14  14 1  o 204.4608 3.660109 311.8292  18.1  -6.893173      7.320218 0.99 
1 1 1 14  14 2  o 30.20312 12.87269 32.79568  84.1  ?              ?        0.36 
1 1 1 14  14 3  o 119.3260 4.751173 216.5355  111.8 16.85237       9.502347 0.98 
1 1 1 14  14 4  o 226.5839 3.960829 376.9181  51.3  -30.31050      7.921657 0.99 
1 1 1 14  14 5  o 123.9842 4.586011 213.4578  13.4  -11.64180      9.172022 0.98 
1 1 1 14  14 6  o 46.31139 9.851951 73.07716  288.5 -25.95589      19.70390 0.76 
1 1 1 14  14 7  o 74.75858 7.595479 82.25642  203.1 33.83809       15.19096 0.88 
1 1 1 14  14 8  o 122.4629 4.521772 136.5483  141.3 4.575668       9.043544 0.96 
1 1 1 14  14 9  o 205.6410 3.608837 289.6813  120.0 -2.844681      7.217673 0.99 
1 1 1 14  14 10 o 69.53419 6.823503 168.3344  355.7 20.30006       13.64701 0.94 
1 1 1 14  14 11 o 91.18391 4.611372 148.2677  347.8 1.965607       9.222743 0.96 
1 1 1 14  14 12 o 58.04453 7.338793 88.07555  180.5 13.81780       14.67759 0.88 
1 1 1 14  14 13 o 58.06337 6.442335 43.83449  188.7 11.60503       12.88467 0.79 
1 1 1 14  14 14 f 87.93880 10.45312 94.87420  98.3  16.42590       20.90625 0.00 
1 1 1 14  14 15 o 58.91106 12.07198 166.8138  84.9  -21.57157      24.14395 0.95 
1 1 1 14  14 16 o 88.54079 11.89127 148.7457  347.6 19.15750       23.78254 0.97 
1 1 1 14  14 17 o 62.97832 12.10035 115.5647  308.3 -8.870811      24.20070 0.94 
1 1 1 14  14 18 o 40.79598 11.95327 22.47485  72.6  -15.71505      23.90654 0.48 
1 1 1 14  14 19 o 44.37896 11.88455 107.5237  80.1  ?              ?        0.92 
1 1 1 14  14 20 x ?        ?        82.21632  229.0 ?              ?        0.00 
1 1 1 14  16 0  o 103.2452 6.176312 139.9760  229.7 -6.329521      12.35262 0.97 
1 1 1 14  16 1  o 120.5182 6.136581 243.9420  137.7 20.88171       12.27316 0.98 
1 1 1 14  16 2  o 145.3242 4.942482 259.1812  150.3 -9.662186      9.884963 0.99 
1 1 1 14  16 3  o 44.56643 10.98915 109.4778  325.9 -3.109116      21.97831 0.89 
1 1 1 14  16 4  o 105.9834 11.82158 270.9627  338.5 42.71252       23.64316 0.98 
1 1 1 14  16 5  o 48.09185 11.56572 132.2558  323.9 8.314468       23.13144 0.92 
1 1 1 14  16 6  o 57.29018 10.95664 89.13249  140.7 -21.58904      21.91329 0.91 
1 1 1 14  16 7  o 34.59056 9.973606 36.21686  304.4 21.54338       19.94721 0.62 
1 1 1 14  16 8  o 92.25682 7.506812 179.7404  300.8 0.7744370      15.01362 0.98 
1 1 1 14  16 9  o 61.42596 10.13091 75.35572  244.1 17.60231       20.26181 0.92 
1 1 1 14  16 10 o 62.46326 9.592522 43.64747  12.4  -11.97710      19.18504 0.86 
1 1 1 14  16 11 o 48.20524 9.138835 13.30076  109.7 24.70378       18.27767 0.41 
1 1 1 14  16 12 o 35.45054 9.398939 59.59445  224.9 4.135941       18.79788 0.82 
1 1 1 14  16 13 o 49.48491 8.036334 103.0166  270.4 17.68037       16.07267 0.94 
1 1 1 14  16 14 o 31.42239 10.66403 116.3980  195.6 ?              ?        0.90 
1 1 1 14  18 0  f 37.32722 10.92520 105.0383  148.7 ?              ?        0.00 
1 1 1 14  18 1  o 33.95165 10.58925 72.30481  141.5 ?              ?        0.85 
1 1 1 14  18 2  o 41.89734 11.11944 121.5506  177.3 ?              ?        0.93 
1 1 1 14  18 3  o 61.92748 12.94705 150.9435  184.9 ?              ?        0.96 
1 1 1 14  18 4  o 41.62163 11.44281 62.61915  224.1 ?              ?        0.86 
1 1 1 14  18 5  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 15  1  0  o 268.0053 3.199322 331.9487  203.3 -21.28546      6.398643 0.95 
1 1 1 15  1  1  o 145.1292 2.100266 361.2751  197.9 11.15013       4.200532 0.62 
1 1 1 15  1  2  o 360.1033 3.186440 1049.994  104.2 12.02048       6.372880 0.96 
1 1 1 15  1  3  o 32.23363 3.581413 561.9016  168.9 7.085295       7.162826 0.31 
1 1 1 15  1  4  o 251.6930 2.480455 764.9594  86.0  35.34291       4.960910 0.94 
1 1 1 15  1  5  o 383.2148 3.852578 364.3983  310.0 -15.18750      7.705155 0.97 
1 1 1 15  1  6  f 54.19097 3.542874 149.1091  68.4  -44.83838      7.085748 0.00 
1 1 1 15  1  7  o 44.35672 3.580535 359.7874  317.6 21.24724       7.161071 0.26 
1 1 1 15  1  8  o 537.3165 4.338576 852.1339  159.1 74.28979       8.677152 0.98 
1 1 1 15  1  9  o 454.3232 4.371372 572.0896  176.5 -23.20386      8.742743 0.97 
1 1 1 15  1  10 o 197.1870 3.635280 318.2792  298.5 82.12331       7.270559 0.91 
1 1 1 15  1  11 o 509.4745 4.499897 697.5862  61.0  -11.20847      8.999794 0.98 
1 1 1 15  1  12 o 579.1990 5.468234 622.9873  16.3  4.468933       10.93647 0.98 
1 1 1 15  1  13 o 721.5321 6.515402 660.0551  313.1 30.94519       13.03080 0.99 
1 1 1 15  1  14 o 416.3635 4.335602 603.7205  311.3 10.01968       8.671205 0.97 
1 1 1 15  1  15 o 181.7680 3.923568 108.9141  300.4 21.28133       7.847136 0.66 
1 1 1 15  1  16 o 341.6897 3.836864 297.7021  283.6 25.12305       7.673729 0.96 
1 1 1 15  1  17 o 229.4716 3.674931 367.1780  336.3 16.79808       7.349862 0.97 
1 1 1 15  1  18 o 122.4787 3.800030 193.7745  146.8 40.51538       7.600061 0.92 
1 1 1 15  1  19 o 337.9748 4.019703 420.5858  344.5 3.935577       8.039407 0.99 
1 1 1 15  1  20 o 137.2031 3.924101 186.4951  326.5 -4.817398      7.848202 0.94 
1 1 1 15  1  21 o 90.36675 5.694132 122.8893  95.8  13.02966       11.38826 0.88 
1 1 1 15  1  22 o 104.4825 5.387975 137.8250  56.2  -4.392143      10.77595 0.92 
1 1 1 15  1  23 o 162.9780 4.230987 137.5865  311.2 -37.70172      8.461974 0.96 
1 1 1 15  1  24 o 98.16412 8.437304 121.9224  190.9 -2.781769      16.87461 0.94 
1 1 1 15  1  25 o 100.3654 6.953422 92.43235  304.0 -19.49174      13.90684 0.90 
1 1 1 15  1  26 o 73.67009 10.01988 98.36600  51.1  -0.2485504     20.03975 0.86 
1 1 1 15  1  27 o 102.9933 7.441628 109.6167  36.9  -8.813766      14.88326 0.93 
1 1 1 15  1  28 o 42.65935 12.14251 58.02692  149.1 1.765530       24.28502 0.69 
1 1 1 15  1  29 o 34.79745 11.64367 72.41873  183.7 15.76147       23.28734 0.77 
1 1 1 15  1  30 o 42.89423 12.12652 68.90318  336.7 19.81297       24.25304 0.81 
1 1 1 15  1  31 o 62.66771 12.23904 92.11199  36.6  -42.73708      24.47808 0.92 
1 1 1 15  3  0  o 346.0067 3.299378 837.0977  306.6 -3.960327      6.598755 0.97 
1 1 1 15  3  1  o 407.5813 3.685711 906.4525  9.5   -29.62347      7.371422 0.98 
1 1 1 15  3  2  o 365.3817 3.800104 606.1642  4.7   34.77789       7.600208 0.96 
1 1 1 15  3  3  o 176.2613 2.520787 202.6423  188.3 -30.06474      5.041574 0.79 
1 1 1 15  3  4  o 497.1829 4.186400 378.1694  154.7 57.75262       8.372801 0.97 
1 1 1 15  3  5  o 129.3087 2.069109 308.1033  261.7 -4.609360      4.138218 0.32 
1 1 1 15  3  6  o 150.3678 2.213786 416.9494  301.1 -21.76103      4.427572 0.88 
1 1 1 15  3  7  o 650.2733 5.000541 1113.632  0.5   4.753235       10.00108 0.99 
1 1 1 15  3  8  o 548.2786 4.662994 703.2405  133.9 9.601746       9.325989 0.98 
1 1 1 15  3  9  o 599.8795 5.091627 749.2969  111.8 -24.22833      10.18325 0.98 
1 1 1 15  3  10 o 252.9558 2.944504 501.0432  223.2 -55.08788      5.889009 0.94 
1 1 1 15  3  11 o 425.0557 4.169217 742.4600  197.9 36.47144       8.338434 0.97 
1 1 1 15  3  12 o 490.8174 4.248423 575.6434  295.1 -19.60620      8.496846 0.98 
1 1 1 15  3  13 o 330.9305 3.270515 387.2403  24.3  25.35141       6.541030 0.95 
1 1 1 15  3  14 o 529.4739 5.096643 707.8976  131.4 16.06104       10.19329 0.99 
1 1 1 15  3  15 o 234.1764 2.987446 260.1434  230.1 7.141937       5.974892 0.93 
1 1 1 15  3  16 o 133.1376 3.073155 257.9789  263.3 -16.75240      6.146311 0.91 
1 1 1 15  3  17 o 363.7789 5.172956 475.6686  99.6  19.60400       10.34591 0.99 
1 1 1 15  3  18 o 88.50378 4.182878 128.1357  190.4 16.97497       8.365757 0.81 
1 1 1 15  3  19 o 107.1845 5.420731 125.7024  349.7 -9.048882      10.84146 0.86 
1 1 1 15  3  20 o 241.3760 3.608313 385.8965  63.4  14.46443       7.216626 0.99 
1 1 1 15  3  21 o 162.8331 3.590093 216.1043  147.4 1.111908       7.180186 0.97 
1 1 1 15  3  22 o 224.0305 3.774627 311.1766  273.8 6.427048       7.549253 0.99 
1 1 1 15  3  23 o 196.9370 4.553774 225.7945  31.7  -7.812393      9.107549 0.98 
1 1 1 15  3  24 o 55.40486 9.835917 115.7805  31.9  -28.27903      19.67183 0.86 
1 1 1 15  3  25 o 124.8960 6.003831 122.4444  34.6  6.213287       12.00766 0.94 
1 1 1 15  3  26 o 49.63695 11.79723 78.62649  75.9  -15.56294      23.59446 0.72 
1 1 1 15  3  27 o 55.87738 12.00009 94.18363  331.9 -9.429897      24.00018 0.85 
1 1 1 15  3  28 o 118.3781 7.707015 142.2302  297.1 -13.37856      15.41403 0.97 
1 1 1 15  3  29 o 36.73263 11.20481 46.43220  352.9 9.868359       22.40962 0.66 
1 1 1 15  3  30 f 39.48051 12.15836 27.85318  234.2 7.566925       24.31672 0.00 
1 1 1 15  3  31 o 61.61521 13.76673 103.5632  251.4 ?              ?        0.93 
1 1 1 15  5  0  o 246.1278 2.856541 682.3932  56.9  86.54033       5.713082 0.92 
1 1 1 15  5  1  o 400.4000 3.926060 939.7433  68.5  30.31924       7.852119 0.98 
1 1 1 15  5  2  o 201.3293 2.624461 332.6520  10.6  -41.07942      5.248922 0.89 
1 1 1 15  5  3  o 597.7141 5.849049 944.7581  331.3 -27.37012      11.69810 0.99 
1 1 1 15  5  4  o 440.5114 4.710139 645.6620  28.2  22.72903       9.420278 0.97 
1 1 1 15  5  5  o 714.4756 6.070236 873.3335  100.0 -7.960022      12.14047 0.99 
1 1 1 15  5  6  o 1028.689 8.165714 1274.397  124.4 63.35742       16.33143 0.99 
1 1 1 15  5  7  o 607.0592 5.200875 1045.146  182.6 28.20490       10.40175 0.99 
1 1 1 15  5  8  o 72.22550 3.225527 84.87910  92.8  22.53450       6.451054 0.04 
1 1 1 15  5  9  o 124.5206 2.800419 229.9981  204.9 -21.63505      5.600838 0.70 
1 1 1 15  5  10 o 351.9404 4.475763 647.4915  287.2 43.25842       8.951526 0.97 
1 1 1 15  5  11 o 178.5579 2.677640 111.8572  223.6 -9.997803      5.355281 0.68 
1 1 1 15  5  12 o 292.6929 3.105799 381.7749  220.9 -8.854065      6.211597 0.95 
1 1 1 15  5  13 o 396.9233 3.765925 573.3937  84.5  -12.98682      7.531849 0.98 
1 1 1 15  5  14 o 66.18709 6.401464 79.01300  261.2 51.69495       12.80293 0.35 
1 1 1 15  5  15 o 186.8002 2.964244 281.5465  9.5   47.74164       5.928489 0.95 
1 1 1 15  5  16 f 183.0876 3.101985 214.5241  203.6 -25.54579      6.203969 0.00 
1 1 1 15  5  17 o 349.3229 3.872120 478.0197  167.6 -29.70566      7.744239 0.99 
1 1 1 15  5  18 o 52.08076 7.451542 113.0095  66.2  -34.43481      14.90308 0.68 
1 1 1 15  5  19 o 178.5222 4.917579 290.6828  220.3 10.11995       9.835157 0.98 
1 1 1 15  5  20 o 69.08282 6.851598 169.6599  132.2 -11.11521      13.70320 0.91 
1 1 1 15  5  21 o 78.63423 7.017270 163.1721  40.5  19.30233       14.03454 0.92 
1 1 1 15  5  22 o 153.8802 4.039446 171.2562  181.5 -21.77443      8.078893 0.97 
1 1 1 15  5  23 o 83.76128 7.373880 209.3694  102.6 12.37825       14.74776 0.96 
1 1 1 15  5  24 o 103.8430 6.736726 111.5342  194.4 39.12621       13.47345 0.92 
1 1 1 15  5  25 o 109.0332 6.318893 163.0799  314.6 -0.7553864E-01 12.63779 0.95 
1 1 1 15  5  26 o 135.3605 5.502207 205.6697  269.6 0.3305206      11.00441 0.98 
1 1 1 15  5  27 o 55.16150 11.21622 77.34341  241.2 -1.873566      22.43244 0.86 
1 1 1 15  5  28 o 87.61842 8.920050 135.3285  349.9 -11.58724      17.84010 0.96 
1 1 1 15  5  29 o 79.50591 9.788755 96.66404  354.0 -16.72064      19.57751 0.94 
1 1 1 15  5  30 o 75.02321 11.43743 95.03751  266.7 ?              ?        0.94 
1 1 1 15  7  0  o 865.7598 7.009446 1025.309  132.4 60.32379       14.01889 0.99 
1 1 1 15  7  1  o 586.0930 5.509505 864.7995  104.4 -23.88959      11.01901 0.99 
1 1 1 15  7  2  f 208.7030 3.080841 385.4568  93.7  -48.81718      6.161681 0.00 
1 1 1 15  7  3  o 314.3047 3.503571 390.8400  181.3 83.80606       7.007142 0.95 
1 1 1 15  7  4  o 119.5973 3.779879 206.7837  224.5 -18.83701      7.559759 0.71 
1 1 1 15  7  5  o 182.1515 2.751112 193.5380  342.7 -45.58769      5.502223 0.81 
1 1 1 15  7  6  o 302.7051 3.656988 548.4337  165.6 3.135010       7.313976 0.96 
1 1 1 15  7  7  f 317.4295 3.351970 419.8968  110.3 -0.6907349     6.703939 0.00 
1 1 1 15  7  8  o 210.1509 3.696266 345.8290  265.8 2.785751       7.392533 0.91 
1 1 1 15  7  9  o 107.3850 3.168248 157.5617  226.4 -16.30752      6.336497 0.63 
1 1 1 15  7  10 o 260.2208 2.907820 546.4928  89.3  39.33614       5.815639 0.97 
1 1 1 15  7  11 o 203.8856 2.787564 209.1725  206.4 -25.56712      5.575128 0.92 
1 1 1 15  7  12 o 85.20509 5.619537 108.5274  229.2 -6.424500      11.23907 0.66 
1 1 1 15  7  13 o 86.45563 5.401953 52.34550  19.6  -24.64290      10.80391 0.51 
1 1 1 15  7  14 o 135.9869 4.371845 212.6926  27.9  16.92372       8.743690 0.94 
1 1 1 15  7  15 o 192.1112 3.000293 289.6501  158.3 13.29012       6.000585 0.97 
1 1 1 15  7  16 o 264.9453 3.300243 356.5849  138.1 32.99033       6.600485 0.98 
1 1 1 15  7  17 f 42.07563 8.850754 140.6466  174.2 15.55451       17.70151 0.00 
1 1 1 15  7  18 o 68.46757 7.310165 36.56887  352.4 3.003708       14.62033 0.52 
1 1 1 15  7  19 o 107.1507 4.931842 200.0675  65.0  -36.69913      9.863685 0.96 
1 1 1 15  7  20 o 41.03616 9.889103 89.74953  111.4 11.27489       19.77821 0.75 
1 1 1 15  7  21 o 37.38267 10.21995 49.64241  28.4  8.613892       20.43991 0.54 
1 1 1 15  7  22 o 94.21220 7.012957 169.9321  299.7 14.70880       14.02591 0.94 
1 1 1 15  7  23 o 89.71004 7.223632 111.5466  64.1  -8.914917      14.44726 0.91 
1 1 1 15  7  24 o 96.53415 6.509971 124.8607  115.5 4.613739       13.01994 0.94 
1 1 1 15  7  25 o 40.50867 10.79900 63.89067  226.9 13.57276       21.59800 0.72 
1 1 1 15  7  26 o 45.50793 11.99306 31.29476  300.5 0.7022896      23.98612 0.58 
1 1 1 15  7  27 o 43.90319 12.06627 64.27957  162.2 3.236851       24.13253 0.81 
1 1 1 15  7  28 o 30.35411 10.08101 61.95166  327.5 -1.504286      20.16203 0.73 
1 1 1 15  7  29 o 36.28413 11.64077 63.22163  262.9 ?              ?        0.80 
1 1 1 15  9  0  o 568.3907 5.054353 760.1091  114.5 -11.01263      10.10871 0.99 
1 1 1 15  9  1  o 60.74037 5.434489 70.52839  197.3 29.81539       10.86898 0.28 
1 1 1 15  9  2  o 485.8621 5.777226 655.2618  268.6 10.25482       11.55445 0.99 
1 1 1 15  9  3  o 169.0051 2.777627 130.2035  24.6  -35.01065      5.555253 0.82 
1 1 1 15  9  4  o 150.8567 2.755064 147.5355  89.1  -47.47540      5.510128 0.81 
1 1 1 15  9  5  o 121.6604 3.282016 166.0963  210.9 -5.466629      6.564032 0.82 
1 1 1 15  9  6  o 445.9681 4.485139 548.5565  357.6 10.95908       8.970278 0.99 
1 1 1 15  9  7  o 210.8006 3.255005 416.3762  27.1  2.533142       6.510010 0.97 
1 1 1 15  9  8  o 175.4865 2.785096 254.6555  138.3 -11.84131      5.570192 0.95 
1 1 1 15  9  9  o 98.86287 3.620093 199.4387  149.0 -25.03890      7.240187 0.91 
1 1 1 15  9  10 o 115.8043 3.313148 154.8528  204.8 -11.72581      6.626296 0.90 
1 1 1 15  9  11 o 102.7479 3.619855 63.04577  150.5 28.11083       7.239710 0.70 
1 1 1 15  9  12 o 98.10233 3.751482 225.5126  25.6  1.637993       7.502965 0.93 
1 1 1 15  9  13 o 160.4009 3.955229 229.7700  11.4  14.83818       7.910458 0.96 
1 1 1 15  9  14 o 63.95964 9.080139 64.75548  16.9  15.22669       18.16028 0.68 
1 1 1 15  9  15 f 226.0739 4.195706 320.9995  200.6 0.5081482      8.391412 0.00 
1 1 1 15  9  16 o 92.36342 6.938869 192.3817  286.1 -10.02039      13.87774 0.95 
1 1 1 15  9  17 o 58.04059 9.916623 119.8393  264.6 16.96339       19.83325 0.87 
1 1 1 15  9  18 o 73.78651 8.633006 99.64976  163.3 -0.3299713     17.26601 0.91 
1 1 1 15  9  19 o 189.0227 5.102324 272.6019  71.4  -9.059128      10.20465 0.99 
1 1 1 15  9  20 o 116.1303 6.878211 191.1650  40.9  -26.42621      13.75642 0.96 
1 1 1 15  9  21 o 55.12436 12.25133 56.14833  225.7 23.57295       24.50266 0.67 
1 1 1 15  9  22 o 69.57313 9.323033 41.73723  180.0 -34.16275      18.64607 0.72 
1 1 1 15  9  23 o 42.38938 11.92148 12.69488  60.4  -12.77529      23.84296 0.22 
1 1 1 15  9  24 o 48.45870 12.71025 73.00575  188.7 2.272106       25.42049 0.84 
1 1 1 15  9  25 o 61.83460 12.22909 99.81338  179.8 8.298080       24.45819 0.92 
1 1 1 15  9  26 o 69.59730 12.21284 77.88052  297.5 12.28892       24.42568 0.91 
1 1 1 15  9  27 o 49.90680 13.60911 60.54866  286.1 ?              ?        0.84 
1 1 1 15  11 0  o 376.4490 4.134713 529.1026  9.1   29.26450       8.269426 0.99 
1 1 1 15  11 1  o 291.6682 3.515917 489.5311  13.6  15.35577       7.031833 0.99 
1 1 1 15  11 2  o 139.5530 4.092961 143.3656  187.5 5.068542       8.185922 0.92 
1 1 1 15  11 3  o 249.2800 3.254877 479.4349  249.3 -14.51376      6.509754 0.99 
1 1 1 15  11 4  o 133.3183 3.313021 149.5238  204.2 -5.975052      6.626042 0.93 
1 1 1 15  11 5  o 60.14505 6.778465 169.7578  265.6 8.686073       13.55693 0.84 
1 1 1 15  11 6  o 83.90825 4.792738 181.4784  290.0 -7.735420      9.585476 0.90 
1 1 1 15  11 7  o 290.0242 3.567483 545.6018  302.7 19.57278       7.134967 0.99 
1 1 1 15  11 8  o 121.2056 3.666461 174.7936  284.2 16.89129       7.332921 0.95 
1 1 1 15  11 9  o 184.4458 2.911419 286.2341  140.8 -10.01222      5.822837 0.98 
1 1 1 15  11 10 o 156.6914 3.026821 272.2141  287.2 -15.78543      6.053643 0.98 
1 1 1 15  11 11 o 307.6627 3.293976 492.0943  270.3 2.127502       6.587952 0.99 
1 1 1 15  11 12 o 107.1404 3.640027 130.6776  44.6  0.1001663      7.280054 0.94 
1 1 1 15  11 13 o 51.03185 7.073713 149.7668  32.8  38.58167       14.14743 0.90 
1 1 1 15  11 14 o 105.4848 6.976909 144.9494  90.5  1.841034       13.95382 0.96 
1 1 1 15  11 15 o 49.77734 11.47648 61.82007  107.5 0.2499847      22.95296 0.72 
1 1 1 15  11 16 o 151.3867 5.278053 207.6283  246.8 -19.70399      10.55611 0.98 
1 1 1 15  11 17 o 163.4842 4.980033 229.4749  189.2 -30.80458      9.960067 0.98 
1 1 1 15  11 18 o 104.8896 7.849353 202.9201  71.5  32.37248       15.69871 0.97 
1 1 1 15  11 19 o 74.86499 10.48633 132.2632  334.5 3.411232       20.97265 0.93 
1 1 1 15  11 20 o 80.95719 11.41058 170.9488  232.9 46.25689       22.82116 0.96 
1 1 1 15  11 21 o 57.83289 12.98176 82.38154  257.6 -1.409702      25.96353 0.89 
1 1 1 15  11 22 o 58.95755 13.78280 112.4445  233.8 -33.03796      27.56560 0.92 
1 1 1 15  11 23 f 100.3162 9.597771 171.6820  225.1 -1.191353      19.19554 0.00 
1 1 1 15  11 24 o 42.87484 13.27183 35.00419  348.8 -19.95465      26.54366 0.64 
1 1 1 15  11 25 x ?        ?        81.00039  11.5  ?              ?        0.00 
1 1 1 15  13 0  o 140.2926 3.854562 277.6578  221.6 26.73793       7.709124 0.98 
1 1 1 15  13 1  o 159.5759 5.756513 243.5773  251.7 4.255737       11.51303 0.98 
1 1 1 15  13 2  o 136.0823 4.495717 185.9191  26.2  45.11681       8.991434 0.97 
1 1 1 15  13 3  o 108.3280 4.663873 125.8646  75.2  5.732460       9.327746 0.94 
1 1 1 15  13 4  o 55.61149 8.602839 73.06229  175.8 4.115170       17.20568 0.77 
1 1 1 15  13 5  o 28.79192 8.636102 49.36553  162.4 3.572983       17.27220 0.43 
1 1 1 15  13 6  o 203.1093 3.629692 338.0168  67.8  12.06267       7.259383 0.99 
1 1 1 15  13 7  o 81.70746 5.956319 117.1675  270.9 -9.052559      11.91264 0.94 
1 1 1 15  13 8  o 134.3454 3.946444 191.6545  276.0 0.1620331      7.892887 0.98 
1 1 1 15  13 9  o 142.1764 4.344873 216.1117  94.4  -20.91228      8.689746 0.98 
1 1 1 15  13 10 o 234.5612 3.110792 444.8434  172.8 48.01570       6.221585 0.99 
1 1 1 15  13 11 o 196.8417 3.194152 359.8915  145.2 37.57059       6.388303 0.99 
1 1 1 15  13 12 o 129.0710 3.443420 214.4025  149.0 2.568222       6.886840 0.97 
1 1 1 15  13 13 o 50.20098 7.171518 153.9297  92.3  7.594082       14.34304 0.91 
1 1 1 15  13 14 o 79.91729 10.87295 72.78621  337.9 -12.28038      21.74590 0.87 
1 1 1 15  13 15 o 45.60066 11.81575 31.25815  319.3 -43.47188      23.63151 0.50 
1 1 1 15  13 16 o 42.08163 12.23465 77.55147  74.2  -26.73894      24.46929 0.81 
1 1 1 15  13 17 o 67.54523 11.71341 80.55925  136.1 -30.98067      23.42682 0.91 
1 1 1 15  13 18 o 45.42549 11.69553 90.74052  102.7 4.597546       23.39107 0.89 
1 1 1 15  13 19 o 88.39934 11.82974 134.6698  71.6  22.33173       23.65949 0.96 
1 1 1 15  13 20 o 78.26251 12.10016 136.6736  174.0 30.60583       24.20033 0.96 
1 1 1 15  13 21 o 35.26115 11.46438 85.80932  173.2 ?              ?        0.86 
1 1 1 15  15 0  o 77.44327 8.345773 127.5618  181.8 14.20591       16.69155 0.93 
1 1 1 15  15 1  o 67.85941 8.681053 143.7367  65.1  -3.143013      17.36211 0.93 
1 1 1 15  15 2  o 53.44499 8.064951 104.0244  59.5  51.97115       16.12990 0.87 
1 1 1 15  15 3  o 48.95846 10.47390 89.36085  263.7 6.971836       20.94779 0.82 
1 1 1 15  15 4  o 108.0232 5.755390 180.7594  288.4 36.60018       11.51078 0.97 
1 1 1 15  15 5  o 36.22129 10.29558 94.70161  255.2 3.520790       20.59116 0.77 
1 1 1 15  15 6  o 37.43204 10.36334 79.31873  207.1 3.106297       20.72667 0.74 
1 1 1 15  15 7  o 64.75445 9.140122 134.6485  145.4 -42.58505      18.28024 0.93 
1 1 1 15  15 8  o 108.0456 5.635921 157.4013  343.3 24.28471       11.27184 0.97 
1 1 1 15  15 9  o 107.1215 5.475763 193.4409  337.3 -20.42568      10.95153 0.98 
1 1 1 15  15 10 o 68.69237 8.185932 124.8033  346.7 6.824791       16.37186 0.95 
1 1 1 15  15 11 o 47.76307 8.832867 79.56361  205.5 -23.20260      17.66573 0.89 
1 1 1 15  15 12 o 59.69942 7.309007 96.75611  184.0 -2.479568      14.61801 0.94 
1 1 1 15  15 13 o 34.44490 8.489075 39.95102  347.1 9.643736       16.97815 0.69 
1 1 1 15  15 14 o 59.74741 12.50468 110.1215  145.5 0.8962440      25.00937 0.93 
1 1 1 15  15 15 o 26.17188 9.471003 13.14281  283.8 -16.33686      18.94201 0.24 
1 1 1 15  15 16 o 29.88869 11.61358 32.41082  320.1 ?              ?        0.54 
1 1 1 15  15 17 o 56.95559 11.13346 69.54533  327.7 ?              ?        0.91 
1 1 1 15  17 0  o 85.88483 7.966071 168.2749  136.7 -3.011650      15.93214 0.98 
1 1 1 15  17 1  o 55.42379 11.94879 108.8179  306.0 3.722336       23.89758 0.93 
1 1 1 15  17 2  o 118.0180 8.548343 243.7478  327.6 -27.13598      17.09669 0.99 
1 1 1 15  17 3  o 70.46683 11.07695 170.5038  9.0   2.226730       22.15391 0.97 
1 1 1 15  17 4  o 43.45550 11.65656 57.07346  78.5  -12.43152      23.31311 0.82 
1 1 1 15  17 5  o 36.91753 12.05138 65.30367  254.1 -1.937176      24.10276 0.81 
1 1 1 15  17 6  o 43.15155 11.62833 72.73202  11.0  6.495628       23.25667 0.86 
1 1 1 15  17 7  o 79.00869 10.38022 117.8888  347.5 -44.51524      20.76044 0.96 
1 1 1 15  17 8  f 57.49100 10.84877 115.1553  359.8 -21.34690      21.69754 0.00 
1 1 1 15  17 9  o 67.48642 11.17394 113.3839  59.6  ?              ?        0.95 
1 1 1 15  17 10 o 40.88226 11.11500 89.27190  26.3  ?              ?        0.90 
1 1 1 16  0  0  o 475.7488 5.928583 839.7340  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  1  o 358.6538 4.738556 127.7308  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  2  o 26.14716 7.096500 222.8559  0.0   0.000000       0.000000 0.01 
1 1 1 16  0  3  o 67.55328 2.908265 921.4572  0.0   0.000000       0.000000 0.08 
1 1 1 16  0  4  o 318.3006 4.053280 203.1079  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  5  o 268.5175 3.413030 598.3780  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  6  o 92.56203 3.663942 10.26897  0.0   0.000000       0.000000 0.55 
1 1 1 16  0  7  o 68.00198 4.219011 326.7647  0.0   0.000000       0.000000 0.34 
1 1 1 16  0  8  o 65.74122 4.230051 14.02635  180.0 0.000000       0.000000 0.21 
1 1 1 16  0  9  o 28.33551 10.28136 105.9947  180.0 0.000000       0.000000 0.07 
1 1 1 16  0  10 o 35.30309 9.633174 22.43366  0.0   0.000000       0.000000 0.06 
1 1 1 16  0  11 o 126.6882 3.939993 174.8271  0.0   0.000000       0.000000 0.60 
1 1 1 16  0  12 o 80.12538 4.243375 263.1685  180.0 0.000000       0.000000 0.59 
1 1 1 16  0  13 o 295.7737 5.145748 403.6250  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  14 o 809.1522 10.38055 952.3087  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  15 o 149.3129 4.896219 96.03895  0.0   0.000000       0.000000 0.76 
1 1 1 16  0  16 o 493.1846 7.253458 701.9061  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  17 o 141.0016 4.488704 259.6833  180.0 0.000000       0.000000 1.00 
1 1 1 16  0  18 f 412.0951 6.738062 505.3029  180.0 0.000000       0.000000 0.00 
1 1 1 16  0  19 o 201.5930 4.505320 275.0963  180.0 0.000000       0.000000 1.00 
1 1 1 16  0  20 o 62.31884 10.91962 43.82959  180.0 0.000000       0.000000 0.42 
1 1 1 16  0  21 o 15.39051 11.01613 42.83278  180.0 0.000000       0.000000 0.14 
1 1 1 16  0  22 f 244.1563 5.580153 395.9688  0.0   0.000000       0.000000 0.00 
1 1 1 16  0  23 o 50.45780 23.40979 87.35986  180.0 0.000000       0.000000 0.80 
1 1 1 16  0  24 o 86.48909 11.20110 118.0495  0.0   0.000000       0.000000 1.00 
1 1 1 16  0  25 f 83.40536 11.54421 103.1336  0.0   0.000000       0.000000 0.00 
1 1 1 16  0  26 o 44.84495 25.24396 7.500539  180.0 0.000000       0.000000 0.08 
1 1 1 16  0  27 o 88.21997 12.87873 30.35559  0.0   0.000000       0.000000 0.71 
1 1 1 16  0  28 o 55.46980 21.07800 111.7784  0.0   0.000000       0.000000 0.98 
1 1 1 16  0  29 o 81.37595 14.99192 87.94271  180.0 0.000000       0.000000 1.00 
1 1 1 16  0  30 o 21.05206 15.00155 1.553072  180.0 0.000000       0.000000 0.02 
1 1 1 16  0  31 o 36.18126 21.85086 44.72053  180.0 ?              ?        0.66 
1 1 1 16  2  0  o 443.4321 3.862446 503.4276  198.1 32.32373       7.724892 0.98 
1 1 1 16  2  1  o 400.7076 3.621850 673.7966  288.4 69.07495       7.243701 0.98 
1 1 1 16  2  2  o 173.8565 2.335585 93.41194  162.2 -47.39452      4.671169 0.84 
1 1 1 16  2  3  o 567.0237 4.513318 741.2020  158.8 -7.982971      9.026636 0.99 
1 1 1 16  2  4  o 633.9779 5.004850 986.3298  101.4 -0.5544434     10.00970 0.98 
1 1 1 16  2  5  o 233.5886 2.514371 500.9020  200.7 29.66743       5.028742 0.92 
1 1 1 16  2  6  o 167.9231 2.061611 368.2239  207.7 14.55501       4.123222 0.76 
1 1 1 16  2  7  o 204.5887 2.235853 90.12309  292.2 -24.69194      4.471706 0.79 
1 1 1 16  2  8  o 545.7174 4.200804 726.5291  137.7 -13.37415      8.401608 0.98 
1 1 1 16  2  9  f 406.8629 3.998087 490.6964  94.3  -44.44669      7.996173 0.00 
1 1 1 16  2  10 o 340.3297 3.413924 394.1958  57.2  27.91702       6.827849 0.94 
1 1 1 16  2  11 o 1122.646 8.735507 1610.255  192.7 37.36145       17.47101 1.00 
1 1 1 16  2  12 o 264.5670 3.054744 397.3484  344.1 -1.013428      6.109488 0.93 
1 1 1 16  2  13 o 84.37038 3.758364 114.5727  287.8 0.1320724      7.516729 0.32 
1 1 1 16  2  14 o 149.7224 2.770083 141.4893  22.7  -40.05768      5.540167 0.64 
1 1 1 16  2  15 o 305.8890 3.171887 435.1326  191.7 23.89139       6.343774 0.97 
1 1 1 16  2  16 o 93.80549 3.983063 111.0002  263.1 -12.06026      7.966125 0.62 
1 1 1 16  2  17 o 377.9112 3.793587 530.5235  312.3 -8.618713      7.587175 0.99 
1 1 1 16  2  18 o 160.3645 4.451762 185.2829  274.5 -17.41498      8.903524 0.94 
1 1 1 16  2  19 o 73.88718 5.580170 93.89488  192.0 -8.805382      11.16034 0.72 
1 1 1 16  2  20 o 215.0352 3.924728 351.4316  8.2   1.822754       7.849455 0.98 
1 1 1 16  2  21 o 209.5804 3.644783 354.4422  30.7  -11.27382      7.289566 0.99 
1 1 1 16  2  22 o 126.9604 4.759331 168.6187  196.4 -0.2643433     9.518661 0.95 
1 1 1 16  2  23 o 61.25589 10.06932 97.10907  58.6  15.43443       20.13864 0.85 
1 1 1 16  2  24 o 209.1462 4.048934 269.4929  322.4 -23.64519      8.097868 0.99 
1 1 1 16  2  25 o 33.23308 10.65610 26.34705  25.8  -3.623608      21.31220 0.21 
1 1 1 16  2  26 o 166.0697 5.344211 252.2741  93.6  3.669357       10.68842 0.98 
1 1 1 16  2  27 o 39.15279 11.14408 62.61740  28.5  10.69669       22.28816 0.64 
1 1 1 16  2  28 o 44.53004 12.45751 76.97633  353.3 18.03016       24.91501 0.81 
1 1 1 16  2  29 o 27.05700 9.303019 40.37326  314.9 -3.903286      18.60604 0.51 
1 1 1 16  2  30 o 49.30916 12.81807 82.97170  6.1   -30.18354      25.63614 0.87 
1 1 1 16  2  31 o 46.71469 14.06084 14.64153  129.7 ?              ?        0.35 
1 1 1 16  4  0  o 283.3014 2.786047 756.6726  231.9 -3.983521      5.572093 0.96 
1 1 1 16  4  1  o 303.6572 3.308961 507.4301  329.9 -9.082306      6.617922 0.96 
1 1 1 16  4  2  o 207.1865 2.858165 401.7571  259.2 -108.2136      5.716329 0.90 
1 1 1 16  4  3  o 411.8954 4.120850 778.1759  94.6  7.843262       8.241700 0.97 
1 1 1 16  4  4  f 115.8380 2.477236 400.1614  114.5 29.77517       4.954472 0.00 
1 1 1 16  4  5  o 468.2646 4.317882 858.1349  78.2  53.34479       8.635764 0.98 
1 1 1 16  4  6  o 612.6726 5.465119 784.9753  163.9 -86.50958      10.93024 0.98 
1 1 1 16  4  7  o 388.0993 3.781753 816.4327  178.0 5.419617       7.563506 0.98 
1 1 1 16  4  8  o 558.6479 4.929871 723.1816  307.1 12.81238       9.859741 0.98 
1 1 1 16  4  9  o 374.1881 3.273281 602.1459  79.5  38.18860       6.546561 0.97 
1 1 1 16  4  10 o 405.1996 3.479945 417.7486  171.3 -27.38898      6.959890 0.96 
1 1 1 16  4  11 o 214.0108 2.929134 315.1154  261.2 -45.87064      5.858269 0.89 
1 1 1 16  4  12 o 428.0997 3.912044 744.5536  330.4 15.24524       7.824087 0.98 
1 1 1 16  4  13 o 143.6471 3.110186 261.4221  54.2  19.07256       6.220371 0.85 
1 1 1 16  4  14 o 106.8458 3.524359 111.5197  348.3 -9.592484      7.048718 0.61 
1 1 1 16  4  15 o 607.1403 5.670244 926.3751  35.4  33.66949       11.34049 0.99 
1 1 1 16  4  16 o 168.3465 3.435550 251.2721  253.7 -50.83212      6.871099 0.95 
1 1 1 16  4  17 o 299.0354 3.379099 372.5402  192.7 17.52982       6.758198 0.98 
1 1 1 16  4  18 o 68.87749 5.964341 144.1176  315.7 5.702370       11.92868 0.79 
1 1 1 16  4  19 o 188.6074 3.215626 245.3944  143.8 16.80417       6.431252 0.97 
1 1 1 16  4  20 o 161.4077 3.652555 282.5890  106.9 25.70232       7.305109 0.98 
1 1 1 16  4  21 o 148.1267 3.845422 167.6569  258.5 10.02724       7.690843 0.96 
1 1 1 16  4  22 o 90.31858 6.104094 76.47579  90.6  7.520920       12.20819 0.87 
1 1 1 16  4  23 o 116.2728 5.633164 201.7062  109.2 26.74139       11.26633 0.97 
1 1 1 16  4  24 f 162.9355 4.400912 138.0257  243.6 7.505051       8.801824 0.00 
1 1 1 16  4  25 f 106.7397 6.160262 118.9768  250.2 6.834084       12.32052 0.00 
1 1 1 16  4  26 o 86.82668 7.172866 131.5421  216.7 -17.59853      14.34573 0.93 
1 1 1 16  4  27 o 32.33131 9.606750 58.97903  280.6 19.12435       19.21350 0.63 
1 1 1 16  4  28 o 70.56664 11.17616 122.3326  316.7 30.80054       22.35232 0.94 
1 1 1 16  4  29 o 35.57240 11.02828 14.02096  283.9 -16.03109      22.05657 0.25 
1 1 1 16  4  30 o 41.17606 11.63504 37.00710  130.8 6.308098       23.27007 0.65 
1 1 1 16  6  0  o 513.3192 4.487611 1243.285  316.5 -32.73727      8.975223 0.99 
1 1 1 16  6  1  o 515.5114 4.668235 502.3783  97.2  -5.279541      9.336471 0.98 
1 1 1 16  6  2  o 478.9749 4.772822 561.8007  296.6 -23.17557      9.545645 0.98 
1 1 1 16  6  3  o 332.1767 3.825217 563.0299  287.7 -14.23965      7.650434 0.97 
1 1 1 16  6  4  o 81.84299 4.805951 284.3811  349.8 -2.793991      9.611902 0.42 
1 1 1 16  6  5  o 106.6309 3.927530 78.24669  89.5  -74.97135      7.855061 0.46 
1 1 1 16  6  6  o 622.0520 5.219180 1006.116  56.2  29.93427       10.43836 0.99 
1 1 1 16  6  7  o 399.7457 6.052060 626.9016  40.3  ?              ?        0.97 
1 1 1 16  6  8  o 124.5765 2.890937 343.3727  193.3 19.28001       5.781875 0.81 
1 1 1 16  6  9  o 281.7287 3.202626 528.7906  190.9 49.07294       6.405252 0.96 
1 1 1 16  6  10 o 157.5682 2.842755 242.6244  231.1 8.427536       5.685510 0.84 
1 1 1 16  6  11 o 167.5807 3.496429 210.1454  161.8 -0.7070923     6.992858 0.85 
1 1 1 16  6  12 o 270.6889 3.749439 600.6710  230.0 -2.315735      7.498878 0.98 
1 1 1 16  6  13 o 169.6218 2.979051 422.0124  111.4 -29.24619      5.958101 0.96 
1 1 1 16  6  14 o 96.67012 4.347870 132.9413  12.6  15.98388       8.695741 0.85 
1 1 1 16  6  15 o 144.7457 3.507803 250.8052  318.1 -23.83127      7.015607 0.95 
1 1 1 16  6  16 o 264.8686 3.312898 451.8842  55.9  12.28754       6.625795 0.99 
1 1 1 16  6  17 o 261.4027 3.293560 401.5507  132.3 3.087341       6.587120 0.99 
1 1 1 16  6  18 o 117.8660 3.900349 160.7705  10.4  6.110680       7.800698 0.94 
1 1 1 16  6  19 o 52.05463 8.708069 82.44398  276.8 12.83268       17.41614 0.71 
1 1 1 16  6  20 o 96.17561 5.513279 99.29839  63.2  -35.21695      11.02656 0.90 
1 1 1 16  6  21 o 93.10984 5.901229 117.9443  31.9  -12.87677      11.80246 0.94 
1 1 1 16  6  22 o 75.64732 8.119465 107.8205  311.0 26.61562       16.23893 0.90 
1 1 1 16  6  23 o 125.1423 5.182569 114.5398  45.5  -3.785957      10.36514 0.93 
1 1 1 16  6  24 o 78.90333 7.906577 93.97182  159.8 -20.67918      15.81315 0.88 
1 1 1 16  6  25 o 58.43583 10.02218 42.90306  158.3 25.98084       20.04437 0.67 
1 1 1 16  6  26 o 54.58329 9.873237 93.86691  253.4 33.29909       19.74647 0.89 
1 1 1 16  6  27 o 39.85445 11.17739 27.92734  105.0 -26.18604      22.35479 0.51 
1 1 1 16  6  28 o 70.87357 11.48669 119.5143  0.5   31.83688       22.97338 0.94 
1 1 1 16  6  29 o 53.56798 12.76372 16.37846  194.7 ?              ?        0.44 
1 1 1 16  8  0  o 209.8018 2.605177 277.7330  268.6 27.06728       5.210355 0.85 
1 1 1 16  8  1  o 116.8577 3.712264 195.5286  354.9 29.57224       7.424527 0.72 
1 1 1 16  8  2  o 155.4883 3.705938 227.9152  196.4 -40.70590      7.411877 0.81 
1 1 1 16  8  3  o 495.7341 4.840619 763.5530  43.0  0.7662048      9.681237 0.98 
1 1 1 16  8  4  o 120.4477 3.049242 29.16442  158.3 -36.23434      6.098484 0.16 
1 1 1 16  8  5  o 189.7794 4.390976 330.2908  164.0 2.571838       8.781953 0.92 
1 1 1 16  8  6  o 345.2622 3.885494 482.8606  12.1  30.39377       7.770988 0.97 
1 1 1 16  8  7  o 32.72010 7.897221 92.65807  17.2  -8.560713      15.79444 0.17 
1 1 1 16  8  8  o 273.5807 2.963497 379.6929  163.4 -27.19913      5.926995 0.97 
1 1 1 16  8  9  f 48.37965 6.932234 141.5405  82.8  -3.703812      13.86447 0.00 
1 1 1 16  8  10 o 159.4043 3.084325 345.4429  11.8  21.07144       6.168650 0.96 
1 1 1 16  8  11 f 224.0577 2.903598 190.1001  342.1 -15.32198      5.807196 0.00 
1 1 1 16  8  12 o 315.3414 3.270945 498.4596  8.0   -5.022583      6.541890 0.99 
1 1 1 16  8  13 o 34.97473 8.079101 56.49944  75.2  18.87203       16.15820 0.28 
1 1 1 16  8  14 o 141.7700 4.118484 207.8411  26.7  -21.61148      8.236967 0.95 
1 1 1 16  8  15 o 212.4654 3.857921 379.5289  113.8 25.31459       7.715843 0.99 
1 1 1 16  8  16 o 61.70406 9.380095 43.48194  59.1  -16.83012      18.76019 0.54 
1 1 1 16  8  17 o 32.80796 9.647589 68.64309  204.4 -12.48313      19.29518 0.49 
1 1 1 16  8  18 o 47.94635 10.88647 26.19782  149.4 3.162315       21.77293 0.34 
1 1 1 16  8  19 o 70.22952 8.365225 54.24356  282.1 18.76309       16.73045 0.81 
1 1 1 16  8  20 o 40.34060 10.62617 79.70076  343.5 -5.725426      21.25235 0.70 
1 1 1 16  8  21 o 115.4875 5.902323 214.5898  6.2   -40.62199      11.80465 0.96 
1 1 1 16  8  22 o 61.66391 10.45537 51.84880  90.3  2.394035       20.91073 0.68 
1 1 1 16  8  23 o 54.82082 11.33292 35.16256  99.8  16.30043       22.66585 0.56 
1 1 1 16  8  24 o 48.11086 11.95181 99.34135  207.4 2.518326       23.90362 0.87 
1 1 1 16  8  25 o 55.37759 11.58575 43.70187  229.0 13.65429       23.17150 0.78 
1 1 1 16  8  26 o 37.65451 11.44048 59.35022  260.0 -14.06308      22.88095 0.76 
1 1 1 16  8  27 f 37.16561 11.94445 61.14661  280.5 -0.4796219     23.88890 0.00 
1 1 1 16  8  28 o 39.34393 12.05962 58.99775  4.2   ?              ?        0.81 
1 1 1 16  10 0  o 192.1611 3.048308 394.1812  313.2 4.460999       6.096616 0.96 
1 1 1 16  10 1  o 177.7762 2.989552 239.4830  59.7  -4.531601      5.979103 0.93 
1 1 1 16  10 2  o 167.1723 3.131153 228.4710  70.9  5.164307       6.262306 0.94 
1 1 1 16  10 3  o 203.1831 3.373563 366.8919  246.2 -6.806793      6.747126 0.97 
1 1 1 16  10 4  o 302.6865 3.310606 412.7819  261.0 2.414154       6.621212 0.99 
1 1 1 16  10 5  o 120.2418 3.597596 230.4621  320.8 -65.57684      7.195193 0.94 
1 1 1 16  10 6  f 378.3523 4.022481 639.4932  81.4  11.98813       8.044963 0.00 
1 1 1 16  10 7  o 197.5343 3.137166 306.7146  319.1 -2.129822      6.274333 0.98 
1 1 1 16  10 8  o 265.5432 3.351740 354.8634  241.3 5.755707       6.703480 0.98 
1 1 1 16  10 9  o 208.5714 2.865047 427.7844  203.4 -7.919220      5.730094 0.98 
1 1 1 16  10 10 o 73.93309 4.990638 63.16605  218.0 2.570114       9.981276 0.67 
1 1 1 16  10 11 o 188.3642 2.871553 304.3259  160.9 9.232010       5.743106 0.98 
1 1 1 16  10 12 o 102.3728 3.763978 190.5267  191.2 8.877693       7.527956 0.95 
1 1 1 16  10 13 o 133.1269 3.282184 167.5806  10.9  10.57414       6.564369 0.96 
1 1 1 16  10 14 o 161.5874 4.895837 313.2093  131.0 -38.77057      9.791674 0.98 
1 1 1 16  10 15 o 92.95497 7.457366 159.8281  189.2 3.139961       14.91473 0.95 
1 1 1 16  10 16 o 29.81615 9.484741 65.81279  146.6 -9.723063      18.96948 0.63 
1 1 1 16  10 17 o 123.6947 6.181038 226.2319  25.0  -2.430519      12.36208 0.97 
1 1 1 16  10 18 o 105.5754 7.658362 129.8178  311.9 3.961021       15.31672 0.94 
1 1 1 16  10 19 o 141.8056 5.697975 189.0654  234.9 -1.196411      11.39595 0.97 
1 1 1 16  10 20 o 45.09705 12.93309 99.30540  184.3 -15.95067      25.86617 0.81 
1 1 1 16  10 21 o 114.0472 8.308515 143.0708  4.0   17.66301       16.61703 0.97 
1 1 1 16  10 22 o 37.23326 11.80334 6.909763  35.9  -15.52047      23.60667 0.13 
1 1 1 16  10 23 o 40.86536 11.61363 68.48161  282.7 13.03124       23.22726 0.82 
1 1 1 16  10 24 o 47.82513 12.93488 58.16821  243.0 17.57259       25.86975 0.80 
1 1 1 16  10 25 o 44.94459 13.05143 88.25407  295.2 1.779152       26.10286 0.88 
1 1 1 16  10 26 x ?        ?        73.40202  286.7 ?              ?        0.00 
1 1 1 16  12 0  o 128.8137 5.245496 221.8545  119.4 3.466202       10.49099 0.96 
1 1 1 16  12 1  o 78.27869 4.974166 96.67719  25.5  3.487114       9.948332 0.84 
1 1 1 16  12 2  o 82.06580 5.109162 85.55517  259.7 31.45666       10.21832 0.83 
1 1 1 16  12 3  o 105.2801 4.408328 268.1893  302.9 21.88982       8.816656 0.96 
1 1 1 16  12 4  f 126.9034 3.994129 106.2632  186.1 4.454048       7.988258 0.00 
1 1 1 16  12 5  o 133.3042 4.681303 205.0510  296.6 20.31078       9.362605 0.97 
1 1 1 16  12 6  o 177.2026 3.440701 331.9175  32.9  -19.75497      6.881401 0.99 
1 1 1 16  12 7  o 248.5969 3.369828 371.7172  149.9 10.90511       6.739655 0.99 
1 1 1 16  12 8  o 196.8956 3.361616 308.2375  219.3 0.1942749      6.723232 0.99 
1 1 1 16  12 9  o 173.4563 3.326286 287.8883  297.0 9.244339       6.652573 0.99 
1 1 1 16  12 10 o 93.60645 4.371381 130.7182  256.4 2.532349       8.742762 0.95 
1 1 1 16  12 11 o 71.71565 5.601009 101.6155  158.6 -1.825783      11.20202 0.92 
1 1 1 16  12 12 o 249.3589 3.056432 433.3307  181.2 -6.560455      6.112863 0.99 
1 1 1 16  12 13 f 160.6774 3.131161 238.0000  253.3 -7.100082      6.262322 0.00 
1 1 1 16  12 14 o 41.37621 11.35202 93.78667  246.1 -6.522167      22.70405 0.74 
1 1 1 16  12 15 o 148.8340 5.751212 173.1731  162.6 -33.92989      11.50242 0.97 
1 1 1 16  12 16 o 102.8970 8.422471 118.9695  110.8 17.09990       16.84494 0.94 
1 1 1 16  12 17 o 100.5583 8.538981 102.6981  211.8 -21.00576      17.07796 0.94 
1 1 1 16  12 18 o 117.9185 8.095675 206.3689  148.9 -16.38718      16.19135 0.98 
1 1 1 16  12 19 o 58.44427 13.48380 135.2087  75.9  -10.44864      26.96760 0.94 
1 1 1 16  12 20 o 47.67675 12.93068 55.49744  268.6 -34.86352      25.86136 0.80 
1 1 1 16  12 21 o 49.14464 12.61239 79.44098  233.6 15.53084       25.22478 0.87 
1 1 1 16  12 22 o 46.33906 13.60053 67.05997  106.3 -8.569355      27.20106 0.84 
1 1 1 16  12 23 o 65.21004 11.20276 103.2707  108.4 ?              ?        0.95 
1 1 1 16  14 0  o 120.4061 4.905751 279.2910  185.5 17.58257       9.811502 0.99 
1 1 1 16  14 1  o 162.4186 3.957747 332.5752  273.4 18.71503       7.915494 0.99 
1 1 1 16  14 2  o 124.6676 4.825956 150.1111  311.9 -45.67654      9.651912 0.97 
1 1 1 16  14 3  o 86.47526 8.958657 147.4179  276.9 -45.06203      17.91731 0.95 
1 1 1 16  14 4  o 62.21109 8.904891 78.76255  308.8 -17.35942      17.80978 0.86 
1 1 1 16  14 5  o 107.2658 5.331605 150.6772  103.8 13.19788       10.66321 0.96 
1 1 1 16  14 6  f 81.95139 7.474472 137.5656  318.7 37.59462       14.94894 0.00 
1 1 1 16  14 7  o 136.0795 4.540370 253.5268  321.0 -21.73676      9.080741 0.98 
1 1 1 16  14 8  o 117.6881 4.773117 164.5617  20.6  31.71761       9.546234 0.96 
1 1 1 16  14 9  o 92.88133 6.097872 84.76226  57.5  19.65775       12.19574 0.91 
1 1 1 16  14 10 o 87.74501 5.238701 86.33754  237.8 -4.722481      10.47740 0.92 
1 1 1 16  14 11 o 59.72012 7.252698 104.8412  209.0 -1.212788      14.50540 0.91 
1 1 1 16  14 12 o 75.65386 6.683575 89.85886  68.2  25.32139       13.36715 0.93 
1 1 1 16  14 13 o 48.60484 8.047618 64.92727  65.3  -15.94143      16.09524 0.84 
1 1 1 16  14 14 o 45.92007 9.196556 109.8070  168.6 21.56207       18.39311 0.92 
1 1 1 16  14 15 o 47.55172 10.96419 83.06953  282.4 3.707783       21.92837 0.89 
1 1 1 16  14 16 o 78.77373 11.69409 92.28650  129.5 4.917053       23.38818 0.94 
1 1 1 16  14 17 o 41.80840 9.907896 74.30471  230.2 16.32286       19.81579 0.87 
1 1 1 16  14 18 o 39.82999 11.16254 58.22117  299.0 3.442482       22.32507 0.81 
1 1 1 16  14 19 o 30.17819 10.61840 28.16455  82.0  ?              ?        0.53 
1 1 1 16  16 0  f 49.25893 11.00303 51.78127  5.4   -13.26539      22.00607 0.00 
1 1 1 16  16 1  o 36.63692 10.34102 120.1142  308.6 17.62010       20.68204 0.88 
1 1 1 16  16 2  o 61.25891 8.685690 167.5582  352.1 -56.91351      17.37138 0.96 
1 1 1 16  16 3  o 67.52486 10.05311 176.0065  51.7  15.34695       20.10621 0.96 
1 1 1 16  16 4  o 78.69778 8.228566 177.3500  107.3 5.898018       16.45713 0.97 
1 1 1 16  16 5  o 58.65327 14.35936 81.36919  157.6 -26.29994      28.71873 0.88 
1 1 1 16  16 6  o 77.12343 9.478636 136.7923  131.0 22.66425       18.95727 0.96 
1 1 1 16  16 7  o 47.53499 11.55527 89.34820  84.4  -18.97888      23.11053 0.90 
1 1 1 16  16 8  o 102.7398 6.554893 215.8711  25.8  -0.8838654E-01 13.10979 0.99 
1 1 1 16  16 9  o 43.21159 10.84982 55.29236  86.2  -11.15947      21.69964 0.82 
1 1 1 16  16 10 o 92.78627 6.574262 195.1459  199.7 19.84444       13.14852 0.98 
1 1 1 16  16 11 o 31.11573 9.273255 45.91629  134.3 -6.573709      18.54651 0.71 
1 1 1 16  16 12 o 80.23837 5.968483 154.3064  38.2  -11.38380      11.93697 0.98 
1 1 1 16  16 13 o 24.45961 7.856764 22.02592  154.1 ?              ?        0.43 
1 1 1 16  16 14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 16  18 0  o 35.17971 10.87545 60.06985  313.4 ?              ?        0.82 
1 1 1 16  18 1  o 58.95750 12.13951 71.75130  3.5   ?              ?        0.91 
1 1 1 16  18 2  f 75.06874 11.77102 209.3720  6.3   ?              ?        0.00 
1 1 1 16  18 3  x ?        ?        142.9084  58.4  ?              ?        0.00 
1 1 1 17  1  0  o 408.1262 3.711922 976.5733  102.1 63.10889       7.423843 0.97 
1 1 1 17  1  1  o 217.4895 2.352530 154.2408  105.2 -73.38982      4.705060 0.88 
1 1 1 17  1  2  o 117.2298 2.155067 89.31420  62.3  104.9008       4.310134 0.58 
1 1 1 17  1  3  o 140.1468 2.018785 345.8281  286.5 -8.563904      4.037570 0.45 
1 1 1 17  1  4  o 346.7358 2.851634 478.5647  332.9 50.61990       5.703269 0.96 
1 1 1 17  1  5  o 266.4249 2.441126 684.7208  303.8 24.78918       4.882252 0.94 
1 1 1 17  1  6  f 543.1923 4.306156 678.5306  264.7 -15.06293      8.612312 0.00 
1 1 1 17  1  7  o 307.3000 2.829838 544.9975  174.4 -19.37247      5.659676 0.93 
1 1 1 17  1  8  o 241.5035 2.695336 404.3369  15.3  2.981689       5.390671 0.92 
1 1 1 17  1  9  o 487.3434 3.988153 625.2007  331.2 -63.97415      7.976306 0.97 
1 1 1 17  1  10 o 129.7917 2.203632 306.6150  175.3 -36.10736      4.407265 0.76 
1 1 1 17  1  11 o 445.3633 3.622217 584.1096  142.5 -15.42929      7.244434 0.97 
1 1 1 17  1  12 o 648.7804 6.080248 867.2023  50.5  -41.47467      12.16050 0.99 
1 1 1 17  1  13 o 365.6311 3.624016 344.1090  77.0  -7.175140      7.248031 0.95 
1 1 1 17  1  14 o 157.0148 3.972364 305.7891  58.6  14.54054       7.944727 0.89 
1 1 1 17  1  15 o 221.3665 3.006504 150.3197  103.1 40.52887       6.013009 0.86 
1 1 1 17  1  16 o 410.1479 3.978676 504.3759  59.5  26.59882       7.957351 0.99 
1 1 1 17  1  17 o 327.8773 4.051927 417.6764  262.5 36.30930       8.103853 0.99 
1 1 1 17  1  18 o 258.6082 3.709441 381.8866  324.2 14.26485       7.418881 0.98 
1 1 1 17  1  19 o 337.5327 4.367733 512.6615  151.4 22.44727       8.735466 0.99 
1 1 1 17  1  20 o 137.7400 4.109718 203.4530  194.1 -1.389374      8.219436 0.95 
1 1 1 17  1  21 o 33.07665 9.433117 73.93629  49.8  -1.300346      18.86623 0.47 
1 1 1 17  1  22 o 48.19965 10.15573 39.24658  49.0  6.742371       20.31146 0.41 
1 1 1 17  1  23 o 86.53082 7.281018 105.1815  280.7 51.19012       14.56204 0.91 
1 1 1 17  1  24 o 135.7117 7.547706 241.8663  302.7 34.67151       15.09541 0.98 
1 1 1 17  1  25 o 31.46629 9.913073 49.55334  357.1 5.228539       19.82615 0.36 
1 1 1 17  1  26 o 115.0031 6.982251 113.6197  232.2 4.088585       13.96450 0.93 
1 1 1 17  1  27 o 43.66956 11.76915 12.01473  296.9 -12.73172      23.53830 0.18 
1 1 1 17  1  28 o 51.61843 11.20989 98.27045  28.0  -38.04635      22.41977 0.88 
1 1 1 17  1  29 o 143.8086 7.205707 181.1693  230.0 21.94028       14.41141 0.98 
1 1 1 17  1  30 o 83.81302 11.55903 125.0445  224.9 -1.870590      23.11807 0.95 
1 1 1 17  1  31 o 40.60188 12.52758 50.13153  146.2 ?              ?        0.75 
1 1 1 17  3  0  o 276.4733 2.792574 768.2457  167.9 66.37029       5.585148 0.96 
1 1 1 17  3  1  o 248.0002 2.614412 337.6961  64.9  -15.38353      5.228824 0.86 
1 1 1 17  3  2  o 167.6559 2.464508 521.3273  97.4  49.31161       4.929017 0.72 
1 1 1 17  3  3  o 192.6686 2.652463 423.5782  169.9 -44.87289      5.304926 0.86 
1 1 1 17  3  4  o 185.5526 2.466637 406.2640  107.0 -35.64612      4.933275 0.90 
1 1 1 17  3  5  o 256.0051 2.751109 270.9413  194.5 11.97574       5.502218 0.91 
1 1 1 17  3  6  o 386.8537 3.422332 371.1143  157.9 -31.83105      6.844665 0.95 
1 1 1 17  3  7  o 665.0280 5.010925 874.1446  188.0 -31.42529      10.02185 0.99 
1 1 1 17  3  8  o 794.2911 5.861907 1240.944  300.0 37.63599       11.72381 0.99 
1 1 1 17  3  9  o 263.3098 3.290567 634.4006  323.8 -34.56685      6.581134 0.95 
1 1 1 17  3  10 o 409.8923 4.374245 555.1918  113.3 12.74255       8.748489 0.97 
1 1 1 17  3  11 o 700.9221 5.881089 1018.441  194.9 -54.16205      11.76218 0.99 
1 1 1 17  3  12 o 329.1519 3.403820 332.4401  27.8  7.850647       6.807640 0.92 
1 1 1 17  3  13 o 76.21404 4.326034 55.67208  169.4 0.9579697      8.652068 0.14 
1 1 1 17  3  14 o 244.3298 3.296566 494.3905  261.9 -64.06367      6.593132 0.96 
1 1 1 17  3  15 o 147.6953 3.324839 306.6650  191.1 16.12012       6.649678 0.93 
1 1 1 17  3  16 o 289.6309 4.172463 489.5881  260.3 -17.84845      8.344926 0.98 
1 1 1 17  3  17 o 97.35027 4.449580 178.4206  273.5 -16.81097      8.899159 0.90 
1 1 1 17  3  18 o 216.9880 3.894091 363.9916  275.0 ?              ?        0.98 
1 1 1 17  3  19 o 54.78940 6.973125 97.76112  213.5 -30.10396      13.94625 0.68 
1 1 1 17  3  20 o 157.9466 3.392914 236.3200  53.3  29.23798       6.785827 0.97 
1 1 1 17  3  21 o 230.8685 3.442267 378.8603  232.3 12.06444       6.884533 0.99 
1 1 1 17  3  22 o 53.03246 8.093335 35.46040  273.7 41.59412       16.18667 0.47 
1 1 1 17  3  23 o 79.55234 7.893273 114.6094  67.5  44.05145       15.78655 0.92 
1 1 1 17  3  24 o 163.6163 4.363145 210.0639  347.5 24.58858       8.726291 0.97 
1 1 1 17  3  25 o 126.3044 5.548829 134.5120  270.6 16.64201       11.09766 0.95 
1 1 1 17  3  26 o 136.4124 5.049800 202.1346  281.6 -15.02092      10.09960 0.97 
1 1 1 17  3  27 o 62.15712 11.21077 83.90166  235.5 -0.2430763     22.42154 0.87 
1 1 1 17  3  28 o 108.9670 7.047722 131.6159  23.1  23.07643       14.09544 0.97 
1 1 1 17  3  29 o 45.28364 11.43439 57.20261  23.2  11.71459       22.86878 0.78 
1 1 1 17  3  30 o 51.66484 12.50631 89.51292  26.1  11.14978       25.01262 0.89 
1 1 1 17  5  0  o 818.8290 6.871212 826.9213  214.3 -24.09369      13.74242 0.99 
1 1 1 17  5  1  o 714.7362 6.244167 1196.785  79.5  64.87921       12.48833 0.99 
1 1 1 17  5  2  o 251.9144 3.007413 789.2806  287.0 -5.810501      6.014826 0.95 
1 1 1 17  5  3  f 305.6235 3.462438 215.1996  211.3 38.45816       6.924876 0.00 
1 1 1 17  5  4  o 437.0469 4.526610 770.7734  267.6 11.49261       9.053220 0.98 
1 1 1 17  5  5  o 677.8081 5.813575 808.2582  18.6  0.3572998      11.62715 0.99 
1 1 1 17  5  6  o 459.7291 4.396577 663.6448  10.6  47.26715       8.793154 0.98 
1 1 1 17  5  7  o 263.7018 3.167706 454.9728  304.5 -18.41832      6.335412 0.94 
1 1 1 17  5  8  o 784.7848 6.301847 1119.578  46.8  48.46393       12.60369 0.99 
1 1 1 17  5  9  o 676.3848 5.719032 1006.342  87.4  -35.87170      11.43806 0.99 
1 1 1 17  5  10 o 459.6458 4.573736 479.2569  139.0 35.79715       9.147471 0.97 
1 1 1 17  5  11 o 96.04231 3.505013 72.74153  105.3 0.1900558      7.010026 0.22 
1 1 1 17  5  12 o 146.2224 2.984587 183.4492  314.8 -47.32747      5.969174 0.82 
1 1 1 17  5  13 o 204.1750 2.877631 232.3692  210.2 44.96609       5.755262 0.92 
1 1 1 17  5  14 o 263.7167 3.159804 355.5055  339.8 -34.15787      6.319608 0.97 
1 1 1 17  5  15 o 210.1250 2.997519 360.4897  38.4  -2.373657      5.995039 0.98 
1 1 1 17  5  16 f 227.4525 3.075258 332.2080  352.3 -1.829224      6.150516 0.00 
1 1 1 17  5  17 o 149.0718 3.413331 267.7637  45.8  17.13490       6.826662 0.96 
1 1 1 17  5  18 o 207.8624 4.043824 280.5845  299.3 -4.725174      8.087647 0.98 
1 1 1 17  5  19 o 30.68269 8.777104 27.69396  132.2 3.828228       17.55421 0.19 
1 1 1 17  5  20 o 60.56317 8.073503 49.51385  86.2  22.77991       16.14701 0.59 
1 1 1 17  5  21 o 84.27063 6.260812 69.19730  160.8 3.891418       12.52162 0.85 
1 1 1 17  5  22 o 206.8970 4.122952 240.4982  98.6  9.548859       8.245905 0.99 
1 1 1 17  5  23 o 30.89668 9.600238 54.61871  348.7 -9.478624      19.20048 0.41 
1 1 1 17  5  24 o 54.83160 10.32938 63.44028  352.9 -19.46180      20.65876 0.68 
1 1 1 17  5  25 o 48.62600 10.56893 44.54714  87.0  -38.71184      21.13786 0.57 
1 1 1 17  5  26 o 37.21872 11.15111 95.41182  221.5 -4.323818      22.30222 0.80 
1 1 1 17  5  27 o 37.66710 10.80195 48.20374  212.2 6.556076       21.60390 0.68 
1 1 1 17  5  28 o 76.41122 10.59703 70.38477  92.5  7.638451       21.19406 0.91 
1 1 1 17  5  29 o 70.98219 11.37334 119.1354  80.6  23.16325       22.74668 0.95 
1 1 1 17  5  30 x ?        ?        36.58987  328.8 ?              ?        0.00 
1 1 1 17  7  0  o 885.0903 7.049741 1271.003  271.5 -86.25934      14.09948 0.99 
1 1 1 17  7  1  o 308.1087 3.186477 458.3554  148.3 7.275085       6.372955 0.95 
1 1 1 17  7  2  o 374.8623 4.040586 392.0038  44.8  28.29480       8.081173 0.96 
1 1 1 17  7  3  o 546.8916 5.221961 955.8110  303.1 0.6095581      10.44392 0.99 
1 1 1 17  7  4  o 498.2101 5.958225 555.6707  39.9  1.881317       11.91645 0.98 
1 1 1 17  7  5  o 129.7679 3.179658 196.1458  276.9 11.49348       6.359316 0.73 
1 1 1 17  7  6  o 392.8663 4.253766 520.3077  274.3 -36.87469      8.507531 0.97 
1 1 1 17  7  7  o 68.38435 4.578916 94.81228  27.9  22.77413       9.157831 0.27 
1 1 1 17  7  8  o 171.6005 3.858135 297.2945  233.9 17.44872       7.716269 0.90 
1 1 1 17  7  9  o 321.0675 3.379822 469.4590  316.2 27.39825       6.759645 0.97 
1 1 1 17  7  10 o 164.1743 2.800262 242.0579  232.9 4.235138       5.600523 0.91 
1 1 1 17  7  11 o 216.7569 2.834820 358.0989  159.2 30.66628       5.669639 0.97 
1 1 1 17  7  12 o 291.2406 3.261275 517.5658  264.4 4.363281       6.522549 0.99 
1 1 1 17  7  13 o 275.2710 4.027340 378.8855  137.9 -9.901855      8.054681 0.98 
1 1 1 17  7  14 o 98.43530 5.777408 122.6653  10.4  -38.74519      11.55482 0.86 
1 1 1 17  7  15 o 105.7366 4.937331 122.6800  158.6 20.26191       9.874661 0.87 
1 1 1 17  7  16 o 184.3235 3.438199 281.1050  175.1 -11.96710      6.876398 0.98 
1 1 1 17  7  17 o 127.5211 4.387268 283.7284  216.7 -8.119385      8.774535 0.97 
1 1 1 17  7  18 o 163.7723 3.821428 204.4190  33.1  -10.69403      7.642855 0.97 
1 1 1 17  7  19 o 84.19325 6.285247 86.84254  150.3 -17.70213      12.57049 0.88 
1 1 1 17  7  20 o 59.59614 9.385460 84.35398  78.6  -50.26904      18.77092 0.86 
1 1 1 17  7  21 o 83.75615 7.080669 110.3774  350.0 -7.550766      14.16134 0.91 
1 1 1 17  7  22 o 78.19328 8.025537 141.3066  247.5 0.3538818      16.05107 0.92 
1 1 1 17  7  23 o 31.32230 10.13631 62.78842  336.4 -13.39653      20.27262 0.51 
1 1 1 17  7  24 o 36.24287 10.76718 34.69769  255.1 -12.57595      21.53436 0.43 
1 1 1 17  7  25 o 35.41467 10.87738 24.87673  35.2  -6.495667      21.75477 0.38 
1 1 1 17  7  26 o 37.69765 11.38080 57.78065  227.1 -18.53198      22.76161 0.75 
1 1 1 17  7  27 o 50.02460 12.29252 83.41869  152.4 17.89688       24.58504 0.88 
1 1 1 17  7  28 o 53.67263 12.85431 85.90556  133.2 ?              ?        0.90 
1 1 1 17  9  0  o 47.41251 5.902487 75.33254  49.5  -0.5177879     11.80497 0.18 
1 1 1 17  9  1  o 87.73447 3.847193 230.8611  35.5  4.181412       7.694386 0.75 
1 1 1 17  9  2  o 517.3173 6.113375 745.5399  322.7 -37.39297      12.22675 0.99 
1 1 1 17  9  3  o 193.1150 3.011811 304.1269  353.7 -10.48717      6.023621 0.93 
1 1 1 17  9  4  o 241.0649 3.211082 353.5943  191.8 2.509033       6.422164 0.96 
1 1 1 17  9  5  o 166.0747 2.953358 327.8202  270.2 -6.303360      5.906716 0.94 
1 1 1 17  9  6  o 135.6259 3.056512 153.9314  58.2  25.85467       6.113024 0.88 
1 1 1 17  9  7  o 235.5303 3.123861 436.2173  251.9 -7.336792      6.247721 0.98 
1 1 1 17  9  8  o 117.2622 3.364884 187.3710  295.8 24.74838       6.729768 0.92 
1 1 1 17  9  9  f 128.6427 3.417948 201.2791  75.2  0.1340942      6.835897 0.00 
1 1 1 17  9  10 o 96.63730 4.101619 151.5526  350.3 -24.36457      8.203238 0.88 
1 1 1 17  9  11 o 83.56589 4.513891 135.8615  263.7 -9.947182      9.027781 0.85 
1 1 1 17  9  12 o 187.1663 3.208224 356.3525  283.9 -8.598129      6.416447 0.98 
1 1 1 17  9  13 o 172.6066 2.916697 273.0038  304.9 -16.71054      5.833395 0.98 
1 1 1 17  9  14 o 100.2141 5.933553 221.0685  177.3 -35.59689      11.86711 0.95 
1 1 1 17  9  15 o 102.7611 6.056615 186.1631  304.7 -1.666214      12.11323 0.95 
1 1 1 17  9  16 o 88.93944 8.341469 67.13530  323.5 -3.928955      16.68294 0.85 
1 1 1 17  9  17 o 91.63634 7.180742 167.2797  354.6 -8.943039      14.36148 0.96 
1 1 1 17  9  18 o 167.4877 4.888281 269.0919  314.9 -5.730103      9.776562 0.98 
1 1 1 17  9  19 o 77.64349 11.29452 113.2725  322.5 16.38234       22.58903 0.89 
1 1 1 17  9  20 o 93.75682 8.598495 154.0078  188.2 -4.135002      17.19699 0.94 
1 1 1 17  9  21 o 101.6028 6.896580 171.2931  292.8 -22.56724      13.79316 0.96 
1 1 1 17  9  22 o 52.04153 12.49494 87.71650  170.6 -2.568054      24.98988 0.84 
1 1 1 17  9  23 o 54.62940 12.52822 76.60987  48.5  6.397438       25.05644 0.86 
1 1 1 17  9  24 o 43.98400 12.13832 31.50118  118.6 -30.39708      24.27663 0.59 
1 1 1 17  9  25 o 40.59943 12.11070 33.96030  200.8 -18.15995      24.22140 0.59 
1 1 1 17  9  26 o 41.44081 12.62363 44.46076  297.5 -5.424511      25.24726 0.72 
1 1 1 17  11 0  o 224.6062 3.428686 353.2586  311.6 12.90755       6.857373 0.98 
1 1 1 17  11 1  o 221.2113 3.925647 439.3929  106.3 38.86089       7.851295 0.99 
1 1 1 17  11 2  o 181.1680 3.999619 303.2960  80.8  14.07764       7.999238 0.97 
1 1 1 17  11 3  o 227.1403 3.120966 387.0258  17.9  9.815201       6.241933 0.98 
1 1 1 17  11 4  o 193.8102 3.082087 417.2806  26.6  24.60783       6.164175 0.98 
1 1 1 17  11 5  f 34.73010 8.374651 80.66750  152.4 -2.822678      16.74930 0.00 
1 1 1 17  11 6  o 216.5781 4.193121 329.1191  108.2 -34.59421      8.386242 0.98 
1 1 1 17  11 7  o 233.6029 3.710366 401.4697  129.5 25.02748       7.420732 0.99 
1 1 1 17  11 8  o 212.9427 3.530177 395.9341  140.8 10.25563       7.060354 0.99 
1 1 1 17  11 9  o 103.0751 3.911392 161.9695  103.1 -24.64481      7.822785 0.94 
1 1 1 17  11 10 o 83.23939 4.758350 150.0632  280.1 -1.005096      9.516700 0.93 
1 1 1 17  11 11 o 173.0086 3.196633 239.3644  277.8 -13.41779      6.393266 0.98 
1 1 1 17  11 12 o 122.1517 3.880602 145.0779  174.2 52.96983       7.761203 0.96 
1 1 1 17  11 13 o 54.43935 7.666517 74.15868  83.8  -14.31639      15.33303 0.83 
1 1 1 17  11 14 o 220.1636 4.572964 350.3741  70.4  -18.46309      9.145927 0.99 
1 1 1 17  11 15 o 129.7720 6.198951 166.5322  97.8  -37.44794      12.39790 0.97 
1 1 1 17  11 16 o 47.61443 11.78354 49.84285  111.2 -6.441200      23.56707 0.56 
1 1 1 17  11 17 o 92.01109 8.482177 33.00457  57.5  -3.905296      16.96435 0.70 
1 1 1 17  11 18 o 149.6555 5.125484 212.6023  98.2  -27.63867      10.25097 0.98 
1 1 1 17  11 19 o 115.0044 7.613065 157.3494  317.8 -18.26044      15.22613 0.97 
1 1 1 17  11 20 o 106.7893 9.767127 174.1082  314.7 21.64486       19.53425 0.97 
1 1 1 17  11 21 o 43.40988 12.19124 80.53806  117.0 4.933331       24.38249 0.86 
1 1 1 17  11 22 o 51.83154 13.39976 36.35872  179.9 -29.12905      26.79952 0.69 
1 1 1 17  11 23 o 43.99143 13.03117 46.77082  254.8 -33.96226      26.06235 0.74 
1 1 1 17  11 24 o 51.88370 14.56835 94.24742  175.5 ?              ?        0.90 
1 1 1 17  13 0  o 52.42979 8.643433 79.45706  103.3 12.14680       17.28687 0.77 
1 1 1 17  13 1  o 53.77978 7.440095 112.8775  294.5 17.83612       14.88019 0.85 
1 1 1 17  13 2  o 75.15088 10.32405 101.9155  7.1   10.02544       20.64811 0.88 
1 1 1 17  13 3  o 81.91428 6.797008 146.0592  72.9  33.97372       13.59402 0.93 
1 1 1 17  13 4  o 64.55472 8.139166 115.9063  253.4 20.78247       16.27833 0.90 
1 1 1 17  13 5  o 118.9014 4.831587 240.3551  238.2 -8.816719      9.663174 0.98 
1 1 1 17  13 6  o 79.70522 6.034745 130.8217  125.8 -39.94725      12.06949 0.94 
1 1 1 17  13 7  o 47.27831 8.723508 64.36220  80.2  -29.39403      17.44702 0.79 
1 1 1 17  13 8  o 288.4666 3.785493 457.6360  45.0  32.82425       7.570986 1.00 
1 1 1 17  13 9  o 59.89352 7.926377 106.2954  251.7 33.09459       15.85275 0.89 
1 1 1 17  13 10 o 118.7038 3.938135 190.6247  243.0 -6.069084      7.876270 0.97 
1 1 1 17  13 11 o 116.7858 4.046964 175.1958  313.6 10.84050       8.093928 0.96 
1 1 1 17  13 12 o 99.61932 3.954128 175.3275  82.8  1.414276       7.908257 0.96 
1 1 1 17  13 13 o 60.08787 7.036440 109.5774  116.1 -46.06090      14.07288 0.90 
1 1 1 17  13 14 o 28.39078 7.868548 58.63037  187.1 -14.70592      15.73710 0.59 
1 1 1 17  13 15 o 96.99823 8.894869 162.5985  272.8 -15.89240      17.78974 0.97 
1 1 1 17  13 16 o 143.2398 6.300604 204.7071  173.3 -37.05641      12.60121 0.99 
1 1 1 17  13 17 o 58.62580 11.42437 92.42723  241.0 14.70043       22.84875 0.92 
1 1 1 17  13 18 o 68.37121 12.08195 135.5244  324.3 18.85500       24.16390 0.95 
1 1 1 17  13 19 o 36.70415 11.98797 87.88003  49.0  -18.77000      23.97594 0.85 
1 1 1 17  13 20 o 63.43327 12.41243 87.14908  306.4 6.824429       24.82486 0.92 
1 1 1 17  13 21 x ?        ?        69.49127  242.1 ?              ?        0.00 
1 1 1 17  15 0  o 92.05821 6.466705 202.4027  64.0  -23.15818      12.93341 0.96 
1 1 1 17  15 1  o 110.9325 7.888133 194.4167  107.1 -3.392845      15.77627 0.97 
1 1 1 17  15 2  o 128.6719 5.206912 217.3966  129.7 -6.072029      10.41382 0.98 
1 1 1 17  15 3  o 40.94465 10.08813 90.71893  33.1  18.61466       20.17625 0.79 
1 1 1 17  15 4  o 59.53589 13.66199 66.92714  242.8 -25.24203      27.32398 0.79 
1 1 1 17  15 5  o 50.90920 10.41096 72.22427  192.7 15.05890       20.82191 0.80 
1 1 1 17  15 6  o 88.09018 6.706522 135.7973  164.2 21.40942       13.41304 0.95 
1 1 1 17  15 7  o 163.4156 4.144327 284.6592  189.3 12.00812       8.288654 0.99 
1 1 1 17  15 8  o 68.20689 8.904400 127.9991  240.7 28.27509       17.80880 0.94 
1 1 1 17  15 9  o 67.32137 9.079515 132.1515  38.1  40.21941       18.15903 0.95 
1 1 1 17  15 10 o 38.99410 9.789619 21.76606  341.7 -15.31229      19.57924 0.46 
1 1 1 17  15 11 o 34.35288 9.320619 74.91848  239.3 -3.448925      18.64124 0.84 
1 1 1 17  15 12 o 50.08781 8.853759 105.5832  70.0  3.993191       17.70752 0.93 
1 1 1 17  15 13 o 76.00452 5.827189 125.0074  70.5  12.10020       11.65438 0.97 
1 1 1 17  15 14 o 31.95692 8.342261 98.57753  300.8 -16.00984      16.68452 0.88 
1 1 1 17  15 15 o 31.71771 10.73691 81.84757  323.3 -13.38690      21.47381 0.85 
1 1 1 17  15 16 o 83.47772 6.499461 109.6375  94.3  ?              ?        0.97 
1 1 1 17  17 0  f 113.6882 6.110761 170.4682  141.5 24.68211       12.22152 0.00 
1 1 1 17  17 1  o 40.07196 11.30653 38.57389  135.8 6.522289       22.61306 0.70 
1 1 1 17  17 2  o 58.71526 11.63433 114.5380  309.9 16.43390       23.26867 0.94 
1 1 1 17  17 3  o 45.51248 13.20335 86.37289  61.4  6.482685       26.40671 0.88 
1 1 1 17  17 4  o 64.07143 11.49324 197.3346  117.2 30.63894       22.98648 0.97 
1 1 1 17  17 5  f 60.99263 11.15454 155.4667  163.1 34.34220       22.30909 0.00 
1 1 1 17  17 6  o 81.56331 14.03086 157.3755  221.6 25.74022       28.06171 0.96 
1 1 1 17  17 7  o 52.47160 11.88365 127.4621  223.8 26.14629       23.76731 0.94 
1 1 1 17  17 8  o 44.48859 11.57974 42.18970  123.0 ?              ?        0.78 
1 1 1 17  17 9  o 35.93874 10.81671 56.69402  248.7 ?              ?        0.82 
1 1 1 18  0  0  o 248.5113 3.759965 20.26827  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  1  o 132.4516 3.092753 582.9118  0.0   0.000000       0.000000 0.67 
1 1 1 18  0  2  o 535.6043 5.664186 891.0194  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  3  o 40.81872 4.450676 497.2471  180.0 0.000000       0.000000 0.35 
1 1 1 18  0  4  o 243.0383 3.331714 292.0519  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  5  o 424.1284 4.908707 474.4844  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  6  o 860.1411 7.818994 1378.277  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  7  o 195.3618 3.645071 443.1196  180.0 0.000000       0.000000 0.99 
1 1 1 18  0  8  o 519.3152 6.150611 636.0886  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  9  o 512.9261 7.703102 76.29057  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  10 f 361.5232 4.873310 584.8983  180.0 0.000000       0.000000 0.00 
1 1 1 18  0  11 o 526.4805 6.083710 731.5699  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  12 o 508.9575 5.611256 750.8420  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  13 o 623.0167 6.625928 937.4417  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  14 o 773.4485 7.971197 1095.942  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  15 o 127.0552 3.576489 225.5090  180.0 0.000000       0.000000 0.95 
1 1 1 18  0  16 o 281.6959 5.561962 375.5007  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  17 o 107.4580 5.914403 172.3613  0.0   0.000000       0.000000 0.99 
1 1 1 18  0  18 o 96.18407 7.391593 57.35357  0.0   0.000000       0.000000 0.71 
1 1 1 18  0  19 o 241.9878 5.335348 517.9173  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  20 o 150.5822 5.152032 230.2091  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  21 o 149.7711 5.719282 272.3058  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  22 o 20.48186 13.63830 81.03815  0.0   0.000000       0.000000 0.40 
1 1 1 18  0  23 o 30.99065 19.21915 101.3066  0.0   0.000000       0.000000 0.76 
1 1 1 18  0  24 o 112.9467 9.092376 154.8580  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  25 o 78.62823 13.04310 140.5022  180.0 0.000000       0.000000 0.99 
1 1 1 18  0  26 o 142.5588 12.34314 200.0232  180.0 0.000000       0.000000 1.00 
1 1 1 18  0  27 o 50.59884 21.84678 66.72652  0.0   0.000000       0.000000 0.82 
1 1 1 18  0  28 o 84.28001 15.82766 88.59145  0.0   0.000000       0.000000 1.00 
1 1 1 18  0  29 o 26.70530 17.73021 27.78138  180.0 0.000000       0.000000 0.35 
1 1 1 18  0  30 o 23.91858 16.70029 30.38688  180.0 0.000000       0.000000 0.37 
1 1 1 18  0  31 x ?        ?        18.98640  0.0   ?              ?        0.00 
1 1 1 18  2  0  o 578.4073 4.718974 760.8984  39.5  8.460266       9.437948 0.98 
1 1 1 18  2  1  o 317.9629 3.177783 787.2549  290.9 76.19562       6.355565 0.96 
1 1 1 18  2  2  o 529.1143 4.215920 899.7552  321.4 12.51001       8.431840 0.98 
1 1 1 18  2  3  o 502.6727 3.879040 682.3297  354.8 3.740936       7.758079 0.98 
1 1 1 18  2  4  o 462.9568 4.067061 662.1994  52.5  27.48196       8.134123 0.98 
1 1 1 18  2  5  o 233.5203 2.470207 183.8978  103.8 62.27231       4.940413 0.84 
1 1 1 18  2  6  o 350.1864 3.018365 402.7832  331.4 -58.73611      6.036731 0.95 
1 1 1 18  2  7  o 454.2469 3.770066 628.3974  248.4 -65.99445      7.540132 0.97 
1 1 1 18  2  8  o 676.4509 4.934200 853.5266  284.9 31.65009       9.868400 0.99 
1 1 1 18  2  9  o 683.3103 5.047956 848.5737  12.9  20.55585       10.09591 0.99 
1 1 1 18  2  10 o 421.4569 3.934299 642.2802  345.3 15.74161       7.868598 0.97 
1 1 1 18  2  11 o 372.0498 3.997423 482.3995  5.4   14.80737       7.994846 0.96 
1 1 1 18  2  12 o 70.79474 4.343000 294.4719  341.2 -13.17260      8.686001 0.58 
1 1 1 18  2  13 o 322.2157 3.386879 476.0828  250.5 -18.19952      6.773757 0.96 
1 1 1 18  2  14 o 112.8492 3.593959 240.5202  299.7 -7.003517      7.187918 0.79 
1 1 1 18  2  15 o 105.0077 3.550133 215.4771  37.1  -18.74049      7.100266 0.83 
1 1 1 18  2  16 o 74.49049 4.705229 92.95744  238.5 -28.44182      9.410459 0.56 
1 1 1 18  2  17 o 91.19413 4.396770 67.61392  58.1  23.67563       8.793539 0.67 
1 1 1 18  2  18 o 267.5089 3.876789 331.4341  15.5  -0.1539612     7.753578 0.98 
1 1 1 18  2  19 o 69.79167 6.090304 160.7757  205.0 -33.84204      12.18061 0.85 
1 1 1 18  2  20 o 103.6852 5.020878 169.4468  292.7 17.68665       10.04176 0.93 
1 1 1 18  2  21 o 288.4580 4.636466 355.1335  212.3 25.30151       9.272931 0.99 
1 1 1 18  2  22 o 69.56235 6.705225 132.6505  76.1  -22.99448      13.41045 0.90 
1 1 1 18  2  23 o 45.85417 10.01805 58.29376  96.3  -8.624260      20.03609 0.67 
1 1 1 18  2  24 o 65.75134 8.812328 47.62677  190.4 -10.76630      17.62466 0.63 
1 1 1 18  2  25 o 41.90650 11.86996 97.85111  8.5   -7.090378      23.73992 0.72 
1 1 1 18  2  26 o 258.3564 4.950296 280.4724  258.0 -23.75343      9.900593 0.99 
1 1 1 18  2  27 o 140.7920 6.225331 181.8081  167.6 11.68724       12.45066 0.98 
1 1 1 18  2  28 f 39.96548 11.82763 32.53985  61.2  -18.59373      23.65526 0.00 
1 1 1 18  2  29 o 121.1537 8.046163 153.6230  264.7 12.40495       16.09233 0.98 
1 1 1 18  2  30 o 45.15834 12.91714 71.62261  212.1 0.9322853      25.83428 0.84 
1 1 1 18  4  0  o 682.5226 5.276550 803.4538  191.8 76.13629       10.55310 0.99 
1 1 1 18  4  1  o 484.2546 4.600167 916.7477  340.5 -31.00052      9.200335 0.98 
1 1 1 18  4  2  o 638.6742 5.519884 725.4820  356.1 -71.03650      11.03977 0.99 
1 1 1 18  4  3  o 685.0004 6.045203 978.6580  220.9 85.93475       12.09041 0.99 
1 1 1 18  4  4  o 371.8008 3.397629 558.1898  178.7 79.82083       6.795257 0.96 
1 1 1 18  4  5  o 923.9732 7.489557 1438.190  56.8  -59.53040      14.97911 0.99 
1 1 1 18  4  6  o 716.3507 5.503911 989.5289  34.8  -126.7530      11.00782 0.99 
1 1 1 18  4  7  f 340.2154 3.461318 557.9855  211.8 33.49841       6.922636 0.00 
1 1 1 18  4  8  o 631.6028 5.470069 768.8163  48.6  -24.67993      10.94014 0.99 
1 1 1 18  4  9  o 292.6259 2.987551 481.8640  128.1 53.97964       5.975102 0.95 
1 1 1 18  4  10 o 1041.695 7.148401 1407.953  89.2  -19.84277      14.29680 1.00 
1 1 1 18  4  11 o 275.3475 3.235386 409.7287  113.7 -2.868134      6.470772 0.93 
1 1 1 18  4  12 o 156.2017 2.947984 174.7420  122.5 -36.69308      5.895967 0.80 
1 1 1 18  4  13 o 161.1061 3.179173 205.2710  205.1 14.19730       6.358346 0.86 
1 1 1 18  4  14 o 233.4983 3.091581 440.3563  255.1 -26.97594      6.183162 0.97 
1 1 1 18  4  15 o 279.8193 4.164010 410.0663  133.5 ?              ?        0.98 
1 1 1 18  4  16 o 87.82755 5.966205 165.3125  3.5   -52.49207      11.93241 0.87 
1 1 1 18  4  17 o 175.3335 3.105766 244.7416  355.5 -1.425644      6.211531 0.96 
1 1 1 18  4  18 o 177.9366 3.398529 243.2435  257.7 -7.828506      6.797058 0.97 
1 1 1 18  4  19 o 137.7853 3.624581 225.4753  69.0  0.8218384      7.249162 0.96 
1 1 1 18  4  20 o 186.6232 3.654134 195.8660  133.5 24.04851       7.308267 0.97 
1 1 1 18  4  21 o 105.1247 5.327301 158.1610  250.8 10.99870       10.65460 0.95 
1 1 1 18  4  22 o 197.8607 3.631767 258.9980  70.1  -8.663589      7.263534 0.99 
1 1 1 18  4  23 o 52.38086 7.667267 67.54871  145.0 51.37217       15.33453 0.70 
1 1 1 18  4  24 o 64.21906 9.273421 46.15895  18.5  42.11826       18.54684 0.61 
1 1 1 18  4  25 o 89.17034 7.569847 123.3483  314.0 8.251465       15.13969 0.92 
1 1 1 18  4  26 o 115.5192 6.199977 146.5486  332.2 -0.4138184     12.39995 0.96 
1 1 1 18  4  27 o 158.2465 5.302312 217.8340  263.3 2.873260       10.60462 0.99 
1 1 1 18  4  28 o 49.40725 12.40202 95.97201  334.7 -9.473186      24.80404 0.89 
1 1 1 18  4  29 o 102.8110 8.273894 134.0243  351.3 9.612236       16.54779 0.97 
1 1 1 18  4  30 o 42.30531 12.11550 91.94511  348.8 ?              ?        0.89 
1 1 1 18  6  0  o 440.6937 4.222812 765.5018  194.6 -84.38785      8.445624 0.98 
1 1 1 18  6  1  o 246.3749 3.140602 194.7377  175.8 -5.939194      6.281205 0.84 
1 1 1 18  6  2  o 146.0029 2.759723 151.8885  352.7 25.01495       5.519446 0.53 
1 1 1 18  6  3  o 706.7820 6.285973 1235.356  295.9 57.97260       12.57195 0.99 
1 1 1 18  6  4  o 364.1938 3.987952 546.1831  269.4 -23.79538      7.975904 0.96 
1 1 1 18  6  5  o 160.1588 2.995387 27.48227  13.2  -38.19730      5.990775 0.23 
1 1 1 18  6  6  o 70.25162 7.410071 220.9740  218.9 -32.51316      14.82014 0.56 
1 1 1 18  6  7  o 309.0165 3.652533 586.2891  298.1 -16.30447      7.305067 0.97 
1 1 1 18  6  8  o 317.1441 3.464820 401.0594  80.5  -3.196716      6.929641 0.95 
1 1 1 18  6  9  o 33.70767 7.506828 173.4770  141.4 0.2337608      15.01366 0.25 
1 1 1 18  6  10 o 208.7320 2.906596 317.7193  273.6 23.69211       5.813192 0.93 
1 1 1 18  6  11 o 340.8940 4.218983 410.5098  53.5  17.23703       8.437966 0.97 
1 1 1 18  6  12 o 318.4376 4.100678 469.1038  286.0 4.056580       8.201357 0.98 
1 1 1 18  6  13 o 288.4016 3.408016 386.1116  204.6 -56.38428      6.816033 0.98 
1 1 1 18  6  14 o 148.7292 3.101333 320.5534  153.5 20.07269       6.202665 0.96 
1 1 1 18  6  15 o 151.6554 3.713295 115.2319  203.3 -20.51863      7.426591 0.89 
1 1 1 18  6  16 o 230.8270 3.133605 408.9689  249.3 -3.371033      6.267210 0.98 
1 1 1 18  6  17 o 44.49603 8.907651 31.06135  175.2 -23.44611      17.81530 0.28 
1 1 1 18  6  18 o 254.9056 3.837248 339.9350  352.8 11.26376       7.674495 0.99 
1 1 1 18  6  19 o 75.76646 7.847656 105.6750  289.3 21.53143       15.69531 0.87 
1 1 1 18  6  20 o 134.5027 4.234092 142.7565  216.5 5.026337       8.468184 0.96 
1 1 1 18  6  21 o 67.22211 8.842483 86.16407  247.1 26.75705       17.68497 0.86 
1 1 1 18  6  22 o 36.04923 10.18732 57.47190  51.0  -9.214430      20.37464 0.47 
1 1 1 18  6  23 o 138.1301 5.172500 171.2591  320.7 -2.772766      10.34500 0.96 
1 1 1 18  6  24 f 128.0736 5.891616 159.3258  258.5 0.2854004      11.78323 0.00 
1 1 1 18  6  25 o 55.99668 10.95013 89.16494  352.2 3.937687       21.90025 0.87 
1 1 1 18  6  26 o 30.36253 9.848989 39.83136  122.0 -11.69366      19.69798 0.55 
1 1 1 18  6  27 o 46.81359 11.52597 93.63627  141.8 13.11766       23.05194 0.88 
1 1 1 18  6  28 o 124.4363 7.504324 133.6146  118.9 0.5462341      15.00865 0.98 
1 1 1 18  6  29 x ?        ?        61.91595  19.3  ?              ?        0.00 
1 1 1 18  8  0  o 133.0701 2.667004 223.5884  301.4 -54.80632      5.334008 0.77 
1 1 1 18  8  1  o 245.7716 3.762495 345.3921  190.8 2.274353       7.524990 0.93 
1 1 1 18  8  2  o 678.0684 6.005732 907.7682  342.1 -5.973206      12.01146 0.99 
1 1 1 18  8  3  o 404.4118 4.027350 671.7154  318.6 -25.25793      8.054700 0.98 
1 1 1 18  8  4  o 324.1182 4.831400 454.2441  196.9 8.588074       9.662800 0.96 
1 1 1 18  8  5  f 355.2562 4.888162 455.0690  270.4 4.722504       9.776323 0.00 
1 1 1 18  8  6  o 200.1943 3.139934 294.4840  281.0 -28.93571      6.279868 0.93 
1 1 1 18  8  7  o 198.7659 2.846426 295.0669  136.7 33.56120       5.692852 0.94 
1 1 1 18  8  8  f 170.5090 2.949648 125.2693  192.3 -18.59283      5.899296 0.00 
1 1 1 18  8  9  o 184.3646 2.805624 251.2573  64.4  3.069885       5.611248 0.95 
1 1 1 18  8  10 o 198.7032 2.891136 243.1113  224.9 22.82262       5.782272 0.97 
1 1 1 18  8  11 o 158.1775 3.025385 236.6175  313.3 32.97922       6.050771 0.96 
1 1 1 18  8  12 o 152.6536 2.850538 150.3873  127.1 26.38960       5.701077 0.93 
1 1 1 18  8  13 o 103.7221 5.502351 219.9844  33.9  8.508781       11.00470 0.93 
1 1 1 18  8  14 f 179.1269 4.026984 218.7825  284.5 3.639420       8.053968 0.00 
1 1 1 18  8  15 o 217.8591 4.117958 330.5497  247.3 -8.751495      8.235915 0.99 
1 1 1 18  8  16 o 65.39644 8.611238 136.8499  19.1  6.674454       17.22248 0.88 
1 1 1 18  8  17 o 231.8190 5.282958 343.9655  356.0 -12.14354      10.56592 0.99 
1 1 1 18  8  18 o 164.5898 4.971812 213.8725  15.2  10.00655       9.943624 0.98 
1 1 1 18  8  19 o 122.3554 5.612564 137.8770  114.8 -5.397766      11.22513 0.96 
1 1 1 18  8  20 o 66.95900 10.04236 156.0122  154.2 -37.24465      20.08472 0.91 
1 1 1 18  8  21 o 59.12044 11.03316 63.77507  239.7 2.889740       22.06633 0.72 
1 1 1 18  8  22 o 50.45686 11.90576 29.42405  118.0 -13.23413      23.81151 0.43 
1 1 1 18  8  23 o 79.19910 10.08842 103.2986  76.1  26.98830       20.17684 0.93 
1 1 1 18  8  24 o 36.76559 11.14143 67.33254  91.6  4.661682       22.28285 0.77 
1 1 1 18  8  25 o 54.35644 11.31351 107.9723  20.4  22.23860       22.62701 0.92 
1 1 1 18  8  26 o 33.66570 10.93471 19.28148  333.2 -3.483957      21.86941 0.34 
1 1 1 18  8  27 o 39.63714 11.88551 77.22330  215.9 ?              ?        0.85 
1 1 1 18  10 0  o 23.03686 6.755392 118.6197  110.4 -5.641069      13.51078 0.28 
1 1 1 18  10 1  o 463.5465 4.763666 827.6882  35.4  -15.52362      9.527332 0.99 
1 1 1 18  10 2  o 206.5961 3.132171 339.4864  316.7 -24.60419      6.264342 0.97 
1 1 1 18  10 3  o 308.0155 3.625664 457.2313  145.9 -12.85553      7.251328 0.99 
1 1 1 18  10 4  o 157.4017 3.110513 294.0727  193.0 -22.78899      6.221027 0.97 
1 1 1 18  10 5  f 125.0917 3.519354 326.5376  161.8 9.325836       7.038708 0.00 
1 1 1 18  10 6  o 231.6372 3.263199 432.2648  111.6 -35.21277      6.526397 0.99 
1 1 1 18  10 7  o 176.4012 3.273349 451.2841  142.8 -15.48480      6.546697 0.98 
1 1 1 18  10 8  o 91.07991 4.711655 152.4259  168.6 0.8571091      9.423309 0.89 
1 1 1 18  10 9  o 111.4206 3.523391 242.0039  312.5 28.30825       7.046783 0.95 
1 1 1 18  10 10 o 110.3744 3.818477 84.68567  76.4  -1.097961      7.636954 0.87 
1 1 1 18  10 11 o 38.04568 8.009128 170.1841  159.5 -16.24050      16.01826 0.83 
1 1 1 18  10 12 o 142.6418 3.603856 305.7997  68.9  -26.85225      7.207712 0.98 
1 1 1 18  10 13 o 47.58743 8.656527 78.86556  165.8 -0.1831932     17.31305 0.71 
1 1 1 18  10 14 o 60.24760 9.755858 55.13184  318.8 6.823669       19.51172 0.72 
1 1 1 18  10 15 o 79.93555 8.386664 111.0120  21.7  -12.29707      16.77333 0.93 
1 1 1 18  10 16 o 70.67944 9.489128 64.52218  193.2 -7.087921      18.97826 0.82 
1 1 1 18  10 17 f 72.81572 9.075526 68.02319  54.7  -54.79106      18.15105 0.00 
1 1 1 18  10 18 o 134.3946 6.098048 153.6313  80.6  8.890244       12.19610 0.96 
1 1 1 18  10 19 o 122.9248 7.042439 187.9734  187.8 8.800179       14.08488 0.97 
1 1 1 18  10 20 o 153.2978 5.955094 248.2040  245.5 -6.189285      11.91019 0.98 
1 1 1 18  10 21 o 55.02051 12.17324 81.20534  356.4 -43.03810      24.34649 0.87 
1 1 1 18  10 22 o 63.23972 12.70125 71.14655  80.2  10.70464       25.40249 0.89 
1 1 1 18  10 23 o 60.60153 13.34583 34.39700  41.9  3.984055       26.69166 0.72 
1 1 1 18  10 24 o 40.94299 12.88892 84.86326  19.9  -5.000019      25.77784 0.86 
1 1 1 18  10 25 o 52.09504 13.21076 59.15422  1.8   ?              ?        0.85 
1 1 1 18  12 0  o 47.50412 7.404292 7.983141  26.4  32.84309       14.80858 0.10 
1 1 1 18  12 1  o 77.80273 7.232907 102.5459  62.3  -5.305542      14.46581 0.86 
1 1 1 18  12 2  o 56.84269 7.395432 151.4416  19.2  -27.56573      14.79086 0.88 
1 1 1 18  12 3  o 35.68847 8.935215 25.39708  198.7 6.494499       17.87043 0.23 
1 1 1 18  12 4  o 73.30082 6.294050 107.5389  117.1 25.99993       12.58810 0.88 
1 1 1 18  12 5  o 92.47908 7.598613 137.3460  61.6  39.13612       15.19723 0.93 
1 1 1 18  12 6  o 217.0914 3.371501 356.5995  45.1  20.15770       6.743001 0.99 
1 1 1 18  12 7  o 95.54412 5.379289 108.6153  7.8   12.63998       10.75858 0.92 
1 1 1 18  12 8  f 128.1349 3.813950 223.9955  79.4  25.83776       7.627900 0.00 
1 1 1 18  12 9  o 142.2354 3.629928 252.1937  143.1 14.18533       7.259855 0.98 
1 1 1 18  12 10 o 202.4428 3.393719 351.3276  356.6 30.93831       6.787438 0.99 
1 1 1 18  12 11 o 148.3387 3.491323 225.4952  6.0   0.9819946      6.982646 0.98 
1 1 1 18  12 12 o 66.15468 6.070298 149.9926  90.7  12.50376       12.14060 0.93 
1 1 1 18  12 13 o 27.34423 8.308365 9.574965  80.5  -4.610481      16.61673 0.08 
1 1 1 18  12 14 o 109.3731 4.418897 213.5122  279.6 -27.81209      8.837794 0.97 
1 1 1 18  12 15 f 193.3144 5.530379 307.8575  303.2 4.381241       11.06076 0.00 
1 1 1 18  12 16 o 112.1532 7.378603 163.2533  57.7  -27.64599      14.75721 0.97 
1 1 1 18  12 17 o 72.74299 11.53425 143.5510  46.7  -41.65522      23.06850 0.95 
1 1 1 18  12 18 f 70.06086 12.07597 121.0758  4.3   -1.279602      24.15193 0.00 
1 1 1 18  12 19 o 73.56069 12.05663 157.0396  11.6  11.31558       24.11327 0.96 
1 1 1 18  12 20 o 95.88741 10.55429 119.6163  345.6 -0.4223022     21.10858 0.96 
1 1 1 18  12 21 f 53.81232 12.30528 139.2271  281.9 22.05638       24.61057 0.00 
1 1 1 18  12 22 o 108.3456 11.27760 146.7257  282.1 ?              ?        0.98 
1 1 1 18  14 0  o 115.3035 5.924375 187.1236  81.9  -15.59436      11.84875 0.98 
1 1 1 18  14 1  o 119.8585 4.824470 168.5991  154.3 8.659950       9.648940 0.97 
1 1 1 18  14 2  o 72.37365 7.506828 167.9207  126.3 -7.548218      15.01366 0.95 
1 1 1 18  14 3  f 184.1549 4.349911 313.0746  178.9 11.05646       8.699821 0.00 
1 1 1 18  14 4  o 99.55731 10.35440 209.3037  193.0 22.12598       20.70879 0.96 
1 1 1 18  14 5  o 33.15034 9.118631 94.48625  235.4 18.82504       18.23726 0.71 
1 1 1 18  14 6  o 116.1686 4.858115 225.6120  93.9  -20.09012      9.716229 0.97 
1 1 1 18  14 7  o 114.5247 5.400102 221.1055  150.3 -20.09933      10.80020 0.97 
1 1 1 18  14 8  o 44.59335 8.110531 127.8039  209.1 33.88692       16.22106 0.87 
1 1 1 18  14 9  o 206.6044 3.875263 304.3164  272.1 8.137558       7.750526 0.99 
1 1 1 18  14 10 o 176.5590 3.596633 317.8726  295.6 14.36136       7.193267 0.99 
1 1 1 18  14 11 o 93.16833 4.898429 153.5344  34.0  -8.894379      9.796859 0.97 
1 1 1 18  14 12 o 143.8573 3.689188 222.9385  76.2  -0.5468750     7.378375 0.99 
1 1 1 18  14 13 f 34.02063 8.695756 95.23305  8.1   5.054110       17.39151 0.00 
1 1 1 18  14 14 o 79.26062 5.359135 112.0882  274.5 15.05013       10.71827 0.96 
1 1 1 18  14 15 o 42.61147 11.11017 34.81046  18.5  3.923992       22.22034 0.67 
1 1 1 18  14 16 o 50.51872 13.05655 33.93331  225.2 -40.64823      26.11310 0.68 
1 1 1 18  14 17 o 42.46284 12.42787 50.32098  151.4 -10.42179      24.85574 0.77 
1 1 1 18  14 18 o 35.38715 11.81621 95.42212  119.8 ?              ?        0.88 
1 1 1 18  16 0  o 120.4519 5.933041 158.6816  113.2 27.73075       11.86608 0.98 
1 1 1 18  16 1  o 101.6479 7.057212 151.3424  205.7 2.625282       14.11442 0.97 
1 1 1 18  16 2  o 147.8252 6.879451 226.7062  295.2 4.202042       13.75890 0.99 
1 1 1 18  16 3  o 69.51210 9.481136 92.55326  22.2  15.39427       18.96227 0.93 
1 1 1 18  16 4  o 45.95971 10.67533 118.6544  173.4 32.87735       21.35067 0.92 
1 1 1 18  16 5  o 62.12855 11.63722 126.5045  156.3 4.902477       23.27444 0.95 
1 1 1 18  16 6  o 69.45804 12.97262 126.9391  253.1 -23.78259      25.94524 0.95 
1 1 1 18  16 7  o 125.5639 5.535132 234.0966  277.0 11.69995       11.07026 0.99 
1 1 1 18  16 8  o 62.79007 10.49458 158.1615  326.3 8.528267       20.98916 0.96 
1 1 1 18  16 9  o 46.50219 10.98218 97.62053  43.7  -2.246109      21.96436 0.91 
1 1 1 18  16 10 o 87.71313 7.270808 128.1388  121.6 21.53920       14.54162 0.97 
1 1 1 18  16 11 o 27.63725 8.800470 29.61293  206.3 -2.707808      17.60094 0.54 
1 1 1 18  16 12 o 42.22504 9.748292 73.04006  208.3 ?              ?        0.89 
1 1 1 18  16 13 x ?        ?        69.56979  167.9 ?              ?        0.00 
1 1 1 18  18 0  o 47.91428 12.28481 142.1817  126.1 ?              ?        0.94 
1 1 1 18  18 1  x ?        ?        62.83665  224.1 ?              ?        0.00 
1 1 1 19  1  0  o 331.3659 3.745436 306.3104  356.7 -40.16257      7.490871 0.97 
1 1 1 19  1  1  o 656.4829 4.888916 1293.792  8.0   8.234558       9.777832 0.99 
1 1 1 19  1  2  o 306.8344 2.801063 465.6339  85.2  -0.1242065E-01 5.602125 0.95 
1 1 1 19  1  3  o 348.6619 3.118755 822.5624  328.2 23.26938       6.237510 0.96 
1 1 1 19  1  4  o 453.7418 3.521307 987.4473  44.9  -14.83362      7.042614 0.98 
1 1 1 19  1  5  o 569.1149 4.020872 748.3323  27.3  70.40472       8.041744 0.98 
1 1 1 19  1  6  o 52.95352 3.825915 289.0168  59.1  -12.77132      7.651830 0.31 
1 1 1 19  1  7  o 506.8957 3.927095 606.6306  191.8 1.980469       7.854189 0.98 
1 1 1 19  1  8  o 600.8553 4.815423 964.4485  222.1 -13.43695      9.630845 0.99 
1 1 1 19  1  9  o 225.9857 2.556353 417.1353  271.6 30.84541       5.112705 0.91 
1 1 1 19  1  10 o 268.8722 2.777305 407.8650  179.5 -38.91565      5.554611 0.93 
1 1 1 19  1  11 o 264.6064 2.763780 441.7149  234.7 -40.11482      5.527559 0.94 
1 1 1 19  1  12 o 637.8398 4.994462 977.4870  228.4 -10.47321      9.988923 0.99 
1 1 1 19  1  13 o 190.0837 2.649847 266.3126  125.1 -46.02092      5.299693 0.89 
1 1 1 19  1  14 o 87.27577 4.273305 158.0596  336.2 14.70499       8.546610 0.61 
1 1 1 19  1  15 o 290.1423 3.337652 373.1737  332.6 43.95511       6.675303 0.97 
1 1 1 19  1  16 o 189.9588 2.945995 163.0415  138.5 -44.46823      5.891990 0.93 
1 1 1 19  1  17 o 212.9998 3.322096 295.7832  69.4  59.89682       6.644193 0.97 
1 1 1 19  1  18 o 165.0145 3.312483 245.4123  24.3  6.114273       6.624966 0.96 
1 1 1 19  1  19 o 150.4420 3.744956 229.4841  343.8 53.20036       7.489912 0.96 
1 1 1 19  1  20 o 143.2923 3.861994 172.4540  78.1  -6.064423      7.723988 0.95 
1 1 1 19  1  21 o 218.7633 3.575301 284.6135  134.4 25.16887       7.150603 0.98 
1 1 1 19  1  22 o 114.4253 5.633171 159.2194  29.7  -4.641899      11.26634 0.95 
1 1 1 19  1  23 o 130.4562 5.465919 107.8463  176.5 -29.87498      10.93184 0.95 
1 1 1 19  1  24 o 89.37344 9.245507 159.0657  130.9 -47.71611      18.49101 0.93 
1 1 1 19  1  25 o 123.5049 7.383449 138.8401  307.9 5.160789       14.76690 0.95 
1 1 1 19  1  26 o 61.16935 11.21690 84.36052  244.0 -10.81346      22.43381 0.83 
1 1 1 19  1  27 f 65.21899 11.41167 103.1912  233.3 -6.533386      22.82333 0.00 
1 1 1 19  1  28 o 46.05561 11.80641 29.21650  113.6 16.05202       23.61281 0.56 
1 1 1 19  1  29 o 39.40577 11.78286 66.33392  351.9 -18.71393      23.56572 0.78 
1 1 1 19  1  30 o 53.75323 13.33176 76.17066  193.3 ?              ?        0.88 
1 1 1 19  3  0  o 483.3536 4.145607 438.4652  207.9 80.83328       8.291215 0.97 
1 1 1 19  3  1  o 465.6797 3.984181 589.3987  215.7 -1.241486      7.968361 0.97 
1 1 1 19  3  2  o 236.1987 2.577029 707.6120  327.3 -45.84290      5.154058 0.94 
1 1 1 19  3  3  f 329.5792 3.246655 556.6603  170.4 -3.545227      6.493310 0.00 
1 1 1 19  3  4  o 339.5258 3.191163 666.2075  229.0 83.03583       6.382326 0.97 
1 1 1 19  3  5  o 793.9070 5.870185 1266.170  1.6   -18.57147      11.74037 0.99 
1 1 1 19  3  6  f 519.0267 4.384637 493.2307  37.0  -53.51675      8.769274 0.00 
1 1 1 19  3  7  o 559.5360 4.337255 748.4333  203.0 34.86810       8.674511 0.98 
1 1 1 19  3  8  o 383.2744 3.173758 406.1904  45.9  -17.39835      6.347515 0.96 
1 1 1 19  3  9  o 203.3628 2.252481 516.9481  219.5 -24.84593      4.504961 0.93 
1 1 1 19  3  10 o 190.0699 2.800718 254.8254  306.7 -35.16566      5.601436 0.86 
1 1 1 19  3  11 o 379.5554 4.290070 568.8907  120.3 20.83438       8.580140 0.97 
1 1 1 19  3  12 o 593.1247 5.276433 781.1181  163.9 5.860962       10.55287 0.99 
1 1 1 19  3  13 o 358.1892 3.666237 439.0977  327.5 -23.04929      7.332474 0.97 
1 1 1 19  3  14 o 151.2506 2.870143 186.9782  170.9 14.53804       5.740285 0.88 
1 1 1 19  3  15 o 116.5716 4.847722 97.13853  126.0 -20.23040      9.695443 0.76 
1 1 1 19  3  16 o 178.7997 3.221027 281.3917  185.8 45.41365       6.442053 0.96 
1 1 1 19  3  17 o 276.7594 3.323240 332.1764  51.4  -3.789825      6.646480 0.98 
1 1 1 19  3  18 o 137.8273 3.661213 240.5371  113.3 11.16635       7.322425 0.95 
1 1 1 19  3  19 o 138.4313 3.719892 160.7383  248.1 -2.739548      7.439784 0.95 
1 1 1 19  3  20 f 118.4384 4.408982 194.4313  158.9 14.35954       8.817965 0.00 
1 1 1 19  3  21 o 162.8488 4.345055 165.0269  201.1 28.09570       8.690110 0.97 
1 1 1 19  3  22 o 159.4102 4.213797 202.6936  124.6 39.19881       8.427594 0.98 
1 1 1 19  3  23 f 75.27474 7.399041 74.71809  55.9  13.96832       14.79808 0.00 
1 1 1 19  3  24 o 177.7323 4.716902 260.0398  136.6 15.07513       9.433804 0.98 
1 1 1 19  3  25 o 50.34225 10.90288 67.58376  71.1  -22.74847      21.80576 0.69 
1 1 1 19  3  26 o 26.41986 8.542114 23.13779  279.6 8.945412       17.08423 0.23 
1 1 1 19  3  27 o 63.85479 10.90511 89.07981  190.7 -23.93542      21.81022 0.90 
1 1 1 19  3  28 o 38.45613 11.17685 54.25124  40.9  0.3412628      22.35370 0.72 
1 1 1 19  3  29 o 62.21349 12.09433 75.34030  292.8 5.965626       24.18866 0.89 
1 1 1 19  3  30 o 43.36837 13.18961 65.72328  204.2 ?              ?        0.83 
1 1 1 19  5  0  o 172.2099 2.532014 93.79611  55.3  34.27606       5.064028 0.66 
1 1 1 19  5  1  o 130.8508 2.696007 358.2300  262.9 33.49468       5.392015 0.83 
1 1 1 19  5  2  o 468.3276 4.484502 776.4529  105.2 18.05063       8.969005 0.98 
1 1 1 19  5  3  o 300.3047 3.234560 359.5505  257.3 2.788910       6.469121 0.94 
1 1 1 19  5  4  o 382.1870 3.765503 531.0366  149.4 23.55002       7.531005 0.97 
1 1 1 19  5  5  o 681.3445 5.149568 1102.512  85.3  -41.84717      10.29914 0.99 
1 1 1 19  5  6  o 257.2726 3.226034 376.2726  32.6  -6.475601      6.452068 0.93 
1 1 1 19  5  7  o 232.6065 3.115957 405.1035  237.3 -20.14984      6.231913 0.91 
1 1 1 19  5  8  o 349.6870 3.607191 494.1838  217.7 1.735596       7.214383 0.96 
1 1 1 19  5  9  o 304.0820 3.333761 521.0415  339.7 21.53961       6.667522 0.96 
1 1 1 19  5  10 o 379.6615 3.912783 520.9366  77.9  -45.22766      7.825567 0.97 
1 1 1 19  5  11 o 344.9695 3.080676 464.9245  118.8 -13.98212      6.161352 0.97 
1 1 1 19  5  12 o 265.9521 3.199480 449.4927  222.0 16.04355       6.398961 0.97 
1 1 1 19  5  13 o 124.6618 4.136405 52.66970  130.7 -28.81837      8.272810 0.51 
1 1 1 19  5  14 o 256.6496 3.348495 489.8716  31.8  -12.17188      6.696991 0.99 
1 1 1 19  5  15 o 59.07821 6.250129 127.4248  106.1 -11.84632      12.50026 0.73 
1 1 1 19  5  16 o 53.28784 7.556768 142.9563  323.2 26.60893       15.11354 0.71 
1 1 1 19  5  17 o 144.7460 3.741827 230.3367  290.9 27.00836       7.483654 0.96 
1 1 1 19  5  18 o 187.8205 3.486666 231.4302  302.1 -9.546478      6.973332 0.97 
1 1 1 19  5  19 o 39.84122 9.822437 48.76277  359.8 -1.249775      19.64487 0.42 
1 1 1 19  5  20 o 142.8340 4.269649 201.7759  87.5  -10.87903      8.539298 0.97 
1 1 1 19  5  21 o 28.24632 8.943709 5.170712  83.4  -3.164909      17.88742 0.05 
1 1 1 19  5  22 o 45.53412 10.08077 13.37751  201.1 18.30363       20.16155 0.17 
1 1 1 19  5  23 o 41.77589 11.11394 71.49225  332.1 -9.403858      22.22787 0.61 
1 1 1 19  5  24 o 153.1753 5.353744 220.2174  280.0 -0.5567780     10.70749 0.98 
1 1 1 19  5  25 o 148.9726 5.141739 172.0545  267.6 -17.95107      10.28348 0.98 
1 1 1 19  5  26 o 41.64882 10.74494 27.20128  121.4 15.39993       21.48989 0.47 
1 1 1 19  5  27 o 131.7859 7.130854 161.0140  274.4 18.47382       14.26171 0.98 
1 1 1 19  5  28 o 53.49391 12.44377 77.92462  217.4 7.082382       24.88754 0.87 
1 1 1 19  5  29 o 41.57940 11.81822 25.71593  168.9 ?              ?        0.54 
1 1 1 19  7  0  o 271.7875 2.856282 476.6815  258.4 -18.10831      5.712564 0.92 
1 1 1 19  7  1  o 80.82558 3.713211 192.8006  84.1  -1.877548      7.426421 0.32 
1 1 1 19  7  2  o 74.76048 3.743573 199.1464  194.0 -8.931992      7.487147 0.46 
1 1 1 19  7  3  o 204.9500 2.718741 174.0531  206.9 -24.43474      5.437481 0.80 
1 1 1 19  7  4  o 214.8886 3.785585 380.7482  190.5 8.795593       7.571171 0.93 
1 1 1 19  7  5  f 311.3412 3.821728 398.8395  211.7 -20.56302      7.643456 0.00 
1 1 1 19  7  6  o 217.5707 3.208750 368.3575  123.0 1.716980       6.417500 0.93 
1 1 1 19  7  7  o 378.9352 3.613247 462.5178  63.1  47.20724       7.226494 0.97 
1 1 1 19  7  8  o 446.9958 5.154162 497.5043  66.6  4.714020       10.30832 0.98 
1 1 1 19  7  9  o 396.7863 4.774645 503.3463  19.2  ?              ?        0.98 
1 1 1 19  7  10 o 143.1324 2.921678 219.7579  23.9  30.07332       5.843357 0.91 
1 1 1 19  7  11 f 158.2180 3.045313 295.3203  67.0  23.97542       6.090625 0.00 
1 1 1 19  7  12 o 139.8440 3.264023 184.7750  59.3  62.27670       6.528046 0.93 
1 1 1 19  7  13 o 166.6448 4.094808 241.5675  306.9 -17.45699      8.189616 0.96 
1 1 1 19  7  14 o 168.8150 4.203171 214.0723  206.9 -33.07286      8.406342 0.95 
1 1 1 19  7  15 o 304.3246 4.514217 403.5820  56.4  21.10654       9.028434 0.99 
1 1 1 19  7  16 o 176.7034 3.456954 317.6060  343.2 12.90016       6.913909 0.98 
1 1 1 19  7  17 o 77.43195 6.769435 143.5230  266.1 -25.80918      13.53887 0.91 
1 1 1 19  7  18 o 49.51897 10.18251 32.15831  203.3 8.816772       20.36502 0.40 
1 1 1 19  7  19 o 56.16615 8.582286 76.83047  88.0  39.50375       17.16457 0.82 
1 1 1 19  7  20 o 89.40009 6.085526 112.5511  336.0 1.394676       12.17105 0.92 
1 1 1 19  7  21 o 118.5741 5.912561 169.4496  27.2  -24.96954      11.82512 0.95 
1 1 1 19  7  22 o 196.2477 4.368400 312.6077  69.2  21.59782       8.736800 0.99 
1 1 1 19  7  23 o 82.37503 8.929220 87.98140  300.2 12.95052       17.85844 0.90 
1 1 1 19  7  24 o 134.7026 6.124076 184.5868  242.4 -24.51114      12.24815 0.98 
1 1 1 19  7  25 o 81.52872 9.719262 101.5626  347.5 -4.209160      19.43852 0.95 
1 1 1 19  7  26 o 44.69185 12.32644 57.78948  333.0 -17.08755      24.65288 0.78 
1 1 1 19  7  27 o 62.74174 12.62710 74.75299  268.3 -14.50526      25.25420 0.90 
1 1 1 19  7  28 x ?        ?        36.43954  162.6 ?              ?        0.00 
1 1 1 19  9  0  o 147.5928 2.426986 139.4235  239.8 12.58308       4.853973 0.79 
1 1 1 19  9  1  o 187.4738 2.630415 416.8601  303.0 19.37111       5.260831 0.95 
1 1 1 19  9  2  o 223.9407 3.641717 400.4036  121.9 8.358963       7.283433 0.96 
1 1 1 19  9  3  o 351.0469 3.753629 525.8413  92.7  -17.85730      7.507257 0.98 
1 1 1 19  9  4  o 107.8270 3.319201 244.6730  201.3 -12.66351      6.638402 0.88 
1 1 1 19  9  5  o 115.9915 3.595335 164.1791  176.7 -8.450577      7.190671 0.87 
1 1 1 19  9  6  o 263.7941 3.121083 353.6693  84.3  -20.85834      6.242166 0.98 
1 1 1 19  9  7  o 284.1756 3.494365 434.4053  151.7 -24.25299      6.988730 0.99 
1 1 1 19  9  8  o 343.3875 3.284051 567.2834  175.3 2.851868       6.568102 0.99 
1 1 1 19  9  9  o 180.0183 3.024553 250.1519  148.8 0.3405762E-01  6.049107 0.96 
1 1 1 19  9  10 o 225.5207 3.082805 430.9543  58.0  -36.75270      6.165610 0.98 
1 1 1 19  9  11 o 123.7194 3.253749 148.6607  83.7  0.2761307      6.507497 0.92 
1 1 1 19  9  12 f 156.9705 3.365319 227.7660  19.3  -4.335480      6.730639 0.00 
1 1 1 19  9  13 o 87.48196 5.164152 79.47923  36.5  -34.68019      10.32830 0.84 
1 1 1 19  9  14 o 100.0577 6.040090 155.3396  72.5  11.13531       12.08018 0.94 
1 1 1 19  9  15 o 60.17805 9.722088 102.7976  135.5 7.948227       19.44418 0.84 
1 1 1 19  9  16 o 85.14710 8.302389 178.2880  69.3  -28.91191      16.60478 0.95 
1 1 1 19  9  17 o 50.98782 12.05729 52.10127  142.3 -4.643196      24.11459 0.66 
1 1 1 19  9  18 o 41.01261 11.12443 55.86373  0.5   1.240475       22.24886 0.54 
1 1 1 19  9  19 o 126.3878 6.882706 155.9677  45.9  -33.58430      13.76541 0.96 
1 1 1 19  9  20 o 99.48186 8.847078 110.8434  156.4 4.885445       17.69416 0.93 
1 1 1 19  9  21 o 72.43896 11.16330 91.71688  173.3 13.62685       22.32660 0.89 
1 1 1 19  9  22 o 91.29399 9.510502 152.9819  23.3  0.1180496      19.02100 0.96 
1 1 1 19  9  23 o 33.88166 10.54354 52.04901  158.9 0.1072807      21.08708 0.70 
1 1 1 19  9  24 o 44.68962 12.70694 52.88577  302.9 -11.45692      25.41388 0.76 
1 1 1 19  9  25 o 45.34437 13.03186 52.40216  343.9 -11.12632      26.06372 0.77 
1 1 1 19  9  26 o 45.47637 12.39223 70.35365  121.2 ?              ?        0.86 
1 1 1 19  11 0  o 319.9447 3.332782 530.2562  158.8 3.054291       6.665563 0.99 
1 1 1 19  11 1  o 87.51620 4.419025 145.8634  66.5  -9.211998      8.838050 0.87 
1 1 1 19  11 2  o 279.6450 3.597257 467.9845  284.1 -19.84924      7.194513 0.99 
1 1 1 19  11 3  o 77.09727 5.057870 251.3008  151.2 -3.175888      10.11574 0.93 
1 1 1 19  11 4  o 38.63854 7.744297 107.9727  95.9  18.54931       15.48859 0.59 
1 1 1 19  11 5  o 43.89095 7.357558 46.42776  142.8 20.42971       14.71512 0.40 
1 1 1 19  11 6  o 102.7249 4.814870 96.23746  72.0  -2.217354      9.629741 0.88 
1 1 1 19  11 7  o 60.07233 7.395672 49.44231  46.7  22.03435       14.79134 0.60 
1 1 1 19  11 8  o 150.9996 3.397258 228.3190  313.2 -41.36919      6.794516 0.97 
1 1 1 19  11 9  o 125.1254 4.069583 173.3073  312.6 -9.699669      8.139166 0.96 
1 1 1 19  11 10 o 119.9894 4.122643 104.5724  55.2  3.337669       8.245287 0.93 
1 1 1 19  11 11 o 230.0463 3.191999 394.4411  108.4 11.29338       6.383998 0.99 
1 1 1 19  11 12 o 54.58702 8.041149 63.98940  149.8 -19.74252      16.08230 0.79 
1 1 1 19  11 13 o 101.6623 4.450886 173.3211  333.6 -24.57221      8.901772 0.97 
1 1 1 19  11 14 o 35.35747 9.265227 44.66928  179.0 8.483679       18.53045 0.46 
1 1 1 19  11 15 o 96.28136 8.359329 141.8856  76.3  0.4067535      16.71866 0.94 
1 1 1 19  11 16 o 64.27135 10.82445 107.0676  30.7  -32.37780      21.64890 0.87 
1 1 1 19  11 17 o 83.07283 10.87364 155.1928  48.2  10.24587       21.74728 0.94 
1 1 1 19  11 18 o 44.73976 12.77217 52.26788  226.5 -9.973770      25.54433 0.66 
1 1 1 19  11 19 o 52.18534 13.10008 80.89249  269.2 -4.676620      26.20016 0.85 
1 1 1 19  11 20 o 88.55701 12.16156 115.5549  16.9  29.03281       24.32312 0.95 
1 1 1 19  11 21 o 45.62892 12.53662 90.42847  135.4 10.48259       25.07324 0.88 
1 1 1 19  11 22 o 56.06538 13.42002 70.76604  185.0 12.58760       26.84003 0.87 
1 1 1 19  11 23 o 42.77710 12.05264 25.11831  297.0 ?              ?        0.55 
1 1 1 19  13 0  o 133.4737 4.317757 175.1348  13.1  35.76717       8.635513 0.97 
1 1 1 19  13 1  o 76.08681 6.853621 94.37504  274.1 19.11237       13.70724 0.89 
1 1 1 19  13 2  o 216.0397 3.504052 420.6750  266.5 26.95403       7.008103 0.99 
1 1 1 19  13 3  o 109.1211 8.257254 188.5240  200.7 7.154160       16.51451 0.97 
1 1 1 19  13 4  o 237.7642 3.902031 368.2004  71.5  -2.162888      7.804062 0.99 
1 1 1 19  13 5  o 120.9219 4.195974 192.8664  13.9  -0.3009186     8.391948 0.98 
1 1 1 19  13 6  o 239.9838 4.063774 450.3566  285.2 2.293701       8.127547 1.00 
1 1 1 19  13 7  o 230.7927 3.663738 424.4720  243.6 10.97705       7.327476 0.99 
1 1 1 19  13 8  o 53.64523 9.145044 94.53167  84.7  -17.97746      18.29009 0.85 
1 1 1 19  13 9  o 54.05878 8.813406 67.36236  39.7  -25.54553      17.62681 0.75 
1 1 1 19  13 10 o 129.2289 3.884906 244.1978  280.9 -0.9039764     7.769812 0.98 
1 1 1 19  13 11 o 31.83458 8.788101 66.50800  307.9 -16.32362      17.57620 0.59 
1 1 1 19  13 12 f 52.58319 6.992507 55.82354  91.8  49.16509       13.98501 0.00 
1 1 1 19  13 13 o 59.52611 7.674407 75.48006  236.9 -4.350483      15.34881 0.86 
1 1 1 19  13 14 o 60.38253 7.629611 89.93604  248.3 25.51929       15.25922 0.90 
1 1 1 19  13 15 o 62.14561 12.62601 87.49089  30.9  -12.87566      25.25202 0.90 
1 1 1 19  13 16 o 49.84941 12.77133 100.1757  278.0 -8.148022      25.54267 0.90 
1 1 1 19  13 17 o 54.71891 12.34552 87.84135  230.4 8.915565       24.69103 0.90 
1 1 1 19  13 18 o 49.71178 12.49948 84.25754  164.4 3.239742       24.99896 0.89 
1 1 1 19  13 19 o 46.15607 13.18487 87.29340  130.7 -21.64637      26.36974 0.88 
1 1 1 19  13 20 o 56.26478 12.84983 122.1840  75.0  ?              ?        0.94 
1 1 1 19  15 0  o 155.3465 4.109550 217.7565  261.5 -8.332474      8.219099 0.98 
1 1 1 19  15 1  o 64.21561 10.28376 102.0050  18.9  -21.25397      20.56753 0.89 
1 1 1 19  15 2  o 98.07881 6.911499 176.3350  349.6 5.853493       13.82300 0.96 
1 1 1 19  15 3  o 44.99397 10.90812 21.82359  268.0 0.2458801      21.81624 0.35 
1 1 1 19  15 4  o 95.84552 6.727175 162.6819  5.2   1.236778       13.45435 0.96 
1 1 1 19  15 5  f 137.7894 5.070070 248.0209  29.9  -9.239594      10.14014 0.00 
1 1 1 19  15 6  o 107.2889 12.11858 254.3682  67.2  28.03314       24.23716 0.98 
1 1 1 19  15 7  o 67.46278 9.035661 141.0768  61.1  11.76039       18.07132 0.95 
1 1 1 19  15 8  o 79.46481 7.278664 105.8847  97.7  -8.666168      14.55733 0.95 
1 1 1 19  15 9  o 48.57038 10.95965 76.97080  84.8  1.340622       21.91931 0.87 
1 1 1 19  15 10 o 37.94329 9.570517 61.83955  51.5  -15.97568      19.14103 0.82 
1 1 1 19  15 11 o 50.35356 9.267186 112.2775  242.6 -3.322002      18.53437 0.93 
1 1 1 19  15 12 o 122.8604 4.415282 161.4493  235.4 16.50668       8.830564 0.98 
1 1 1 19  15 13 o 30.26241 8.915221 27.53875  78.1  -3.199495      17.83044 0.51 
1 1 1 19  15 14 o 57.99921 7.508691 73.73685  302.5 41.94183       15.01738 0.92 
1 1 1 19  15 15 o 57.54353 12.56388 137.7463  202.4 ?              ?        0.95 
1 1 1 19  17 0  o 91.99101 8.047611 158.3383  49.2  -17.60148      16.09522 0.98 
1 1 1 19  17 1  o 49.52483 11.38849 51.16745  275.1 16.20458       22.77698 0.83 
1 1 1 19  17 2  o 63.46768 10.60212 114.2207  294.5 40.31613       21.20424 0.95 
1 1 1 19  17 3  o 33.67401 10.68761 31.97005  285.0 11.85912       21.37522 0.59 
1 1 1 19  17 4  o 63.59012 13.63860 156.7618  174.1 6.293858       27.27719 0.95 
1 1 1 19  17 5  f 48.80827 12.13673 122.2458  75.9  10.66124       24.27347 0.00 
1 1 1 19  17 6  o 36.70388 10.73263 79.84924  357.3 -12.55080      21.46526 0.87 
1 1 1 19  17 7  o 52.01012 15.29834 66.84010  102.7 ?              ?        0.85 
1 1 1 19  17 8  o 30.28446 9.852699 27.80540  99.3  ?              ?        0.57 
1 1 1 20  0  0  o 762.9687 8.699152 1375.867  0.0   0.000000       0.000000 1.00 
1 1 1 20  0  1  o 436.6943 5.664339 3.255422  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  2  o 55.55210 4.542082 15.96232  0.0   0.000000       0.000000 0.34 
1 1 1 20  0  3  o 26.96308 8.315510 25.22466  180.0 0.000000       0.000000 0.18 
1 1 1 20  0  4  o 344.0331 4.163768 570.1085  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  5  o 529.4905 5.628788 722.9924  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  6  o 66.54337 3.495645 284.2532  0.0   0.000000       0.000000 0.42 
1 1 1 20  0  7  o 602.8311 5.917808 593.9551  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  8  o 1195.441 12.01135 1673.327  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  9  o 188.9747 3.627124 209.1836  180.0 0.000000       0.000000 0.96 
1 1 1 20  0  10 o 360.8199 4.660708 280.7821  0.0   0.000000       0.000000 1.00 
1 1 1 20  0  11 f 470.6157 9.344598 1159.707  0.0   0.000000       0.000000 0.00 
1 1 1 20  0  12 o 79.16229 5.214626 139.9218  180.0 0.000000       0.000000 0.43 
1 1 1 20  0  13 o 236.2132 3.805288 304.4242  0.0   0.000000       0.000000 1.00 
1 1 1 20  0  14 o 216.1995 3.705024 556.7471  0.0   0.000000       0.000000 1.00 
1 1 1 20  0  15 o 158.9377 3.585609 174.6586  0.0   0.000000       0.000000 0.98 
1 1 1 20  0  16 o 31.65235 13.71257 59.51948  0.0   0.000000       0.000000 0.29 
1 1 1 20  0  17 o 267.5500 4.124448 333.5883  0.0   0.000000       0.000000 1.00 
1 1 1 20  0  18 o 151.7485 4.227385 264.8947  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  19 f 27.44144 15.28291 29.36521  180.0 0.000000       0.000000 0.00 
1 1 1 20  0  20 o 144.0035 6.201341 224.2539  0.0   0.000000       0.000000 1.00 
1 1 1 20  0  21 o 216.2738 5.725366 315.0540  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  22 o 232.1182 6.294481 326.3104  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  23 o 299.9336 5.846924 317.7445  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  24 o 33.86447 17.96150 29.30861  0.0   0.000000       0.000000 0.23 
1 1 1 20  0  25 f 50.78087 20.63529 53.49865  0.0   0.000000       0.000000 0.00 
1 1 1 20  0  26 o 44.51548 26.50778 24.20310  180.0 0.000000       0.000000 0.30 
1 1 1 20  0  27 o 147.8785 8.785749 141.4884  180.0 0.000000       0.000000 1.00 
1 1 1 20  0  28 o 24.76693 16.97316 24.35345  180.0 0.000000       0.000000 0.29 
1 1 1 20  0  29 o 47.28699 22.61230 29.47612  0.0   0.000000       0.000000 0.55 
1 1 1 20  0  30 o 142.7191 10.20072 119.2747  180.0 ?              ?        1.00 
1 1 1 20  2  0  o 457.2254 3.927164 700.5920  126.3 0.3483887      7.854329 0.97 
1 1 1 20  2  1  o 378.0536 3.523237 819.2797  50.3  -56.26474      7.046475 0.96 
1 1 1 20  2  2  o 295.4330 2.810050 237.0180  259.3 16.99014       5.620100 0.96 
1 1 1 20  2  3  o 355.1791 3.178159 481.4084  212.1 32.72787       6.356318 0.95 
1 1 1 20  2  4  o 394.7977 3.251039 784.5481  160.6 61.72586       6.502077 0.97 
1 1 1 20  2  5  o 395.6638 3.436592 337.0569  352.6 33.20251       6.873183 0.95 
1 1 1 20  2  6  o 430.3326 3.915811 596.8552  29.9  -35.98666      7.831621 0.97 
1 1 1 20  2  7  o 404.6085 3.463631 478.1346  193.0 92.16647       6.927262 0.96 
1 1 1 20  2  8  o 395.3989 3.148622 802.3475  180.2 -15.51779      6.297243 0.98 
1 1 1 20  2  9  o 343.3504 3.410923 521.1791  216.8 -33.85495      6.821847 0.96 
1 1 1 20  2  10 o 377.1501 3.302133 642.1644  111.9 5.578003       6.604266 0.97 
1 1 1 20  2  11 o 468.1527 3.724098 537.5278  32.9  -43.00110      7.448196 0.97 
1 1 1 20  2  12 o 393.7867 3.434045 565.9315  196.1 -0.6160278     6.868091 0.97 
1 1 1 20  2  13 o 70.72803 6.737637 157.3311  247.8 -19.70181      13.47527 0.47 
1 1 1 20  2  14 o 119.6082 3.190034 240.4124  81.0  -29.31065      6.380068 0.87 
1 1 1 20  2  15 o 79.50868 4.279223 209.0970  64.1  0.3635483      8.558446 0.84 
1 1 1 20  2  16 o 214.4134 2.976177 373.3465  177.3 13.05331       5.952353 0.98 
1 1 1 20  2  17 o 252.0323 3.620765 346.5363  339.5 -49.63109      7.241530 0.98 
1 1 1 20  2  18 o 159.7955 3.392494 300.1466  134.6 0.7908936      6.784987 0.97 
1 1 1 20  2  19 o 107.0034 4.390425 202.0284  202.9 -30.34217      8.780850 0.94 
1 1 1 20  2  20 o 145.7430 3.820536 237.2121  194.4 -16.46765      7.641072 0.97 
1 1 1 20  2  21 o 150.9434 6.125837 208.2187  281.0 3.170029       12.25167 0.97 
1 1 1 20  2  22 f 75.95239 6.805534 101.8799  6.0   -5.187416      13.61107 0.00 
1 1 1 20  2  23 o 86.15994 6.415821 107.7893  282.1 -20.85232      12.83164 0.90 
1 1 1 20  2  24 f 150.9027 4.613449 163.3932  128.5 -13.99776      9.226898 0.00 
1 1 1 20  2  25 o 61.81218 9.517653 115.4290  330.4 35.27517       19.03531 0.87 
1 1 1 20  2  26 o 46.82400 11.05850 70.95058  164.5 -26.62400      22.11700 0.76 
1 1 1 20  2  27 o 117.1988 6.778663 122.7357  279.9 9.664024       13.55733 0.97 
1 1 1 20  2  28 o 61.61384 11.84496 81.68121  104.4 -12.46467      23.68992 0.89 
1 1 1 20  2  29 o 53.68442 12.11241 76.74762  11.1  -23.43695      24.22481 0.87 
1 1 1 20  2  30 o 56.06537 11.06026 86.30031  238.6 ?              ?        0.91 
1 1 1 20  4  0  o 149.5017 2.247688 446.3722  169.2 -44.84779      4.495377 0.87 
1 1 1 20  4  1  o 523.5458 4.156069 978.6793  203.7 -21.64240      8.312139 0.98 
1 1 1 20  4  2  o 242.8106 2.865036 472.0655  147.0 21.18961       5.730073 0.90 
1 1 1 20  4  3  o 85.95267 3.396394 298.1251  348.5 55.34892       6.792788 0.61 
1 1 1 20  4  4  o 693.4666 6.018499 932.0937  303.2 19.37164       12.03700 0.99 
1 1 1 20  4  5  o 295.8808 3.014907 592.6287  352.7 58.07129       6.029814 0.95 
1 1 1 20  4  6  o 956.7838 6.820517 1550.010  225.6 13.14996       13.64103 1.00 
1 1 1 20  4  7  o 711.0120 6.607009 881.0045  298.7 55.70288       13.21402 0.99 
1 1 1 20  4  8  o 373.8974 3.297413 519.2787  324.7 6.125000       6.594826 0.97 
1 1 1 20  4  9  o 110.8883 2.977338 90.22642  228.7 -27.25889      5.954675 0.49 
1 1 1 20  4  10 o 280.4210 2.959598 461.0822  320.5 17.83087       5.919196 0.96 
1 1 1 20  4  11 o 405.0081 4.192890 429.5331  155.1 -1.365814      8.385780 0.97 
1 1 1 20  4  12 o 379.3114 3.927452 492.6651  203.3 26.07407       7.854903 0.98 
1 1 1 20  4  13 o 214.1032 3.088598 275.1612  273.5 42.07088       6.177195 0.95 
1 1 1 20  4  14 o 98.07329 3.893199 175.2552  335.5 13.16681       7.786397 0.85 
1 1 1 20  4  15 o 394.8000 5.055215 493.7060  32.3  -0.5119324     10.11043 0.99 
1 1 1 20  4  16 o 217.4393 3.309121 376.2631  49.4  -35.42165      6.618241 0.98 
1 1 1 20  4  17 o 90.35251 5.011573 93.81148  79.5  -38.10427      10.02315 0.80 
1 1 1 20  4  18 o 58.85110 7.057453 22.58355  329.5 -28.74040      14.11491 0.27 
1 1 1 20  4  19 o 134.9251 3.907636 147.8022  251.4 17.82322       7.815272 0.95 
1 1 1 20  4  20 o 138.3155 4.261684 179.7786  71.0  -21.65408      8.523368 0.96 
1 1 1 20  4  21 o 102.3983 6.024311 177.4433  346.0 18.71462       12.04862 0.96 
1 1 1 20  4  22 o 28.36110 8.894246 30.25315  354.5 -18.32050      17.78849 0.25 
1 1 1 20  4  23 o 48.92980 10.60979 73.74899  70.2  -15.52196      21.21958 0.66 
1 1 1 20  4  24 o 113.7138 6.035784 200.2543  193.1 18.93904       12.07157 0.96 
1 1 1 20  4  25 o 111.4888 5.773681 139.5936  128.6 -29.71893      11.54736 0.96 
1 1 1 20  4  26 o 88.78105 8.872867 126.0004  116.8 -10.76691      17.74573 0.95 
1 1 1 20  4  27 o 53.48762 11.37026 83.91600  125.5 14.29268       22.74051 0.88 
1 1 1 20  4  28 o 58.73211 10.25915 80.92065  151.2 41.85376       20.51830 0.90 
1 1 1 20  4  29 o 36.03828 11.23374 79.08248  173.9 ?              ?        0.84 
1 1 1 20  6  0  f 372.1055 3.823551 398.6242  325.0 -13.02444      7.647103 0.00 
1 1 1 20  6  1  o 282.8475 3.164762 379.6181  199.8 49.00089       6.329523 0.95 
1 1 1 20  6  2  o 727.2234 6.641877 789.1084  125.8 21.38763       13.28375 0.99 
1 1 1 20  6  3  o 484.5913 4.603604 863.8862  83.3  45.24939       9.207209 0.98 
1 1 1 20  6  4  o 415.2381 4.134595 667.2079  282.0 -4.956146      8.269190 0.97 
1 1 1 20  6  5  o 422.2382 5.838746 627.3475  181.7 -8.627075      11.67749 0.98 
1 1 1 20  6  6  o 603.5320 5.069758 825.9273  117.9 -4.211548      10.13952 0.99 
1 1 1 20  6  7  o 153.8937 2.856632 297.6121  340.9 -16.74469      5.713264 0.84 
1 1 1 20  6  8  o 216.2333 3.989949 275.0800  111.0 ?              ?        0.91 
1 1 1 20  6  9  o 380.0334 4.914911 433.0137  27.4  ?              ?        0.97 
1 1 1 20  6  10 o 38.47093 6.517533 159.2412  319.0 -31.81315      13.03507 0.38 
1 1 1 20  6  11 o 170.5172 2.973510 240.3326  171.2 28.70682       5.947019 0.93 
1 1 1 20  6  12 o 387.7600 3.791966 532.5430  54.4  -3.057007      7.583931 0.99 
1 1 1 20  6  13 o 226.5836 4.368578 408.3733  2.4   30.93861       8.737157 0.98 
1 1 1 20  6  14 o 117.6905 3.924731 242.0521  98.4  31.57593       7.849463 0.94 
1 1 1 20  6  15 f 172.6145 3.360766 298.4514  59.9  5.957123       6.721532 0.00 
1 1 1 20  6  16 o 124.5779 3.841437 210.5031  317.9 26.29604       7.682874 0.95 
1 1 1 20  6  17 f 71.24159 7.511768 43.36621  152.9 5.469978       15.02354 0.00 
1 1 1 20  6  18 o 132.5966 4.311661 193.3324  175.1 23.88663       8.623322 0.96 
1 1 1 20  6  19 o 130.1824 3.987867 216.9637  241.7 -31.77151      7.975735 0.97 
1 1 1 20  6  20 o 66.19183 7.171049 109.0984  189.0 -20.20802      14.34210 0.90 
1 1 1 20  6  21 o 110.8723 5.585126 142.3619  148.0 13.52251       11.17025 0.94 
1 1 1 20  6  22 o 326.0648 4.360178 396.3790  65.4  20.75293       8.720357 0.99 
1 1 1 20  6  23 o 75.91289 8.850385 108.9598  86.0  -8.744423      17.70077 0.90 
1 1 1 20  6  24 o 126.5362 5.942917 143.1385  295.8 -33.85048      11.88583 0.97 
1 1 1 20  6  25 o 99.63692 7.586887 146.3184  302.5 20.38227       15.17377 0.97 
1 1 1 20  6  26 o 49.96967 11.58795 23.54366  238.9 -37.02097      23.17590 0.52 
1 1 1 20  6  27 o 31.26588 10.11914 43.29894  290.6 9.715630       20.23828 0.60 
1 1 1 20  6  28 o 37.92812 11.57830 43.39047  188.8 ?              ?        0.70 
1 1 1 20  8  0  o 557.5359 4.655837 976.6630  152.5 -5.169189      9.311673 0.99 
1 1 1 20  8  1  o 433.1380 3.860470 661.0867  151.1 -54.04288      7.720940 0.98 
1 1 1 20  8  2  o 279.0529 3.071073 319.1914  81.3  -22.35605      6.142146 0.94 
1 1 1 20  8  3  o 225.7247 5.674158 286.3665  45.9  ?              ?        0.91 
1 1 1 20  8  4  o 141.2453 2.980604 307.7679  207.5 -14.78096      5.961208 0.89 
1 1 1 20  8  5  o 270.1113 3.282384 479.2643  232.2 -24.17105      6.564767 0.97 
1 1 1 20  8  6  o 279.6832 3.508893 391.4832  349.2 27.78464       7.017786 0.97 
1 1 1 20  8  7  o 200.2037 2.982544 234.5453  119.9 -14.57919      5.965088 0.94 
1 1 1 20  8  8  o 266.5538 3.184374 399.9426  122.7 -24.96854      6.368748 0.98 
1 1 1 20  8  9  o 238.1580 3.011619 329.6101  149.1 -1.878601      6.023238 0.98 
1 1 1 20  8  10 o 82.94685 4.253946 224.4431  224.1 -30.69010      8.507893 0.90 
1 1 1 20  8  11 o 99.25196 4.519169 161.4647  258.2 35.28676       9.038338 0.89 
1 1 1 20  8  12 o 241.4389 3.359517 354.3565  230.1 12.69043       6.719034 0.98 
1 1 1 20  8  13 o 115.4782 3.627330 62.51531  104.6 8.542931       7.254660 0.80 
1 1 1 20  8  14 o 125.2362 4.568791 181.2688  63.2  9.647278       9.137582 0.95 
1 1 1 20  8  15 o 169.6681 4.512868 234.9604  123.7 -1.587723      9.025737 0.98 
1 1 1 20  8  16 o 75.45554 9.040060 82.09611  184.6 -8.660049      18.08012 0.83 
1 1 1 20  8  17 o 126.0300 6.315467 163.2657  260.7 37.56709       12.63093 0.96 
1 1 1 20  8  18 o 139.2259 5.645454 225.3383  246.1 27.00873       11.29091 0.98 
1 1 1 20  8  19 o 107.8700 6.858217 206.4369  46.4  -8.272110      13.71643 0.96 
1 1 1 20  8  20 o 199.1380 4.519912 291.0809  65.7  24.98547       9.039824 0.99 
1 1 1 20  8  21 o 86.96957 9.048555 149.2943  245.8 34.55821       18.09711 0.94 
1 1 1 20  8  22 o 188.9925 4.794280 266.0086  318.2 -13.03284      9.588560 0.99 
1 1 1 20  8  23 o 82.80426 9.231597 98.75092  309.4 -5.648460      18.46319 0.94 
1 1 1 20  8  24 o 109.6810 7.738415 147.8029  219.2 12.20008       15.47683 0.97 
1 1 1 20  8  25 o 39.66788 11.57529 57.06905  275.4 10.36104       23.15057 0.76 
1 1 1 20  8  26 o 40.78720 12.08489 23.89202  276.2 5.510262       24.16978 0.49 
1 1 1 20  10 0  o 145.8504 2.782634 206.1281  130.6 -2.907288      5.565268 0.94 
1 1 1 20  10 1  o 157.9901 4.897871 311.8596  353.7 ?              ?        0.97 
1 1 1 20  10 2  o 141.2764 3.208202 283.8513  163.0 0.1469116      6.416404 0.96 
1 1 1 20  10 3  o 272.9053 3.733370 427.2200  62.4  9.119598       7.466741 0.99 
1 1 1 20  10 4  o 249.7017 3.449140 494.6577  351.1 -19.35194      6.898280 0.99 
1 1 1 20  10 5  o 152.2088 3.491484 175.2481  318.8 -16.07852      6.982969 0.94 
1 1 1 20  10 6  o 235.7798 3.445662 330.8323  200.7 -14.14630      6.891323 0.98 
1 1 1 20  10 7  o 115.4061 4.632240 228.0982  82.9  -2.605171      9.264480 0.94 
1 1 1 20  10 8  o 174.1809 3.184121 286.4131  342.5 3.466034       6.368243 0.97 
1 1 1 20  10 9  o 288.0742 3.195831 407.4006  28.8  7.199432       6.391662 0.99 
1 1 1 20  10 10 o 118.6287 3.721007 230.0672  39.0  -22.71527      7.442014 0.96 
1 1 1 20  10 11 o 149.8127 3.594200 227.2973  42.8  12.62265       7.188400 0.97 
1 1 1 20  10 12 o 165.1773 3.381880 249.7410  19.2  27.14789       6.763761 0.98 
1 1 1 20  10 13 o 140.9669 3.642753 208.3474  36.1  -2.529175      7.285507 0.97 
1 1 1 20  10 14 o 140.7394 3.610933 207.1966  97.8  25.81773       7.221865 0.98 
1 1 1 20  10 15 o 91.20438 7.940299 127.9728  303.8 -9.150871      15.88060 0.94 
1 1 1 20  10 16 o 188.6043 4.991639 284.3106  292.3 16.75046       9.983277 0.99 
1 1 1 20  10 17 o 161.5937 6.189581 208.7678  242.7 8.762497       12.37916 0.98 
1 1 1 20  10 18 o 66.04712 11.17517 111.7501  126.6 -49.80089      22.35035 0.88 
1 1 1 20  10 19 f 101.2796 8.518596 182.6695  79.7  ?              ?        0.00 
1 1 1 20  10 20 o 55.20971 10.65977 72.93064  177.1 33.52253       21.31954 0.85 
1 1 1 20  10 21 o 43.79959 12.45893 116.4349  147.3 6.314613       24.91787 0.90 
1 1 1 20  10 22 f 85.32471 10.61016 141.2406  63.7  28.86350       21.22031 0.00 
1 1 1 20  10 23 o 39.56496 12.44878 7.848616  11.5  -24.88774      24.89757 0.17 
1 1 1 20  10 24 o 64.17244 13.47016 75.11320  285.4 ?              ?        0.90 
1 1 1 20  12 0  o 84.32706 4.314076 132.2521  336.5 22.50894       8.628152 0.91 
1 1 1 20  12 1  o 130.9199 3.995625 239.2175  97.9  -41.78868      7.991250 0.97 
1 1 1 20  12 2  o 98.75440 4.546971 170.8595  44.4  1.097534       9.093942 0.95 
1 1 1 20  12 3  o 93.48193 8.717445 142.8791  161.4 24.95905       17.43489 0.93 
1 1 1 20  12 4  o 70.43860 5.945474 76.15646  341.0 -19.86960      11.89095 0.82 
1 1 1 20  12 5  f 63.52135 8.791355 84.31915  10.6  1.373302       17.58271 0.00 
1 1 1 20  12 6  o 175.7780 3.629635 284.7351  133.8 -11.77974      7.259270 0.98 
1 1 1 20  12 7  o 46.69308 8.913989 69.10164  78.1  -2.033966      17.82798 0.71 
1 1 1 20  12 8  o 131.6859 4.295232 246.6932  333.8 -12.20659      8.590465 0.98 
1 1 1 20  12 9  o 204.8413 3.580431 291.5204  323.9 -16.70726      7.160861 0.99 
1 1 1 20  12 10 o 66.33449 5.934624 99.18029  143.4 -13.48537      11.86925 0.90 
1 1 1 20  12 11 f 98.13358 4.757234 86.26327  132.4 3.984154       9.514468 0.00 
1 1 1 20  12 12 o 54.93182 7.993122 35.62589  337.1 30.37867       15.98624 0.51 
1 1 1 20  12 13 o 92.74165 5.051160 157.5832  102.2 -10.47343      10.10232 0.95 
1 1 1 20  12 14 o 136.1623 3.992148 188.3258  170.1 11.11809       7.984296 0.97 
1 1 1 20  12 15 o 74.74744 10.79426 75.23759  152.4 46.51194       21.58852 0.87 
1 1 1 20  12 16 o 92.99619 10.39819 116.2297  263.6 5.212395       20.79638 0.95 
1 1 1 20  12 17 o 54.89070 12.77141 91.24330  96.9  3.033314       25.54282 0.89 
1 1 1 20  12 18 o 61.86684 12.28309 95.58025  305.8 -50.89930      24.56618 0.92 
1 1 1 20  12 19 o 40.81322 12.41123 21.18430  290.1 -4.072140      24.82245 0.43 
1 1 1 20  12 20 o 72.74197 13.85837 156.6666  87.4  -45.15691      27.71674 0.96 
1 1 1 20  12 21 o 49.17657 14.48595 27.69496  73.2  ?              ?        0.60 
1 1 1 20  14 0  o 124.0032 4.058335 215.5633  244.5 -15.29510      8.116671 0.98 
1 1 1 20  14 1  o 94.91090 7.731815 192.9464  354.0 15.77905       15.46363 0.96 
1 1 1 20  14 2  o 143.2798 4.748363 229.5411  7.9   12.03378       9.496725 0.98 
1 1 1 20  14 3  o 94.18638 6.918601 131.3894  160.5 30.91876       13.83720 0.94 
1 1 1 20  14 4  o 118.8729 5.351713 166.2184  211.7 5.857834       10.70343 0.96 
1 1 1 20  14 5  o 62.35721 12.07237 102.9208  346.9 1.110657       24.14474 0.86 
1 1 1 20  14 6  o 159.2025 4.474625 307.4361  348.0 8.752670       8.949249 0.99 
1 1 1 20  14 7  o 77.21043 6.995915 108.9542  338.8 -0.6337204     13.99183 0.92 
1 1 1 20  14 8  o 297.0666 3.811621 449.5524  118.9 14.24637       7.623242 1.00 
1 1 1 20  14 9  o 125.7909 4.571419 269.6263  141.0 14.59372       9.142838 0.98 
1 1 1 20  14 10 o 184.7842 3.820093 271.4684  246.7 1.031723       7.640186 0.99 
1 1 1 20  14 11 o 138.1911 4.126062 206.1054  218.1 -1.647751      8.252124 0.99 
1 1 1 20  14 12 o 93.85944 5.624197 193.4190  187.4 9.638969       11.24839 0.98 
1 1 1 20  14 13 o 34.15789 9.051417 44.28860  156.0 -13.10500      18.10283 0.71 
1 1 1 20  14 14 o 37.39723 9.210770 98.73203  252.8 7.012264       18.42154 0.89 
1 1 1 20  14 15 o 85.20193 12.08080 168.5685  180.7 49.43498       24.16161 0.97 
1 1 1 20  14 16 o 102.1166 9.423015 166.2989  340.5 -10.46204      18.84603 0.98 
1 1 1 20  14 17 o 67.26274 10.21252 164.3917  306.7 ?              ?        0.97 
1 1 1 20  16 0  o 38.82866 9.970371 78.89224  102.2 1.507481       19.94074 0.84 
1 1 1 20  16 1  o 38.93194 11.12339 56.27476  179.2 -11.81553      22.24678 0.76 
1 1 1 20  16 2  o 63.80479 11.55764 127.0609  293.9 -17.23825      23.11528 0.94 
1 1 1 20  16 3  f 65.19966 12.27686 138.1678  281.2 47.88830       24.55371 0.00 
1 1 1 20  16 4  o 37.25890 10.99152 65.61815  54.4  -14.29747      21.98304 0.82 
1 1 1 20  16 5  f 52.22022 11.16351 84.03911  84.7  -36.86789      22.32703 0.00 
1 1 1 20  16 6  o 61.12679 10.85410 101.9687  161.2 15.61070       21.70821 0.94 
1 1 1 20  16 7  o 134.8927 8.283424 221.5052  109.0 -6.564133      16.56685 0.99 
1 1 1 20  16 8  o 36.63760 10.62087 64.71210  188.9 -14.14261      21.24175 0.82 
1 1 1 20  16 9  o 112.5062 6.049825 184.7493  256.5 12.92831       12.09965 0.99 
1 1 1 20  16 10 o 47.13808 10.76040 79.11554  52.4  3.720692       21.52080 0.90 
1 1 1 20  16 11 o 40.13943 8.450873 67.90691  97.8  ?              ?        0.88 
1 1 1 20  16 12 x ?        ?        63.38193  281.3 ?              ?        0.00 
1 1 1 21  1  0  o 235.9259 3.173593 391.7594  324.5 -37.55637      6.347186 0.93 
1 1 1 21  1  1  o 330.1318 3.615315 629.3075  99.9  -7.228760      7.230630 0.96 
1 1 1 21  1  2  o 357.1221 3.127471 605.5122  144.8 -23.23868      6.254942 0.97 
1 1 1 21  1  3  o 247.2280 2.637146 354.4413  207.1 31.90352       5.274293 0.93 
1 1 1 21  1  4  o 354.2882 2.928218 513.2889  247.4 62.72641       5.856436 0.97 
1 1 1 21  1  5  o 261.7534 3.420716 463.0151  3.2   84.28508       6.841432 0.93 
1 1 1 21  1  6  o 491.5258 4.110459 756.1320  14.5  -42.54523      8.220918 0.98 
1 1 1 21  1  7  o 188.8028 2.262279 505.2484  358.3 -107.4343      4.524557 0.87 
1 1 1 21  1  8  o 274.8420 2.704185 354.0237  169.2 7.915100       5.408370 0.91 
1 1 1 21  1  9  o 508.7288 4.388324 645.2892  31.1  -17.41074      8.776648 0.98 
1 1 1 21  1  10 o 727.0999 5.533190 896.5380  348.1 -73.40753      11.06638 0.99 
1 1 1 21  1  11 o 501.9564 4.117335 667.4069  341.8 -50.56943      8.234670 0.98 
1 1 1 21  1  12 o 341.9872 3.190055 497.5406  153.4 25.12741       6.380111 0.97 
1 1 1 21  1  13 o 303.6337 3.066997 452.5048  143.4 74.11603       6.133994 0.97 
1 1 1 21  1  14 o 213.1502 2.603481 235.4834  7.0   -43.73888      5.206962 0.94 
1 1 1 21  1  15 o 126.1845 2.718280 245.8612  318.9 18.44728       5.436561 0.93 
1 1 1 21  1  16 o 147.8048 2.866132 262.9587  298.2 -20.57343      5.732265 0.95 
1 1 1 21  1  17 o 130.0198 3.758080 87.05846  16.3  -27.42001      7.516161 0.82 
1 1 1 21  1  18 o 259.0706 3.572573 380.9920  166.0 25.07356       7.145145 0.98 
1 1 1 21  1  19 o 134.3414 3.719889 214.5736  273.6 -8.715668      7.439778 0.96 
1 1 1 21  1  20 o 36.83426 10.67440 54.39481  91.4  -3.862686      21.34879 0.41 
1 1 1 21  1  21 f 91.47377 5.774571 167.6833  161.0 4.135246       11.54914 0.00 
1 1 1 21  1  22 o 104.3539 5.867741 88.18913  159.9 16.38736       11.73548 0.93 
1 1 1 21  1  23 o 89.65150 9.173812 117.6114  75.8  45.20930       18.34762 0.91 
1 1 1 21  1  24 o 39.28003 10.47503 51.69736  92.1  2.606979       20.95006 0.46 
1 1 1 21  1  25 o 96.48421 9.501434 63.94830  121.3 -1.492935      19.00287 0.85 
1 1 1 21  1  26 o 49.42079 11.31288 34.15105  313.1 6.300472       22.62577 0.54 
1 1 1 21  1  27 f 37.94823 10.73715 54.43321  339.6 -25.28153      21.47429 0.00 
1 1 1 21  1  28 o 52.71634 11.06135 64.65715  101.6 32.13392       22.12269 0.84 
1 1 1 21  1  29 o 45.14221 12.14763 29.43801  38.9  -7.788788      24.29527 0.57 
1 1 1 21  1  30 x ?        ?        28.43316  127.9 ?              ?        0.00 
1 1 1 21  3  0  o 182.1171 2.347168 360.2109  36.5  -23.82544      4.694337 0.77 
1 1 1 21  3  1  o 906.0281 6.745489 1636.771  294.8 43.25891       13.49098 0.99 
1 1 1 21  3  2  o 509.5945 4.227001 671.5566  333.9 -6.533295      8.454002 0.98 
1 1 1 21  3  3  o 933.1193 6.493900 1369.190  148.0 22.51794       12.98780 0.99 
1 1 1 21  3  4  f 622.2388 5.470932 1072.657  206.8 -93.92389      10.94186 0.00 
1 1 1 21  3  5  o 272.4341 2.841969 489.6979  121.2 -16.06168      5.683937 0.94 
1 1 1 21  3  6  o 616.7316 4.813917 1065.053  200.6 -14.38831      9.627833 0.99 
1 1 1 21  3  7  o 265.8605 2.738084 345.3406  186.5 22.15517       5.476167 0.91 
1 1 1 21  3  8  o 322.5438 2.830365 479.0806  46.7  43.16586       5.660730 0.95 
1 1 1 21  3  9  o 615.4160 4.757263 750.4330  2.5   25.87347       9.514526 0.98 
1 1 1 21  3  10 o 392.0999 3.211216 691.9287  316.0 31.46277       6.422432 0.97 
1 1 1 21  3  11 o 69.14220 3.997492 174.8700  321.9 18.77780       7.994983 0.42 
1 1 1 21  3  12 o 77.67703 4.328281 95.24392  292.4 -23.47612      8.656563 0.39 
1 1 1 21  3  13 o 229.1563 3.376361 354.8079  165.1 34.52943       6.752721 0.96 
1 1 1 21  3  14 f 258.8661 3.255536 377.2826  40.7  6.073212       6.511071 0.00 
1 1 1 21  3  15 o 390.3501 4.293240 572.7234  29.0  28.54083       8.586479 0.99 
1 1 1 21  3  16 o 142.5124 3.301649 67.88470  70.1  12.40993       6.603298 0.81 
1 1 1 21  3  17 o 145.7109 3.491456 124.1134  96.9  -1.863068      6.982912 0.90 
1 1 1 21  3  18 o 29.18437 9.320461 108.2792  145.7 -14.34512      18.64092 0.51 
1 1 1 21  3  19 o 62.40746 6.541280 106.1812  190.6 -7.525867      13.08256 0.81 
1 1 1 21  3  20 o 141.1609 4.102374 201.4725  305.6 35.03828       8.204748 0.96 
1 1 1 21  3  21 o 222.9043 3.803824 325.7801  299.3 44.56544       7.607648 0.99 
1 1 1 21  3  22 o 161.7180 4.414093 217.5453  230.2 29.54268       8.828187 0.98 
1 1 1 21  3  23 o 92.07521 8.093408 102.9391  228.3 38.63506       16.18682 0.89 
1 1 1 21  3  24 f 79.16341 8.692318 102.6095  347.3 3.617859       17.38464 0.00 
1 1 1 21  3  25 o 80.14281 9.113179 82.99539  3.9   10.24944       18.22636 0.88 
1 1 1 21  3  26 o 175.1657 5.264353 221.6767  217.4 9.269516       10.52871 0.99 
1 1 1 21  3  27 o 41.74350 11.79826 84.68560  258.3 -5.433365      23.59652 0.85 
1 1 1 21  3  28 o 73.23846 10.42170 64.37390  141.4 14.31410       20.84339 0.89 
1 1 1 21  3  29 o 67.00718 12.28757 106.9360  143.8 ?              ?        0.94 
1 1 1 21  5  0  o 798.9749 6.887303 1464.601  306.3 61.41144       13.77461 0.99 
1 1 1 21  5  1  o 456.3178 4.417253 682.8680  166.1 -19.68488      8.834507 0.98 
1 1 1 21  5  2  o 916.6502 8.135931 1062.744  147.0 -35.93079      16.27186 0.99 
1 1 1 21  5  3  o 263.5791 3.013334 240.9891  336.8 8.889099       6.026669 0.90 
1 1 1 21  5  4  f 615.5665 5.451102 708.2278  303.6 -25.33630      10.90220 0.00 
1 1 1 21  5  5  o 393.5488 3.579130 486.2202  355.2 22.78918       7.158259 0.96 
1 1 1 21  5  6  o 272.1466 3.048031 357.4825  231.0 -31.37106      6.096062 0.93 
1 1 1 21  5  7  o 215.9005 2.475358 354.4842  5.0   -16.47226      4.950716 0.90 
1 1 1 21  5  8  o 290.4390 3.165958 454.0918  80.5  31.60529       6.331915 0.95 
1 1 1 21  5  9  o 79.38138 4.630429 145.1571  220.0 7.035088       9.260858 0.52 
1 1 1 21  5  10 o 398.4116 4.314996 490.2423  337.4 31.00681       8.629992 0.98 
1 1 1 21  5  11 o 282.0063 3.425421 431.7567  21.6  0.3159790      6.850843 0.97 
1 1 1 21  5  12 o 106.5714 3.459764 152.1562  31.2  -33.37713      6.919527 0.79 
1 1 1 21  5  13 o 352.4704 4.288108 446.2509  254.5 1.591858       8.576216 0.99 
1 1 1 21  5  14 o 246.3796 3.421281 387.5625  171.2 28.71106       6.842561 0.98 
1 1 1 21  5  15 o 165.1551 4.195770 232.0495  24.6  11.86128       8.391540 0.96 
1 1 1 21  5  16 o 110.8942 4.229346 152.8298  248.9 -12.31155      8.458692 0.91 
1 1 1 21  5  17 o 34.39178 8.712870 137.5186  317.4 12.80607       17.42574 0.71 
1 1 1 21  5  18 o 143.5126 4.197948 207.8178  162.9 33.66204       8.395895 0.96 
1 1 1 21  5  19 o 236.8066 3.475709 350.2137  206.6 24.54810       6.951417 0.99 
1 1 1 21  5  20 o 157.1212 4.131277 189.7909  61.5  34.26042       8.262554 0.98 
1 1 1 21  5  21 o 40.41157 11.01072 45.10381  83.2  1.676033       22.02144 0.47 
1 1 1 21  5  22 o 136.8782 4.722250 241.8595  25.2  12.94827       9.444499 0.97 
1 1 1 21  5  23 o 127.0529 5.732563 105.8411  74.9  -9.898575      11.46513 0.94 
1 1 1 21  5  24 o 49.32833 11.54965 90.61273  74.7  6.116116       23.09931 0.81 
1 1 1 21  5  25 o 74.22820 10.25995 104.0536  60.2  14.14268       20.51991 0.92 
1 1 1 21  5  26 o 105.2604 7.589259 167.1812  55.1  2.159225       15.17852 0.98 
1 1 1 21  5  27 o 121.6597 7.124447 175.3716  52.2  -0.6335678     14.24889 0.98 
1 1 1 21  5  28 o 41.64954 12.10441 70.36819  283.7 ?              ?        0.83 
1 1 1 21  7  0  o 216.2082 2.977523 265.6714  332.7 -29.35661      5.955046 0.88 
1 1 1 21  7  1  o 348.3491 3.470485 422.9326  326.7 -29.25018      6.940971 0.96 
1 1 1 21  7  2  o 234.9106 2.797416 273.9542  49.5  -19.05731      5.594832 0.89 
1 1 1 21  7  3  o 547.9694 5.239809 696.0555  78.9  -0.8131104     10.47962 0.98 
1 1 1 21  7  4  o 284.4782 3.175197 371.8750  297.2 -8.996826      6.350393 0.94 
1 1 1 21  7  5  o 513.4873 4.691129 781.1458  193.5 36.78836       9.382257 0.99 
1 1 1 21  7  6  o 343.3330 3.932360 279.7972  250.6 6.111511       7.864721 0.96 
1 1 1 21  7  7  o 243.9395 2.994913 269.4581  232.8 76.92249       5.989825 0.94 
1 1 1 21  7  8  o 134.1150 3.119356 256.8513  159.6 52.34625       6.238713 0.90 
1 1 1 21  7  9  o 292.5359 3.297556 444.4898  163.5 9.711243       6.595112 0.98 
1 1 1 21  7  10 o 208.4398 3.002209 269.0640  179.2 22.96504       6.004419 0.97 
1 1 1 21  7  11 o 49.95135 7.246140 46.38860  355.0 -15.34116      14.49228 0.36 
1 1 1 21  7  12 o 88.88892 5.474161 142.1002  59.3  -47.02135      10.94832 0.86 
1 1 1 21  7  13 o 210.2280 3.285425 350.7793  305.8 24.55856       6.570850 0.98 
1 1 1 21  7  14 o 98.21291 5.364920 138.6908  329.9 30.81743       10.72984 0.89 
1 1 1 21  7  15 o 53.65271 8.757483 9.311532  139.2 -8.871582      17.51497 0.11 
1 1 1 21  7  16 o 80.80609 7.336062 118.8640  159.0 -31.08614      14.67212 0.89 
1 1 1 21  7  17 o 76.84270 7.233231 162.6296  163.0 4.925171       14.46646 0.92 
1 1 1 21  7  18 o 191.5699 3.858881 316.5141  186.5 1.825363       7.717762 0.99 
1 1 1 21  7  19 o 89.10424 7.191098 96.31496  15.6  18.70334       14.38220 0.91 
1 1 1 21  7  20 o 53.13524 10.52963 57.28584  57.2  -0.8582230     21.05926 0.61 
1 1 1 21  7  21 o 117.2904 6.086345 170.8779  222.6 16.39154       12.17269 0.96 
1 1 1 21  7  22 o 132.8637 5.384765 197.4228  5.2   13.71872       10.76953 0.97 
1 1 1 21  7  23 o 37.33032 11.09296 64.96973  30.1  -6.467724      22.18592 0.70 
1 1 1 21  7  24 o 41.87211 11.01633 50.78889  90.6  -19.99865      22.03265 0.72 
1 1 1 21  7  25 o 50.18315 12.30863 71.32272  353.8 -11.45138      24.61726 0.85 
1 1 1 21  7  26 o 29.58909 10.11701 38.40045  277.0 -10.92654      20.23401 0.55 
1 1 1 21  7  27 o 29.70805 10.16586 48.71948  246.0 ?              ?        0.68 
1 1 1 21  9  0  o 80.39877 3.509582 195.0545  116.1 -2.237320      7.019163 0.76 
1 1 1 21  9  1  o 128.9092 2.748845 164.2914  312.1 -7.880028      5.497691 0.84 
1 1 1 21  9  2  o 237.2175 3.076291 373.6620  117.8 -1.361816      6.152581 0.97 
1 1 1 21  9  3  o 177.9365 2.595585 286.2589  133.9 16.01517       5.191170 0.95 
1 1 1 21  9  4  o 276.2846 4.313861 459.2586  324.3 ?              ?        0.98 
1 1 1 21  9  5  o 275.5531 4.615820 312.3972  329.2 ?              ?        0.98 
1 1 1 21  9  6  f 93.80712 4.653024 189.5230  248.7 -11.66238      9.306047 0.00 
1 1 1 21  9  7  o 254.3935 3.621285 359.5708  347.1 2.073807       7.242570 0.98 
1 1 1 21  9  8  o 155.4828 3.306228 281.7114  260.3 3.366425       6.612456 0.96 
1 1 1 21  9  9  o 101.1987 4.429239 160.1593  80.0  37.44820       8.858479 0.90 
1 1 1 21  9  10 o 148.6576 3.427263 284.6569  192.0 -2.895599      6.854527 0.97 
1 1 1 21  9  11 f 118.5067 3.698554 196.3729  141.2 -1.118675      7.397109 0.00 
1 1 1 21  9  12 o 208.7889 3.074238 387.9492  253.6 13.94711       6.148476 0.99 
1 1 1 21  9  13 o 135.0409 3.681269 189.8549  357.0 3.775757       7.362538 0.96 
1 1 1 21  9  14 o 116.5024 6.405235 127.4942  46.8  28.58326       12.81047 0.94 
1 1 1 21  9  15 o 199.9040 4.816010 312.5381  203.2 2.820419       9.632020 0.99 
1 1 1 21  9  16 o 160.1026 5.371598 232.1318  261.8 -31.06564      10.74320 0.98 
1 1 1 21  9  17 o 49.49348 11.90992 67.00689  2.5   0.9110565      23.81984 0.68 
1 1 1 21  9  18 o 28.20538 9.209807 62.29211  86.1  -3.702536      18.41961 0.45 
1 1 1 21  9  19 o 84.88435 10.82333 143.5086  47.8  16.54620       21.64667 0.93 
1 1 1 21  9  20 o 89.60996 8.815820 86.55393  223.6 -37.37631      17.63164 0.91 
1 1 1 21  9  21 o 56.55923 12.79271 101.7166  320.1 -21.20989      25.58541 0.89 
1 1 1 21  9  22 o 148.6785 6.483713 190.0744  15.1  3.981583       12.96743 0.99 
1 1 1 21  9  23 o 63.03398 12.90569 57.18761  70.1  -23.74528      25.81137 0.85 
1 1 1 21  9  24 o 97.80809 9.302516 144.8414  187.1 -29.28420      18.60503 0.97 
1 1 1 21  9  25 o 34.41792 11.13675 21.12172  272.9 ?              ?        0.42 
1 1 1 21  11 0  o 248.6971 3.326135 414.4326  124.4 -22.75891      6.652271 0.99 
1 1 1 21  11 1  o 66.48043 4.923932 184.1374  226.9 -0.2994080     9.847864 0.88 
1 1 1 21  11 2  o 107.6232 5.020348 157.9529  232.7 -7.389755      10.04070 0.92 
1 1 1 21  11 3  o 185.8802 3.511001 209.6848  115.4 -0.9907532E-01 7.022002 0.97 
1 1 1 21  11 4  o 39.68874 6.610350 85.93412  315.7 -42.29682      13.22070 0.61 
1 1 1 21  11 5  o 227.1273 3.587693 380.5179  325.0 -7.000671      7.175387 0.99 
1 1 1 21  11 6  o 85.11536 5.254068 131.6887  179.2 18.99681       10.50814 0.91 
1 1 1 21  11 7  o 117.6174 4.140107 172.3306  78.2  -11.04065      8.280213 0.95 
1 1 1 21  11 8  o 169.6316 3.393718 240.6681  125.1 -9.311890      6.787437 0.98 
1 1 1 21  11 9  o 140.0140 3.821455 271.0646  258.1 -16.82629      7.642910 0.98 
1 1 1 21  11 10 o 214.5568 3.305833 305.7304  292.0 -2.983154      6.611666 0.99 
1 1 1 21  11 11 o 108.1989 4.233801 120.1750  346.9 -15.08691      8.467602 0.95 
1 1 1 21  11 12 o 122.4723 3.950928 183.1940  78.0  -10.00545      7.901856 0.97 
1 1 1 21  11 13 o 89.76919 5.637229 89.76424  271.9 5.690384       11.27446 0.91 
1 1 1 21  11 14 o 86.46461 6.006191 67.22800  268.2 15.24424       12.01238 0.84 
1 1 1 21  11 15 o 116.2780 7.339240 176.1566  318.1 -27.38052      14.67848 0.96 
1 1 1 21  11 16 o 62.74419 10.93356 116.9702  305.0 24.19687       21.86712 0.89 
1 1 1 21  11 17 o 54.93764 13.35089 100.9050  182.0 -11.57756      26.70179 0.87 
1 1 1 21  11 18 o 133.1720 6.274137 184.4874  244.5 -17.26926      12.54827 0.98 
1 1 1 21  11 19 o 61.09121 13.49751 90.73840  346.3 -8.379997      26.99503 0.90 
1 1 1 21  11 20 o 39.55782 12.20086 54.65814  36.1  -10.50943      24.40171 0.75 
1 1 1 21  11 21 o 49.41071 13.70595 47.98548  303.9 -3.025959      27.41189 0.76 
1 1 1 21  11 22 o 56.96358 14.12506 108.1913  88.7  5.256355       28.25012 0.92 
1 1 1 21  11 23 x ?        ?        120.2943  97.7  ?              ?        0.00 
1 1 1 21  13 0  o 152.2768 5.345207 357.9375  132.9 -12.79625      10.69041 0.99 
1 1 1 21  13 1  o 154.9901 3.492930 237.5071  20.4  11.20792       6.985859 0.98 
1 1 1 21  13 2  o 196.2976 3.996810 314.0317  41.7  9.386124       7.993619 0.99 
1 1 1 21  13 3  o 67.08310 7.287805 101.7332  162.5 -11.26298      14.57561 0.91 
1 1 1 21  13 4  o 135.4677 4.314836 234.9004  172.6 -4.059494      8.629672 0.98 
1 1 1 21  13 5  o 163.4631 5.743770 233.0614  72.6  0.4432678E-01  11.48754 0.99 
1 1 1 21  13 6  o 33.58776 8.853035 25.48469  116.9 4.337433       17.70607 0.32 
1 1 1 21  13 7  o 165.3399 3.865772 296.4820  211.9 -28.88516      7.731544 0.99 
1 1 1 21  13 8  o 38.89076 9.845383 24.24006  80.1  -0.6017685E-01 19.69077 0.28 
1 1 1 21  13 9  o 179.7260 3.938773 313.3681  31.1  5.507553       7.877546 0.99 
1 1 1 21  13 10 o 80.48813 5.945349 159.0009  25.6  -24.44666      11.89070 0.94 
1 1 1 21  13 11 o 48.06187 8.267436 13.75591  172.5 28.76452       16.53487 0.24 
1 1 1 21  13 12 o 81.58200 5.832968 89.00830  252.5 0.4990921      11.66594 0.92 
1 1 1 21  13 13 o 43.12079 9.705600 75.27259  65.2  -4.068035      19.41120 0.81 
1 1 1 21  13 14 o 56.20934 8.446563 122.2318  180.5 -27.67300      16.89313 0.93 
1 1 1 21  13 15 o 79.78607 11.38404 135.9638  166.3 2.750053       22.76807 0.96 
1 1 1 21  13 16 o 208.0298 5.666152 321.4420  18.0  -31.75778      11.33230 0.99 
1 1 1 21  13 17 o 87.79427 12.42911 169.2327  7.4   40.15782       24.85822 0.97 
1 1 1 21  13 18 o 71.50257 13.09367 138.2208  304.9 17.69098       26.18734 0.95 
1 1 1 21  13 19 o 47.94838 12.38165 70.79238  330.0 ?              ?        0.88 
1 1 1 21  15 0  o 45.37116 9.350673 39.98338  199.3 -1.871563      18.70135 0.58 
1 1 1 21  15 1  o 93.68217 7.045733 130.3636  180.9 -32.32477      14.09147 0.95 
1 1 1 21  15 2  o 161.3137 5.216538 241.9221  152.0 15.88867       10.43308 0.99 
1 1 1 21  15 3  o 54.84982 12.32894 141.4869  222.4 13.13711       24.65788 0.91 
1 1 1 21  15 4  o 99.28162 6.522683 171.2244  323.2 -5.248520      13.04537 0.97 
1 1 1 21  15 5  o 68.52808 8.949282 103.0303  316.7 -6.237984      17.89856 0.93 
1 1 1 21  15 6  o 76.67960 8.845262 151.1614  216.7 28.43765       17.69052 0.96 
1 1 1 21  15 7  o 50.50958 11.35727 48.57718  154.1 20.67208       22.71455 0.78 
1 1 1 21  15 8  o 70.50795 12.94075 57.83436  169.4 -24.54839      25.88150 0.88 
1 1 1 21  15 9  o 39.73037 10.35987 62.64087  315.3 -12.39514      20.71974 0.83 
1 1 1 21  15 10 o 103.2095 5.495117 148.5082  45.9  -4.937172      10.99023 0.98 
1 1 1 21  15 11 o 137.1464 4.394755 194.7984  121.4 18.39933       8.789510 0.99 
1 1 1 21  15 12 o 115.2494 4.635870 197.9720  199.2 9.381302       9.271740 0.99 
1 1 1 21  15 13 f 79.33438 6.140171 119.0329  326.7 -5.527321      12.28034 0.00 
1 1 1 21  15 14 o 123.3658 4.205161 209.0908  37.8  ?              ?        0.99 
1 1 1 21  17 0  o 62.16800 9.488346 127.5208  329.0 49.23990       18.97669 0.96 
1 1 1 21  17 1  o 33.42831 10.04173 62.74323  19.0  1.656181       20.08347 0.81 
1 1 1 21  17 2  o 33.57624 10.76641 118.2337  38.8  7.843126       21.53283 0.90 
1 1 1 21  17 3  o 85.36845 9.351565 126.0800  258.6 5.504456       18.70313 0.97 
1 1 1 21  17 4  o 33.39873 10.22784 53.99940  175.5 15.24153       20.45568 0.78 
1 1 1 21  17 5  f 54.01250 13.66738 49.78615  132.7 ?              ?        0.00 
1 1 1 21  17 6  o 37.97636 11.02668 73.21342  271.8 ?              ?        0.87 
1 1 1 21  17 7  x ?        ?        76.88508  200.0 ?              ?        0.00 
1 1 1 22  0  0  o 829.6139 9.104733 1529.623  180.0 0.000000       0.000000 1.00 
1 1 1 22  0  1  o 389.7484 5.342352 9.692255  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  2  o 572.1948 6.857294 683.4861  180.0 0.000000       0.000000 1.00 
1 1 1 22  0  3  o 880.0951 8.238186 911.9961  180.0 0.000000       0.000000 1.00 
1 1 1 22  0  4  f 180.7672 3.348422 103.1923  180.0 0.000000       0.000000 0.00 
1 1 1 22  0  5  o 545.6548 5.755503 99.50876  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  6  o 504.4726 7.196787 539.7504  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  7  o 98.25565 3.631754 89.09409  180.0 0.000000       0.000000 0.33 
1 1 1 22  0  8  o 768.9609 7.959886 1095.710  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  9  o 350.6283 5.355258 356.7238  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  10 f 226.9557 4.078718 245.1330  0.0   0.000000       0.000000 0.00 
1 1 1 22  0  11 o 220.5057 4.683741 317.6467  0.0   0.000000       0.000000 0.98 
1 1 1 22  0  12 o 177.7793 4.006986 137.6073  0.0   0.000000       0.000000 0.86 
1 1 1 22  0  13 f 57.90973 6.597698 181.6798  180.0 0.000000       0.000000 0.00 
1 1 1 22  0  14 o 109.3018 4.738950 180.4753  0.0   0.000000       0.000000 0.91 
1 1 1 22  0  15 o 159.3189 4.249607 111.8303  0.0   0.000000       0.000000 0.96 
1 1 1 22  0  16 o 119.0786 4.269536 218.6764  180.0 0.000000       0.000000 1.00 
1 1 1 22  0  17 o 226.4540 3.851635 306.9605  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  18 o 67.50059 7.681476 104.5098  0.0   0.000000       0.000000 0.85 
1 1 1 22  0  19 o 28.81497 14.03299 34.16233  180.0 0.000000       0.000000 0.21 
1 1 1 22  0  20 o 28.84223 15.04272 3.122869  0.0   0.000000       0.000000 0.02 
1 1 1 22  0  21 o 24.41326 14.44544 44.24545  0.0   0.000000       0.000000 0.30 
1 1 1 22  0  22 o 143.4764 5.410081 216.1068  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  23 f 273.5480 4.815563 408.1837  0.0   0.000000       0.000000 0.00 
1 1 1 22  0  24 o 22.62138 13.85836 31.99787  0.0   0.000000       0.000000 0.19 
1 1 1 22  0  25 o 47.15630 20.71504 10.16711  0.0   0.000000       0.000000 0.14 
1 1 1 22  0  26 o 123.7401 10.12295 75.45129  180.0 0.000000       0.000000 1.00 
1 1 1 22  0  27 o 93.32794 13.38744 139.5084  0.0   0.000000       0.000000 1.00 
1 1 1 22  0  28 o 23.39872 16.36380 2.186318  180.0 0.000000       0.000000 0.03 
1 1 1 22  0  29 o 31.65829 20.08907 18.60368  0.0   0.000000       0.000000 0.29 
1 1 1 22  2  0  o 79.08266 2.900513 311.3597  45.6  7.305099       5.801026 0.37 
1 1 1 22  2  1  o 105.5466 2.830566 282.3401  63.0  0.8335114E-01  5.661131 0.64 
1 1 1 22  2  2  o 353.8157 3.060455 580.2032  99.0  83.83014       6.120910 0.96 
1 1 1 22  2  3  o 935.4255 6.529759 1463.011  116.9 38.75439       13.05952 0.99 
1 1 1 22  2  4  o 483.1100 4.140096 772.8951  13.5  58.11258       8.280191 0.98 
1 1 1 22  2  5  o 124.9728 2.287042 308.6712  63.1  -13.01947      4.574084 0.51 
1 1 1 22  2  6  o 541.7253 4.253139 618.2320  197.4 -45.81635      8.506279 0.98 
1 1 1 22  2  7  f 278.5785 2.599891 706.4832  107.6 35.44043       5.199781 0.00 
1 1 1 22  2  8  o 211.2863 2.901069 315.0798  37.5  75.42734       5.802139 0.91 
1 1 1 22  2  9  o 363.5355 3.021571 495.3645  348.7 -6.626953      6.043141 0.96 
1 1 1 22  2  10 o 499.0646 4.051578 810.2371  302.9 3.842072       8.103156 0.98 
1 1 1 22  2  11 o 147.1157 2.615467 262.3994  127.1 -16.32150      5.230935 0.82 
1 1 1 22  2  12 o 330.5583 3.495465 353.6967  43.5  51.57913       6.990930 0.96 
1 1 1 22  2  13 o 273.9670 2.859398 423.0182  113.3 -17.61624      5.718795 0.97 
1 1 1 22  2  14 o 122.1659 3.233749 78.50314  100.3 10.34904       6.467498 0.72 
1 1 1 22  2  15 f 48.97402 6.045126 54.16788  115.5 11.11168       12.09025 0.00 
1 1 1 22  2  16 o 113.1486 3.892748 104.6095  79.8  1.628716       7.785495 0.83 
1 1 1 22  2  17 o 61.23236 7.303983 112.9086  354.1 -18.66380      14.60797 0.71 
1 1 1 22  2  18 o 200.4370 3.465022 213.6175  289.6 -4.046600      6.930044 0.97 
1 1 1 22  2  19 o 154.9126 3.849259 189.1983  107.1 16.43604       7.698517 0.96 
1 1 1 22  2  20 o 46.53078 9.539906 88.89922  99.6  -13.62918      19.07981 0.70 
1 1 1 22  2  21 o 149.7208 4.231382 180.0990  156.3 8.766663       8.462765 0.97 
1 1 1 22  2  22 o 48.62888 9.716693 84.47571  140.0 -18.33467      19.43339 0.76 
1 1 1 22  2  23 o 44.35120 10.46687 53.06019  79.9  -21.69866      20.93375 0.50 
1 1 1 22  2  24 o 91.33292 6.820464 140.3662  301.2 8.733818       13.64093 0.93 
1 1 1 22  2  25 o 135.4201 5.445604 156.9893  91.4  -2.190399      10.89121 0.97 
1 1 1 22  2  26 o 31.36581 10.15995 39.22832  312.2 -10.81544      20.31990 0.48 
1 1 1 22  2  27 o 80.41647 12.39490 95.57108  145.2 6.785866       24.78980 0.93 
1 1 1 22  2  28 o 39.58150 10.91339 83.73936  90.8  10.18614       21.82679 0.84 
1 1 1 22  2  29 o 90.29855 9.401081 110.8107  135.9 ?              ?        0.96 
1 1 1 22  4  0  o 591.9668 4.691158 1149.473  5.0   78.29968       9.382316 0.99 
1 1 1 22  4  1  o 114.9969 2.465866 232.8669  176.1 11.83289       4.931733 0.57 
1 1 1 22  4  2  o 383.4949 3.477196 379.4905  123.8 2.298706       6.954391 0.95 
1 1 1 22  4  3  o 144.9814 2.713997 236.7423  21.3  -2.343750      5.427994 0.77 
1 1 1 22  4  4  o 395.4027 3.444005 420.7640  212.1 -63.12219      6.888010 0.95 
1 1 1 22  4  5  o 468.6328 3.973326 624.0718  64.4  -33.63254      7.946653 0.97 
1 1 1 22  4  6  o 313.1743 4.009638 324.0078  85.7  5.287170       8.019276 0.94 
1 1 1 22  4  7  o 442.8202 3.752582 583.6085  325.4 -10.11368      7.505163 0.97 
1 1 1 22  4  8  f 534.8656 4.162641 563.3369  45.9  -39.75665      8.325282 0.00 
1 1 1 22  4  9  o 470.5494 4.724851 615.3122  337.6 -63.45798      9.449701 0.98 
1 1 1 22  4  10 o 555.3542 4.192673 740.1851  292.0 -29.40820      8.385346 0.99 
1 1 1 22  4  11 o 251.6667 3.609931 454.1714  27.3  14.77664       7.219863 0.96 
1 1 1 22  4  12 o 234.6587 4.063195 195.1160  331.6 6.757736       8.126390 0.93 
1 1 1 22  4  13 o 688.5023 6.430883 933.2551  255.4 1.031555       12.86177 1.00 
1 1 1 22  4  14 o 87.59680 4.187275 135.1285  213.0 -13.81637      8.374550 0.83 
1 1 1 22  4  15 o 119.5376 3.962667 122.2514  203.7 12.06837       7.925334 0.87 
1 1 1 22  4  16 o 112.3555 4.038498 74.23992  200.8 -22.45438      8.076997 0.77 
1 1 1 22  4  17 o 56.71338 7.875528 54.35299  296.7 13.98418       15.75106 0.51 
1 1 1 22  4  18 o 65.42097 7.938770 100.9479  181.2 -0.1700363     15.87754 0.81 
1 1 1 22  4  19 o 47.53971 9.246132 104.5514  181.4 -11.37590      18.49226 0.75 
1 1 1 22  4  20 o 204.8511 3.803668 283.0128  299.6 -1.935867      7.607335 0.99 
1 1 1 22  4  21 o 120.1317 5.213886 145.7348  209.5 -12.07626      10.42777 0.96 
1 1 1 22  4  22 o 92.40678 6.556792 98.24301  45.5  28.37543       13.11358 0.88 
1 1 1 22  4  23 o 51.78997 10.26134 119.2593  243.7 -35.36536      20.52268 0.83 
1 1 1 22  4  24 o 53.58428 10.51239 79.35580  189.5 23.75299       21.02478 0.79 
1 1 1 22  4  25 o 34.10267 10.39819 21.17118  142.1 6.167456       20.79638 0.29 
1 1 1 22  4  26 o 40.03077 10.84568 101.5783  350.2 13.28890       21.69136 0.87 
1 1 1 22  4  27 o 64.30585 10.89117 61.84515  47.6  30.36029       21.78233 0.87 
1 1 1 22  4  28 o 80.78741 11.07973 123.6500  214.3 30.98929       22.15946 0.95 
1 1 1 22  6  0  o 146.7736 2.813713 246.1016  17.4  29.91595       5.627427 0.82 
1 1 1 22  6  1  o 264.8740 3.074177 348.5611  71.9  1.417969       6.148354 0.91 
1 1 1 22  6  2  o 194.4939 2.686299 254.2495  12.7  58.31734       5.372599 0.84 
1 1 1 22  6  3  o 230.1627 2.907423 294.6534  73.7  -32.04237      5.814847 0.90 
1 1 1 22  6  4  o 153.8396 3.860871 121.8901  38.6  -14.90239      7.721742 0.51 
1 1 1 22  6  5  o 241.9863 3.161732 203.8449  100.2 9.359467       6.323463 0.88 
1 1 1 22  6  6  o 351.9285 3.784252 601.7447  276.7 36.93970       7.568505 0.97 
1 1 1 22  6  7  o 158.2126 2.543473 296.1168  200.6 12.35034       5.086946 0.89 
1 1 1 22  6  8  o 217.5700 2.973029 204.3431  301.7 51.43448       5.946058 0.89 
1 1 1 22  6  9  o 316.6709 4.606317 306.2213  306.2 ?              ?        0.96 
1 1 1 22  6  10 o 176.0396 3.578771 229.5945  44.0  14.00859       7.157543 0.93 
1 1 1 22  6  11 o 168.2231 3.251486 338.2357  67.8  21.21353       6.502972 0.96 
1 1 1 22  6  12 o 101.9050 3.722198 177.3812  342.7 21.78426       7.444397 0.90 
1 1 1 22  6  13 o 140.6996 4.429274 232.4702  25.9  -0.2899170E-03 8.858548 0.95 
1 1 1 22  6  14 o 254.6299 3.778464 299.5617  69.8  -17.38101      7.556927 0.98 
1 1 1 22  6  15 o 70.78021 9.239982 83.73950  235.6 14.38258       18.47996 0.72 
1 1 1 22  6  16 o 155.6026 3.293111 254.9989  239.5 -20.36458      6.586222 0.97 
1 1 1 22  6  17 f 102.8124 5.519780 196.6746  14.3  4.892021       11.03956 0.00 
1 1 1 22  6  18 o 117.6049 4.425670 181.2586  88.1  -20.46206      8.851340 0.96 
1 1 1 22  6  19 o 163.0773 3.731435 251.3033  22.0  -28.09793      7.462870 0.98 
1 1 1 22  6  20 o 44.35318 9.963121 53.25735  264.6 16.97247       19.92624 0.56 
1 1 1 22  6  21 o 152.4470 4.944273 225.5360  242.3 8.142822       9.888545 0.97 
1 1 1 22  6  22 o 128.0822 5.712665 192.1224  314.4 0.4949036      11.42533 0.97 
1 1 1 22  6  23 o 66.90973 10.51447 88.51726  98.5  22.42872       21.02893 0.87 
1 1 1 22  6  24 o 158.2268 5.135742 175.7242  105.2 -7.597733      10.27148 0.98 
1 1 1 22  6  25 o 69.78218 11.03498 125.7058  333.5 -34.60134      22.06995 0.94 
1 1 1 22  6  26 o 84.71957 9.596531 85.15009  327.5 -20.80978      19.19306 0.93 
1 1 1 22  6  27 o 57.22466 12.90224 71.65974  71.4  -17.86943      25.80449 0.88 
1 1 1 22  8  0  o 116.2042 2.879194 281.4625  20.6  -17.75209      5.758387 0.83 
1 1 1 22  8  1  o 162.8210 2.754613 236.4668  268.8 -67.39740      5.509227 0.87 
1 1 1 22  8  2  o 151.0715 3.143221 167.9632  100.0 38.05833       6.286442 0.80 
1 1 1 22  8  3  o 125.2334 3.065535 103.0142  279.4 -0.5051193     6.131070 0.51 
1 1 1 22  8  4  o 138.3821 3.048780 293.2603  136.5 7.333221       6.097561 0.91 
1 1 1 22  8  5  o 454.9389 4.393141 679.8064  98.9  54.45135       8.786282 0.99 
1 1 1 22  8  6  o 182.0874 3.435793 387.9900  54.4  22.07947       6.871585 0.96 
1 1 1 22  8  7  o 282.2258 4.412142 339.0993  331.3 ?              ?        0.98 
1 1 1 22  8  8  o 37.89687 8.083874 117.4436  240.0 -3.593704      16.16775 0.49 
1 1 1 22  8  9  o 387.7368 3.833663 560.5113  174.0 24.22394       7.667326 0.99 
1 1 1 22  8  10 f 192.9022 2.979877 288.5892  142.4 23.64392       5.959754 0.00 
1 1 1 22  8  11 o 180.1493 3.186804 377.2619  31.6  -33.95403      6.373607 0.98 
1 1 1 22  8  12 o 138.2083 4.812811 178.2950  232.0 -18.65923      9.625622 0.95 
1 1 1 22  8  13 o 200.2106 3.194777 203.5714  184.8 24.58075       6.389554 0.97 
1 1 1 22  8  14 o 117.1743 5.645852 148.1598  1.6   20.80512       11.29170 0.94 
1 1 1 22  8  15 o 108.4695 5.250422 128.0065  281.1 -28.46034      10.50084 0.93 
1 1 1 22  8  16 o 150.0387 4.502083 248.2244  207.2 -19.81310      9.004166 0.98 
1 1 1 22  8  17 o 105.6407 7.219518 127.1132  100.7 23.09975       14.43904 0.95 
1 1 1 22  8  18 o 86.43147 8.604755 83.49430  166.5 6.192024       17.20951 0.87 
1 1 1 22  8  19 o 50.68265 12.37469 124.0961  91.1  -4.438065      24.74938 0.83 
1 1 1 22  8  20 o 194.0056 5.304733 289.3792  141.4 -24.47830      10.60947 0.99 
1 1 1 22  8  21 o 92.60954 8.546715 101.0663  131.0 5.937561       17.09343 0.93 
1 1 1 22  8  22 o 62.73457 10.85307 91.92551  54.0  13.94669       21.70613 0.90 
1 1 1 22  8  23 o 77.12790 10.62011 105.8811  7.7   23.12995       21.24022 0.94 
1 1 1 22  8  24 o 38.75902 11.41009 18.71353  179.8 8.509876       22.82017 0.36 
1 1 1 22  8  25 o 46.09229 12.12626 74.14334  65.1  15.23387       24.25253 0.86 
1 1 1 22  8  26 o 42.85646 12.71621 10.33800  104.4 ?              ?        0.26 
1 1 1 22  10 0  o 260.2370 4.511522 447.5301  42.7  ?              ?        0.99 
1 1 1 22  10 1  o 218.0345 2.715336 338.5642  145.9 -7.600754      5.430673 0.98 
1 1 1 22  10 2  o 233.7707 3.121028 343.2680  206.2 -16.89761      6.242056 0.98 
1 1 1 22  10 3  o 378.3660 3.818704 524.0189  231.2 -37.03918      7.637407 0.99 
1 1 1 22  10 4  o 159.2907 3.443296 191.3502  266.5 53.25285       6.886593 0.95 
1 1 1 22  10 5  f 189.9876 3.314420 193.5564  283.0 28.35458       6.628840 0.00 
1 1 1 22  10 6  o 260.2717 3.394957 460.5226  190.0 -19.79121      6.789914 0.99 
1 1 1 22  10 7  o 188.5997 3.393492 264.4594  246.2 16.87741       6.786984 0.98 
1 1 1 22  10 8  o 218.1873 3.236698 344.7805  216.8 6.182388       6.473396 0.99 
1 1 1 22  10 9  o 116.1970 4.047122 180.2704  234.7 -27.99097      8.094244 0.95 
1 1 1 22  10 10 o 230.6109 3.548478 334.7480  259.0 8.770401       7.096956 0.99 
1 1 1 22  10 11 o 61.02685 6.898311 114.4031  204.4 7.888069       13.79662 0.86 
1 1 1 22  10 12 o 212.5555 3.195709 253.8079  258.8 9.002563       6.391417 0.99 
1 1 1 22  10 13 f 98.98227 8.004445 167.8651  300.6 21.09420       16.00889 0.00 
1 1 1 22  10 14 o 179.3453 4.465574 251.8577  53.6  -1.411774      8.931148 0.99 
1 1 1 22  10 15 o 65.32309 10.39202 72.95206  200.1 11.19558       20.78405 0.80 
1 1 1 22  10 16 o 105.4749 6.403368 135.4390  4.7   -17.78709      12.80674 0.94 
1 1 1 22  10 17 o 75.38635 11.13062 106.7699  36.9  6.062874       22.26124 0.89 
1 1 1 22  10 18 o 139.4259 6.850002 207.5946  193.8 -14.79974      13.70000 0.98 
1 1 1 22  10 19 o 70.41299 11.72568 115.8651  278.0 -38.05843      23.45136 0.93 
1 1 1 22  10 20 o 49.84295 13.31848 72.81313  298.3 -7.649422      26.63695 0.84 
1 1 1 22  10 21 o 57.74477 12.17512 85.60525  190.3 22.41145       24.35024 0.90 
1 1 1 22  10 22 o 45.85559 11.99683 80.91125  44.1  18.50159       23.99366 0.86 
1 1 1 22  10 23 o 38.65517 12.19014 90.94328  46.8  -4.513832      24.38027 0.87 
1 1 1 22  10 24 x ?        ?        53.78717  133.0 ?              ?        0.00 
1 1 1 22  12 0  o 90.57680 4.122342 119.5074  330.9 -11.15616      8.244684 0.92 
1 1 1 22  12 1  o 99.35812 4.217093 235.3382  338.2 17.19542       8.434187 0.96 
1 1 1 22  12 2  o 95.15011 3.950596 130.6664  205.9 -11.48929      7.901193 0.93 
1 1 1 22  12 3  o 103.8984 4.811780 175.0823  177.6 -0.2483444     9.623561 0.95 
1 1 1 22  12 4  o 154.2915 3.721214 250.2260  273.7 7.615219       7.442428 0.98 
1 1 1 22  12 5  o 182.0343 4.446378 318.1385  293.9 ?              ?        0.99 
1 1 1 22  12 6  o 192.4959 5.121764 293.0092  224.7 12.14581       10.24353 0.99 
1 1 1 22  12 7  f 228.8849 3.502392 383.8596  147.7 -11.77008      7.004784 0.00 
1 1 1 22  12 8  o 45.85470 9.562819 61.04125  202.3 17.65075       19.12564 0.75 
1 1 1 22  12 9  o 103.2953 4.931964 133.0695  301.6 -4.158188      9.863929 0.96 
1 1 1 22  12 10 o 199.6949 3.581398 294.0602  69.6  -4.246643      7.162797 0.99 
1 1 1 22  12 11 o 39.15546 9.800385 84.67044  88.9  -2.617840      19.60077 0.69 
1 1 1 22  12 12 o 93.01932 5.579127 159.0692  265.5 0.9466400      11.15825 0.95 
1 1 1 22  12 13 o 142.2847 4.196537 213.6208  286.9 10.79289       8.393073 0.98 
1 1 1 22  12 14 o 71.90012 7.497995 99.91144  135.1 1.923759       14.99599 0.91 
1 1 1 22  12 15 o 146.9747 6.859042 197.9306  178.5 18.47809       13.71808 0.98 
1 1 1 22  12 16 o 83.63294 10.23260 108.8902  7.1   -26.26233      20.46519 0.95 
1 1 1 22  12 17 o 35.73621 11.66657 74.40240  191.8 -1.396854      23.33313 0.81 
1 1 1 22  12 18 o 68.42815 13.96407 62.35011  95.7  -8.028549      27.92813 0.88 
1 1 1 22  12 19 o 63.42554 13.68605 104.0907  13.9  -2.135715      27.37209 0.92 
1 1 1 22  12 20 o 45.27300 13.22676 59.16796  325.1 -0.6337891     26.45351 0.82 
1 1 1 22  12 21 x ?        ?        87.54860  55.4  ?              ?        0.00 
1 1 1 22  14 0  o 215.6946 3.478051 397.9996  34.2  -19.56535      6.956103 0.99 
1 1 1 22  14 1  o 222.1100 3.335612 415.8275  355.3 -1.691925      6.671223 0.99 
1 1 1 22  14 2  o 71.05620 12.00480 83.73294  168.8 5.597443       24.00959 0.85 
1 1 1 22  14 3  o 35.85179 10.01766 79.65422  188.4 -15.54368      20.03532 0.67 
1 1 1 22  14 4  o 79.15201 8.328760 112.2934  43.3  8.846848       16.65752 0.92 
1 1 1 22  14 5  o 84.65730 6.828512 118.2000  63.8  8.623619       13.65702 0.93 
1 1 1 22  14 6  o 50.91500 8.777376 27.00010  190.6 37.41609       17.55475 0.45 
1 1 1 22  14 7  f 129.3049 4.761808 189.8982  296.6 -8.534554      9.523616 0.00 
1 1 1 22  14 8  o 68.87005 11.82296 168.6282  267.7 19.50123       23.64591 0.94 
1 1 1 22  14 9  o 127.0582 4.936511 152.2836  50.0  16.07970       9.873022 0.98 
1 1 1 22  14 10 o 136.0454 4.052484 228.8703  15.8  -9.213745      8.104967 0.99 
1 1 1 22  14 11 o 58.63850 8.626155 73.97366  307.8 5.074654       17.25231 0.90 
1 1 1 22  14 12 o 46.02987 9.305682 55.96986  244.1 19.19658       18.61136 0.84 
1 1 1 22  14 13 o 54.13955 8.658579 88.83264  36.7  21.48432       17.31716 0.92 
1 1 1 22  14 14 o 95.14678 5.167260 155.3838  60.0  7.291534       10.33452 0.98 
1 1 1 22  14 15 o 35.23294 8.862364 42.96261  109.4 22.65909       17.72473 0.72 
1 1 1 22  14 16 o 116.3201 11.49185 201.9482  104.8 ?              ?        0.98 
1 1 1 22  14 17 x ?        ?        65.90528  158.2 ?              ?        0.00 
1 1 1 22  16 0  o 47.82269 9.811607 87.90314  233.8 -16.62682      19.62321 0.90 
1 1 1 22  16 1  o 122.7808 5.197791 216.6535  42.5  13.78466       10.39558 0.99 
1 1 1 22  16 2  o 102.1524 8.024034 207.0385  78.4  13.29209       16.04807 0.98 
1 1 1 22  16 3  o 94.30005 8.211165 165.5560  167.5 18.65882       16.42233 0.98 
1 1 1 22  16 4  o 46.48520 11.77981 73.64874  99.5  7.641602       23.55962 0.87 
1 1 1 22  16 5  o 64.84653 11.22177 110.4015  306.7 19.26564       22.44354 0.94 
1 1 1 22  16 6  o 90.46030 7.714739 171.7552  264.7 3.105026       15.42948 0.98 
1 1 1 22  16 7  o 34.49632 10.51538 27.79903  136.9 -2.286358      21.03075 0.53 
1 1 1 22  16 8  o 30.09463 9.708378 46.47688  78.9  -3.259537      19.41676 0.70 
1 1 1 22  16 9  o 43.96056 13.20071 132.4794  324.2 -7.128326      26.40143 0.93 
1 1 1 22  16 10 o 41.18632 13.08746 38.08312  301.6 ?              ?        0.69 
1 1 1 22  16 11 x ?        ?        49.40930  154.0 ?              ?        0.00 
1 1 1 23  1  0  o 431.0400 4.423954 802.9368  229.5 15.74844       8.847907 0.98 
1 1 1 23  1  1  o 447.6742 3.729684 566.8388  255.9 -14.36520      7.459368 0.97 
1 1 1 23  1  2  o 549.3609 4.323419 488.0242  240.2 -5.655151      8.646837 0.98 
1 1 1 23  1  3  o 1202.936 8.171681 1506.524  170.8 13.46375       16.34336 1.00 
1 1 1 23  1  4  o 281.9822 3.010384 309.9921  119.0 11.79034       6.020768 0.82 
1 1 1 23  1  5  f 491.5721 3.729474 701.4618  219.0 -6.199432      7.458948 0.00 
1 1 1 23  1  6  o 263.5124 2.744459 276.3510  215.5 -16.56752      5.488917 0.93 
1 1 1 23  1  7  o 579.4580 4.451425 760.9233  217.2 19.63812       8.902849 0.98 
1 1 1 23  1  8  o 386.3676 4.133134 474.7392  53.4  4.439362       8.266269 0.96 
1 1 1 23  1  9  o 483.6380 4.082727 740.1786  200.0 -32.57690      8.165455 0.98 
1 1 1 23  1  10 o 253.7414 3.148185 299.3189  190.5 -44.49759      6.296371 0.91 
1 1 1 23  1  11 f 320.1872 3.183162 258.7100  38.3  -21.43323      6.366324 0.00 
1 1 1 23  1  12 o 271.2833 2.733319 400.4547  337.9 38.88300       5.466638 0.96 
1 1 1 23  1  13 o 231.5210 2.714794 220.2045  146.9 -48.04294      5.429588 0.94 
1 1 1 23  1  14 o 409.0121 3.674278 508.6158  126.8 -18.51123      7.348556 0.99 
1 1 1 23  1  15 f 88.04399 3.737834 167.0431  294.1 34.91032       7.475669 0.00 
1 1 1 23  1  16 o 146.0655 2.969960 303.5922  229.7 7.877090       5.939919 0.96 
1 1 1 23  1  17 o 148.3467 2.947692 231.3366  227.1 13.10493       5.895384 0.95 
1 1 1 23  1  18 o 178.1811 3.016922 214.1502  247.2 9.176392       6.033844 0.97 
1 1 1 23  1  19 f 71.10905 5.162770 110.3705  145.6 -33.28189      10.32554 0.00 
1 1 1 23  1  20 o 102.7109 5.169715 129.3872  297.7 -16.86405      10.33943 0.92 
1 1 1 23  1  21 o 102.7306 4.314775 73.53651  269.1 -8.303085      8.629550 0.90 
1 1 1 23  1  22 o 120.1941 5.238747 187.7160  8.6   30.74831       10.47749 0.96 
1 1 1 23  1  23 o 91.89180 8.979182 75.00436  292.7 21.75523       17.95836 0.84 
1 1 1 23  1  24 o 80.64386 7.530421 104.8752  206.8 -17.53095      15.06084 0.89 
1 1 1 23  1  25 o 51.49567 11.41370 29.39031  18.5  -10.06957      22.82740 0.47 
1 1 1 23  1  26 o 120.4524 6.553067 147.6933  215.8 32.88583       13.10613 0.97 
1 1 1 23  1  27 o 81.67061 9.245037 122.0588  126.3 -5.663498      18.49007 0.95 
1 1 1 23  1  28 o 59.91365 12.35184 40.38432  246.4 -19.65690      24.70369 0.76 
1 1 1 23  1  29 o 32.46210 10.33816 53.88723  205.2 ?              ?        0.72 
1 1 1 23  3  0  o 423.1874 3.682952 552.4683  79.2  34.71262       7.365905 0.97 
1 1 1 23  3  1  o 433.8007 3.782637 826.2067  30.9  -23.61722      7.565274 0.98 
1 1 1 23  3  2  o 281.8095 3.023270 524.5292  69.1  -13.12372      6.046539 0.94 
1 1 1 23  3  3  o 521.5609 4.047812 546.8881  346.7 0.4927368      8.095624 0.98 
1 1 1 23  3  4  o 424.2632 3.865330 707.9988  17.3  -14.05243      7.730659 0.97 
1 1 1 23  3  5  o 668.4506 5.130076 839.7573  65.0  41.15204       10.26015 0.99 
1 1 1 23  3  6  o 141.1073 2.709850 264.1175  291.8 -23.62488      5.419699 0.77 
1 1 1 23  3  7  o 536.4011 4.945670 621.5263  271.7 -4.945984      9.891340 0.98 
1 1 1 23  3  8  o 184.1045 2.435477 304.5956  345.5 -62.60321      4.870954 0.84 
1 1 1 23  3  9  o 355.8666 2.973526 558.5126  75.8  27.21259       5.947052 0.97 
1 1 1 23  3  10 o 194.8214 2.342973 200.0681  246.5 -47.69778      4.685947 0.86 
1 1 1 23  3  11 o 106.7511 3.177203 286.1665  83.3  11.14131       6.354406 0.84 
1 1 1 23  3  12 o 77.72563 4.346666 138.1123  43.2  36.37187       8.693333 0.64 
1 1 1 23  3  13 o 215.5533 2.722778 310.2011  221.2 -48.60182      5.445557 0.96 
1 1 1 23  3  14 o 79.11009 3.974202 132.7112  39.8  -23.49380      7.948403 0.82 
1 1 1 23  3  15 o 240.2164 3.293134 373.4642  282.2 -55.96291      6.586268 0.98 
1 1 1 23  3  16 o 120.3324 3.806406 260.7441  324.3 -16.57967      7.612813 0.94 
1 1 1 23  3  17 o 36.48636 8.261594 88.82778  312.7 17.19599       16.52319 0.51 
1 1 1 23  3  18 o 158.7680 4.767664 197.7579  175.5 4.262558       9.535329 0.96 
1 1 1 23  3  19 o 160.9175 3.920339 224.5308  76.1  41.67159       7.840677 0.97 
1 1 1 23  3  20 o 245.3089 3.897271 333.7107  23.4  -5.420120      7.794541 0.99 
1 1 1 23  3  21 o 69.95251 8.280908 143.3830  62.0  19.34240       16.56182 0.92 
1 1 1 23  3  22 o 131.3856 5.174775 188.0212  16.7  49.93425       10.34955 0.96 
1 1 1 23  3  23 o 70.20321 8.713944 128.9740  178.8 -28.77542      17.42789 0.89 
1 1 1 23  3  24 o 88.45664 7.555160 167.3503  137.6 5.999161       15.11032 0.95 
1 1 1 23  3  25 o 126.8916 6.092874 139.5985  62.9  20.75471       12.18575 0.97 
1 1 1 23  3  26 o 102.1084 8.135482 123.2562  2.2   27.99828       16.27096 0.96 
1 1 1 23  3  27 o 63.24513 11.34857 84.06466  253.6 3.642262       22.69714 0.90 
1 1 1 23  3  28 o 26.75697 9.305804 32.19044  318.2 -9.208788      18.61161 0.45 
1 1 1 23  3  29 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 23  5  0  o 361.8059 3.302050 621.1985  118.6 57.55750       6.604099 0.97 
1 1 1 23  5  1  f 414.0779 3.850343 562.7143  62.9  -19.24677      7.700686 0.00 
1 1 1 23  5  2  o 429.3832 4.321830 421.3765  95.9  -55.64319      8.643660 0.97 
1 1 1 23  5  3  o 424.2430 4.154302 443.4226  75.4  58.95013       8.308603 0.96 
1 1 1 23  5  4  o 414.3830 4.112862 581.3456  261.8 56.82822       8.225724 0.97 
1 1 1 23  5  5  o 332.0342 3.415241 345.1404  324.0 63.71539       6.830482 0.93 
1 1 1 23  5  6  o 255.4863 2.811508 402.9485  132.0 -27.39246      5.623016 0.93 
1 1 1 23  5  7  o 253.1106 2.822557 289.8578  194.5 -50.75365      5.645113 0.91 
1 1 1 23  5  8  o 209.1092 2.845399 295.2450  284.8 55.50566       5.690798 0.90 
1 1 1 23  5  9  o 284.7094 4.143171 440.4572  202.3 41.18671       8.286342 0.97 
1 1 1 23  5  10 o 76.18791 3.844581 107.0756  281.5 20.76099       7.689162 0.55 
1 1 1 23  5  11 o 319.4925 3.357277 308.1683  50.8  -9.034271      6.714553 0.97 
1 1 1 23  5  12 o 254.4354 2.756448 387.6900  324.3 48.79419       5.512896 0.98 
1 1 1 23  5  13 o 321.9235 3.873728 407.1947  347.4 11.56329       7.747455 0.99 
1 1 1 23  5  14 o 57.33901 7.101377 19.62548  177.7 -46.62858      14.20275 0.20 
1 1 1 23  5  15 o 247.1685 3.459396 281.2137  137.8 -12.10147      6.918792 0.98 
1 1 1 23  5  16 o 137.6646 3.964024 298.0817  99.9  -20.99937      7.928047 0.97 
1 1 1 23  5  17 o 45.95704 8.907222 37.35890  358.0 19.42496       17.81444 0.37 
1 1 1 23  5  18 o 208.2925 3.607553 305.6995  210.0 -7.254166      7.215106 0.99 
1 1 1 23  5  19 o 151.5922 4.137057 142.5551  14.7  -24.57224      8.274114 0.97 
1 1 1 23  5  20 f 38.88559 10.51249 129.2472  267.4 0.1576767      21.02498 0.00 
1 1 1 23  5  21 o 129.3146 5.501622 152.2212  189.3 0.6621399      11.00324 0.95 
1 1 1 23  5  22 o 61.11104 10.12029 49.57387  212.9 -20.43228      20.24059 0.64 
1 1 1 23  5  23 o 44.74746 10.84833 66.42789  294.4 -33.01440      21.69666 0.69 
1 1 1 23  5  24 o 105.6646 7.506589 153.5879  184.5 -21.76929      15.01318 0.96 
1 1 1 23  5  25 o 68.72682 11.15748 82.41909  225.7 11.75524       22.31495 0.91 
1 1 1 23  5  26 o 113.9928 7.274048 133.1151  32.3  17.17032       14.54810 0.97 
1 1 1 23  5  27 o 102.3074 8.392262 139.3860  101.6 9.700722       16.78452 0.97 
1 1 1 23  5  28 x ?        ?        29.34030  226.4 ?              ?        0.00 
1 1 1 23  7  0  o 145.2239 3.070616 196.7607  214.5 54.15421       6.141232 0.75 
1 1 1 23  7  1  o 268.2689 3.160380 276.0644  275.3 -40.82916      6.320759 0.90 
1 1 1 23  7  2  o 311.5831 3.237923 315.5049  139.1 19.08151       6.475846 0.94 
1 1 1 23  7  3  o 227.5413 3.077794 305.3782  229.3 65.78030       6.155588 0.93 
1 1 1 23  7  4  o 241.6122 3.167669 347.0824  56.2  -61.58470      6.335338 0.94 
1 1 1 23  7  5  o 463.3198 4.877288 652.5431  73.0  12.37048       9.754577 0.99 
1 1 1 23  7  6  o 491.8791 4.117391 652.1966  84.5  22.77039       8.234782 0.99 
1 1 1 23  7  7  f 253.9203 2.804646 266.1974  33.0  3.805374       5.609292 0.00 
1 1 1 23  7  8  o 508.9937 6.290835 696.6752  324.8 ?              ?        0.99 
1 1 1 23  7  9  o 127.9064 4.213394 242.9296  181.4 -11.83283      8.426788 0.94 
1 1 1 23  7  10 o 133.9339 3.519936 206.7952  189.7 23.24805       7.039872 0.94 
1 1 1 23  7  11 o 110.1465 4.216605 163.9157  309.1 -49.99393      8.433209 0.91 
1 1 1 23  7  12 o 71.48079 5.585676 124.6632  67.2  36.21803       11.17135 0.78 
1 1 1 23  7  13 o 338.7433 3.641017 472.4670  113.2 40.28040       7.282033 0.99 
1 1 1 23  7  14 f 218.2086 3.840851 326.4623  26.0  -18.16171      7.681701 0.00 
1 1 1 23  7  15 o 160.8950 4.645672 227.9861  349.4 -8.094681      9.291345 0.97 
1 1 1 23  7  16 o 96.79129 6.382246 96.02164  282.9 -38.92883      12.76449 0.89 
1 1 1 23  7  17 o 111.9737 6.433691 157.6436  0.6   -8.670265      12.86738 0.96 
1 1 1 23  7  18 o 41.02032 9.673416 48.92432  10.7  21.88477       19.34683 0.57 
1 1 1 23  7  19 o 116.4275 5.464148 136.3527  296.9 18.31085       10.92830 0.94 
1 1 1 23  7  20 o 104.1387 6.128097 127.4974  187.2 4.717972       12.25619 0.93 
1 1 1 23  7  21 o 187.2936 4.821488 237.4176  154.3 10.58144       9.642976 0.98 
1 1 1 23  7  22 o 40.42444 11.04572 84.64017  178.0 -27.91788      22.09143 0.78 
1 1 1 23  7  23 o 67.42999 10.41544 47.40381  196.2 26.39044       20.83088 0.82 
1 1 1 23  7  24 o 94.34624 9.523117 150.6707  174.1 20.25298       19.04623 0.97 
1 1 1 23  7  25 o 56.10553 11.95639 110.8489  72.4  -40.33465      23.91278 0.92 
1 1 1 23  7  26 o 47.92889 12.74955 47.23724  163.2 ?              ?        0.77 
1 1 1 23  9  0  o 192.4131 3.613142 385.1818  310.4 23.33803       7.226283 0.96 
1 1 1 23  9  1  o 123.9071 3.096343 230.1750  24.9  -1.076752      6.192687 0.91 
1 1 1 23  9  2  o 275.0426 3.265757 367.5233  302.9 -36.53741      6.531514 0.98 
1 1 1 23  9  3  o 314.2400 3.777889 442.7198  248.8 -13.66281      7.555779 0.99 
1 1 1 23  9  4  o 191.0126 2.972827 261.5673  247.9 15.19556       5.945654 0.97 
1 1 1 23  9  5  o 212.5112 2.965644 488.3181  141.1 39.25494       5.931289 0.98 
1 1 1 23  9  6  o 124.5375 4.034572 287.5842  82.7  30.23460       8.069144 0.95 
1 1 1 23  9  7  o 321.3782 3.907366 486.9972  289.1 -4.304993      7.814731 0.99 
1 1 1 23  9  8  o 98.57994 4.698927 199.7303  259.2 25.80170       9.397854 0.93 
1 1 1 23  9  9  f 125.8076 3.581059 129.2651  243.1 6.508545       7.162118 0.00 
1 1 1 23  9  10 o 78.14497 8.327183 76.84385  213.2 5.677834       16.65437 0.78 
1 1 1 23  9  11 o 56.73336 9.559910 80.79619  152.1 27.69651       19.11982 0.73 
1 1 1 23  9  12 o 194.0815 3.567968 293.1588  173.5 49.00294       7.135935 0.98 
1 1 1 23  9  13 o 50.98917 8.144860 129.5066  35.4  -22.91321      16.28972 0.85 
1 1 1 23  9  14 o 163.7117 3.444027 233.4471  10.0  5.212723       6.888054 0.98 
1 1 1 23  9  15 o 187.0608 4.508630 274.5141  163.2 -9.997665      9.017261 0.99 
1 1 1 23  9  16 o 235.0603 4.283935 369.3568  147.5 -3.656738      8.567869 0.99 
1 1 1 23  9  17 o 89.67326 9.420717 125.6312  54.8  6.624458       18.84143 0.92 
1 1 1 23  9  18 o 151.8209 5.663435 183.4085  137.4 8.412506       11.32687 0.97 
1 1 1 23  9  19 o 145.0916 6.437454 214.6551  179.1 -17.95174      12.87491 0.98 
1 1 1 23  9  20 o 57.44138 9.650982 103.4306  248.9 44.90628       19.30196 0.90 
1 1 1 23  9  21 o 113.9605 7.021592 133.9099  206.1 18.90207       14.04318 0.97 
1 1 1 23  9  22 o 62.94537 13.04087 53.01470  214.9 17.62201       26.08174 0.84 
1 1 1 23  9  23 o 91.28455 11.54127 107.4368  17.9  0.2385483      23.08253 0.95 
1 1 1 23  9  24 o 43.50911 12.37163 60.49853  344.0 ?              ?        0.82 
1 1 1 23  11 0  o 130.4082 3.053010 241.5510  26.3  -12.08276      6.106020 0.96 
1 1 1 23  11 1  o 103.3243 3.693747 148.8016  42.5  -48.36030      7.387494 0.92 
1 1 1 23  11 2  o 144.4982 3.635639 170.8585  221.5 35.46819       7.271277 0.95 
1 1 1 23  11 3  o 200.6137 3.011495 314.9460  264.7 -10.83913      6.022991 0.98 
1 1 1 23  11 4  o 259.5196 3.689933 353.8236  293.9 37.91533       7.379865 0.99 
1 1 1 23  11 5  o 36.56454 9.881454 93.26588  177.9 -12.50407      19.76291 0.65 
1 1 1 23  11 6  o 207.7171 5.608729 281.9590  223.2 22.33844       11.21746 0.98 
1 1 1 23  11 7  o 41.90016 10.69328 108.7199  342.8 -21.10952      21.38657 0.76 
1 1 1 23  11 8  o 150.8335 5.212979 210.5018  146.4 -46.77435      10.42596 0.97 
1 1 1 23  11 9  o 143.6661 3.597958 250.3758  186.8 -27.30255      7.195915 0.98 
1 1 1 23  11 10 o 159.2518 5.263183 218.8895  304.3 -10.31233      10.52637 0.98 
1 1 1 23  11 11 o 121.2805 6.195831 215.9892  205.6 -15.42463      12.39166 0.98 
1 1 1 23  11 12 o 195.4490 4.917417 272.4731  188.9 -32.20381      9.834833 0.99 
1 1 1 23  11 13 o 135.7934 5.070624 196.6628  182.9 -24.00807      10.14125 0.97 
1 1 1 23  11 14 o 72.07822 8.148462 125.9673  136.4 -3.544304      16.29692 0.91 
1 1 1 23  11 15 o 108.9701 8.380933 237.4386  255.8 -10.16504      16.76187 0.97 
1 1 1 23  11 16 o 157.6688 5.541972 263.7323  347.1 3.622086       11.08394 0.99 
1 1 1 23  11 17 o 62.17728 12.47973 129.4115  127.9 6.890003       24.95947 0.93 
1 1 1 23  11 18 o 47.61385 12.65794 64.33849  120.6 4.021351       25.31589 0.81 
1 1 1 23  11 19 o 64.65097 14.06561 122.6215  216.4 -7.524208      28.13122 0.94 
1 1 1 23  11 20 o 95.90781 10.15823 161.7951  189.6 -20.62914      20.31646 0.97 
1 1 1 23  11 21 f 47.94919 13.51711 47.30970  133.1 -18.38590      27.03422 0.00 
1 1 1 23  11 22 o 34.25370 11.50362 26.64329  78.2  ?              ?        0.52 
1 1 1 23  13 0  o 65.51833 6.671659 134.4289  94.3  -1.201599      13.34332 0.93 
1 1 1 23  13 1  o 74.86095 5.644168 114.1151  185.0 14.79812       11.28834 0.93 
1 1 1 23  13 2  o 51.27230 7.672248 100.9035  231.5 16.73461       15.34450 0.89 
1 1 1 23  13 3  o 78.51352 6.293351 150.0152  349.1 -3.809448      12.58670 0.95 
1 1 1 23  13 4  o 45.54977 9.658943 166.5735  198.0 -16.01625      19.31789 0.91 
1 1 1 23  13 5  o 82.46645 6.366982 178.3159  178.1 3.389458       12.73396 0.96 
1 1 1 23  13 6  o 244.7035 3.845111 302.8126  138.3 21.03194       7.690222 0.99 
1 1 1 23  13 7  o 54.04382 9.440957 104.5114  75.4  7.967728       18.88191 0.84 
1 1 1 23  13 8  o 48.72271 13.31589 106.1066  265.4 ?              ?        0.81 
1 1 1 23  13 9  o 164.3139 7.159925 280.6615  193.6 7.679199       14.31985 0.98 
1 1 1 23  13 10 o 99.06587 10.13017 109.6333  167.2 26.50075       20.26033 0.93 
1 1 1 23  13 11 o 56.65201 12.08627 122.5766  46.2  6.534534       24.17255 0.90 
1 1 1 23  13 12 o 160.1708 5.726603 219.2912  11.8  -18.31084      11.45321 0.99 
1 1 1 23  13 13 o 112.3803 8.623856 117.3768  28.5  -14.06716      17.24771 0.97 
1 1 1 23  13 14 f 38.85331 11.89028 53.05467  95.7  -16.62684      23.78057 0.00 
1 1 1 23  13 15 o 123.2471 8.523017 204.0386  224.0 6.112106       17.04603 0.99 
1 1 1 23  13 16 o 134.5388 7.655826 201.6279  120.9 -39.13560      15.31165 0.99 
1 1 1 23  13 17 o 95.78024 12.19819 160.8283  148.0 -2.838036      24.39637 0.97 
1 1 1 23  13 18 o 38.78671 12.64312 78.04494  148.3 ?              ?        0.85 
1 1 1 23  15 0  o 223.8610 3.634063 380.3277  32.2  -13.58534      7.268127 0.99 
1 1 1 23  15 1  o 49.28268 9.701851 56.08435  297.1 22.40337       19.40370 0.76 
1 1 1 23  15 2  o 150.1836 4.389401 250.0672  204.2 -17.81142      8.778803 0.99 
1 1 1 23  15 3  o 57.14219 11.04214 92.19485  143.2 -19.94453      22.08429 0.89 
1 1 1 23  15 4  f 91.75569 8.813428 138.2810  54.2  34.14653       17.62686 0.00 
1 1 1 23  15 5  o 77.34087 8.056079 143.7888  295.3 2.288063       16.11216 0.96 
1 1 1 23  15 6  o 89.11169 7.444322 92.97124  311.4 17.16911       14.88864 0.95 
1 1 1 23  15 7  o 26.79208 8.871838 44.58238  145.0 1.126822       17.74368 0.61 
1 1 1 23  15 8  o 103.8743 6.130831 188.0993  227.4 -15.09549      12.26166 0.98 
1 1 1 23  15 9  o 98.77306 6.048506 137.3980  291.8 -30.13406      12.09701 0.98 
1 1 1 23  15 10 o 127.4022 11.35017 227.0388  350.9 46.03279       22.70035 0.99 
1 1 1 23  15 11 o 36.77258 10.62608 8.943149  284.2 7.188805       21.25216 0.21 
1 1 1 23  15 12 o 37.99345 9.924541 84.48730  126.2 -2.859997      19.84908 0.88 
1 1 1 23  15 13 o 26.85899 8.384294 71.35389  141.5 ?              ?        0.82 
1 1 1 23  15 14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 23  17 0  o 61.62096 11.12998 124.7105  220.8 8.297977       22.25997 0.95 
1 1 1 23  17 1  o 38.38978 10.37377 43.45182  182.1 -10.83240      20.74755 0.75 
1 1 1 23  17 2  o 34.80437 10.84027 51.61050  52.3  8.635925       21.68053 0.77 
1 1 1 23  17 3  o 34.66454 11.14417 60.85351  334.1 ?              ?        0.81 
1 1 1 23  17 4  o 35.15216 11.17503 44.19691  310.5 ?              ?        0.73 
1 1 1 23  17 5  o 30.41959 10.07419 35.76725  245.4 ?              ?        0.65 
1 1 1 24  0  0  o 783.4030 8.721977 869.1110  0.0   0.000000       0.000000 1.00 
1 1 1 24  0  1  o 297.6643 4.304842 563.0338  0.0   0.000000       0.000000 1.00 
1 1 1 24  0  2  o 641.2080 7.492832 810.9620  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  3  o 159.7788 3.231641 194.8415  0.0   0.000000       0.000000 0.58 
1 1 1 24  0  4  o 63.90906 5.650806 338.6607  0.0   0.000000       0.000000 0.67 
1 1 1 24  0  5  o 555.8340 7.668206 404.9646  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  6  o 564.5715 5.877785 512.1328  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  7  o 170.1208 3.349007 145.0311  0.0   0.000000       0.000000 0.37 
1 1 1 24  0  8  o 679.0656 9.382211 871.1539  0.0   0.000000       0.000000 1.00 
1 1 1 24  0  9  o 679.5184 7.200938 771.6727  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  10 o 66.23676 6.563065 173.4894  0.0   0.000000       0.000000 0.44 
1 1 1 24  0  11 o 163.3891 3.378320 340.2428  180.0 0.000000       0.000000 0.99 
1 1 1 24  0  12 o 277.5655 4.135788 165.0574  0.0   0.000000       0.000000 1.00 
1 1 1 24  0  13 o 68.41824 6.206188 35.30705  0.0   0.000000       0.000000 0.30 
1 1 1 24  0  14 o 36.57169 13.45621 52.50779  180.0 0.000000       0.000000 0.15 
1 1 1 24  0  15 o 14.82863 10.01585 5.547484  180.0 0.000000       0.000000 0.01 
1 1 1 24  0  16 o 26.60073 13.91186 183.4251  180.0 0.000000       0.000000 0.57 
1 1 1 24  0  17 o 113.5918 4.083211 152.0484  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  18 o 111.7889 5.357096 117.3125  180.0 0.000000       0.000000 0.99 
1 1 1 24  0  19 o 73.56061 7.517088 127.0267  0.0   0.000000       0.000000 0.98 
1 1 1 24  0  20 o 18.66495 12.32210 33.48957  180.0 0.000000       0.000000 0.17 
1 1 1 24  0  21 o 111.3114 5.867574 144.1399  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  22 o 144.4531 6.680519 137.8035  0.0   0.000000       0.000000 1.00 
1 1 1 24  0  23 o 168.3041 4.605348 220.4581  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  24 o 62.59562 13.44415 107.1961  180.0 0.000000       0.000000 0.97 
1 1 1 24  0  25 o 55.52071 17.84930 127.4837  180.0 0.000000       0.000000 0.99 
1 1 1 24  0  26 o 82.14608 9.759484 95.98091  180.0 0.000000       0.000000 1.00 
1 1 1 24  0  27 o 33.76535 17.10118 44.81239  180.0 0.000000       0.000000 0.63 
1 1 1 24  0  28 o 69.21349 11.68726 63.53823  180.0 0.000000       0.000000 0.99 
1 1 1 24  0  29 x ?        ?        37.42538  180.0 ?              ?        0.00 
1 1 1 24  2  0  o 354.3629 3.413734 436.0428  258.9 58.72958       6.827468 0.96 
1 1 1 24  2  1  o 379.0423 3.421607 661.7391  299.4 -40.07013      6.843214 0.97 
1 1 1 24  2  2  o 515.9614 4.086864 731.1311  190.2 78.06412       8.173727 0.98 
1 1 1 24  2  3  f 407.8436 3.462672 523.5244  228.3 6.797577       6.925345 0.00 
1 1 1 24  2  4  o 339.4353 3.013844 306.8938  13.4  -44.61993      6.027687 0.91 
1 1 1 24  2  5  o 962.3657 7.389962 1429.912  65.9  19.46277       14.77992 0.99 
1 1 1 24  2  6  o 697.2445 4.800739 868.5363  78.7  -69.14709      9.601478 0.99 
1 1 1 24  2  7  o 904.4486 6.278158 1163.387  230.3 26.90863       12.55632 0.99 
1 1 1 24  2  8  o 195.5965 2.605417 118.9369  357.2 -48.92697      5.210835 0.75 
1 1 1 24  2  9  o 328.8506 2.974788 396.1151  114.0 8.210541       5.949576 0.95 
1 1 1 24  2  10 o 225.6806 2.872055 251.1467  118.8 -17.21106      5.744110 0.90 
1 1 1 24  2  11 o 182.5380 2.577351 219.7785  136.5 26.91429       5.154702 0.88 
1 1 1 24  2  12 o 160.3155 2.577510 311.6531  142.0 -19.57797      5.155019 0.93 
1 1 1 24  2  13 o 159.6985 2.658390 153.8669  152.6 12.07129       5.316779 0.90 
1 1 1 24  2  14 o 115.1491 3.004088 270.3804  66.8  5.534698       6.008175 0.94 
1 1 1 24  2  15 o 234.3217 3.015186 337.6982  309.4 -30.22908      6.030371 0.98 
1 1 1 24  2  16 o 118.8450 3.219428 161.1103  256.4 -21.30321      6.438856 0.91 
1 1 1 24  2  17 o 95.70680 4.573571 140.4469  215.1 6.945320       9.147141 0.89 
1 1 1 24  2  18 o 203.3681 3.092726 302.6621  135.4 0.3057861E-01  6.185451 0.98 
1 1 1 24  2  19 o 196.3829 3.088164 236.8101  337.1 16.89325       6.176328 0.98 
1 1 1 24  2  20 o 303.5226 4.105641 401.0961  320.7 -33.00464      8.211282 0.99 
1 1 1 24  2  21 o 76.72498 7.236271 175.5398  232.7 -20.29362      14.47254 0.94 
1 1 1 24  2  22 o 42.53528 9.337747 45.44469  305.8 -35.12198      18.67549 0.43 
1 1 1 24  2  23 o 106.2334 6.140905 84.90398  314.9 8.612267       12.28181 0.89 
1 1 1 24  2  24 o 122.4916 5.798788 152.5023  158.3 15.54259       11.59758 0.96 
1 1 1 24  2  25 o 65.17182 10.19795 72.21997  266.6 4.835934       20.39590 0.86 
1 1 1 24  2  26 o 60.00554 11.87483 52.31599  269.3 -8.847828      23.74966 0.82 
1 1 1 24  2  27 o 74.66045 12.38079 104.8196  286.7 -18.87407      24.76159 0.93 
1 1 1 24  2  28 o 55.18807 12.83089 33.78736  22.2  -2.670471      25.66178 0.69 
1 1 1 24  4  0  o 685.8149 5.332939 809.5923  61.2  13.49780       10.66588 0.99 
1 1 1 24  4  1  o 552.8245 4.912875 415.2099  67.6  -22.81775      9.825750 0.97 
1 1 1 24  4  2  o 539.1579 4.385931 657.9946  55.4  -14.52075      8.771862 0.98 
1 1 1 24  4  3  o 668.0468 5.628510 888.5196  205.9 -66.66730      11.25702 0.99 
1 1 1 24  4  4  o 660.1879 4.990111 853.9616  230.6 35.60614       9.980223 0.99 
1 1 1 24  4  5  o 141.3315 2.674313 189.4651  38.8  34.02907       5.348626 0.65 
1 1 1 24  4  6  o 156.9313 2.922272 183.6937  336.8 37.74184       5.844543 0.77 
1 1 1 24  4  7  o 725.9320 5.995609 821.9067  189.5 -77.61688      11.99122 0.99 
1 1 1 24  4  8  o 36.98494 6.265762 104.0653  233.1 28.18684       12.53152 0.17 
1 1 1 24  4  9  o 305.0852 2.953408 319.0925  145.8 -24.34036      5.906816 0.95 
1 1 1 24  4  10 o 180.4715 2.403768 292.6534  248.3 -10.01982      4.807536 0.92 
1 1 1 24  4  11 o 210.2660 2.393088 352.3849  176.6 -22.21498      4.786176 0.96 
1 1 1 24  4  12 o 264.1511 3.262223 376.4687  152.5 -13.40118      6.524446 0.98 
1 1 1 24  4  13 o 169.5767 2.761813 204.5002  332.5 10.82153       5.523627 0.95 
1 1 1 24  4  14 o 114.9315 3.825190 151.1762  245.0 3.395393       7.650380 0.89 
1 1 1 24  4  15 o 214.3850 4.235974 291.6230  14.3  -9.288040      8.471949 0.97 
1 1 1 24  4  16 o 239.1912 3.421261 321.8086  102.3 25.66460       6.842521 0.98 
1 1 1 24  4  17 o 123.7949 4.030982 170.6962  163.5 -10.80893      8.061965 0.95 
1 1 1 24  4  18 o 137.8057 4.071753 143.9383  157.4 -6.837296      8.143505 0.95 
1 1 1 24  4  19 o 167.9344 3.779553 191.4395  29.5  24.75691       7.559106 0.97 
1 1 1 24  4  20 o 133.2547 4.614751 169.6221  34.6  -29.15954      9.229503 0.97 
1 1 1 24  4  21 o 120.2079 5.582495 229.5424  36.3  0.2145920      11.16499 0.97 
1 1 1 24  4  22 o 105.6809 6.354159 143.9244  26.1  -2.051842      12.70832 0.94 
1 1 1 24  4  23 o 102.8217 6.629976 127.1325  297.7 11.87021       13.25995 0.94 
1 1 1 24  4  24 f 111.3684 7.036595 171.8247  221.0 26.09714       14.07319 0.00 
1 1 1 24  4  25 o 50.92323 10.42093 68.68646  250.1 20.71742       20.84185 0.84 
1 1 1 24  4  26 o 54.14688 12.15593 90.42477  343.5 -7.897457      24.31187 0.89 
1 1 1 24  4  27 o 41.98608 11.47873 73.60919  99.1  10.61129       22.95747 0.83 
1 1 1 24  4  28 o 62.29628 12.22928 76.62769  135.9 ?              ?        0.91 
1 1 1 24  6  0  o 593.0948 4.942301 869.2900  141.3 30.93481       9.884603 0.99 
1 1 1 24  6  1  o 320.5977 3.344750 349.6444  73.9  -13.75470      6.689500 0.95 
1 1 1 24  6  2  o 205.4396 2.844605 371.6643  223.8 15.64316       5.689210 0.91 
1 1 1 24  6  3  o 94.65115 3.873446 268.6310  222.1 52.31340       7.746892 0.71 
1 1 1 24  6  4  o 341.7932 3.645365 424.9612  174.0 32.25861       7.290731 0.96 
1 1 1 24  6  5  o 251.5077 2.968725 452.2024  154.3 -26.45793      5.937450 0.95 
1 1 1 24  6  6  o 303.5615 4.306895 492.0572  123.6 24.91476       8.613791 0.97 
1 1 1 24  6  7  o 322.4502 3.530797 365.4301  78.9  -13.03003      7.061594 0.96 
1 1 1 24  6  8  o 249.4916 3.270143 404.3860  12.3  27.17641       6.540286 0.97 
1 1 1 24  6  9  o 156.9048 2.784794 163.1319  163.1 12.42593       5.569589 0.89 
1 1 1 24  6  10 o 188.5401 3.779434 302.7736  140.5 33.46367       7.558867 0.97 
1 1 1 24  6  11 o 139.2581 3.369239 252.4710  317.2 22.98492       6.738478 0.95 
1 1 1 24  6  12 o 109.4706 3.851356 188.3391  285.8 -4.143723      7.702711 0.91 
1 1 1 24  6  13 o 75.77100 5.506630 41.89757  86.3  6.572510       11.01326 0.45 
1 1 1 24  6  14 o 57.98216 9.432385 198.1556  346.8 19.45713       18.86477 0.87 
1 1 1 24  6  15 o 226.2858 3.478165 335.0405  102.4 -22.53210      6.956329 0.99 
1 1 1 24  6  16 o 116.9408 4.368626 153.8031  85.8  -21.92287      8.737252 0.94 
1 1 1 24  6  17 o 105.5745 5.222805 157.6563  279.7 15.17363       10.44561 0.95 
1 1 1 24  6  18 o 131.9159 4.987244 196.9023  295.9 3.473602       9.974487 0.97 
1 1 1 24  6  19 o 32.67216 9.481440 48.23356  298.9 3.954376       18.96288 0.43 
1 1 1 24  6  20 o 59.23311 10.06420 99.58624  209.1 -15.18473      20.12839 0.81 
1 1 1 24  6  21 o 117.3433 6.168108 203.3164  187.8 -37.73348      12.33622 0.96 
1 1 1 24  6  22 o 139.0689 5.739890 170.1136  253.8 3.383789       11.47978 0.97 
1 1 1 24  6  23 o 42.65117 11.86571 17.04974  13.9  -17.27154      23.73142 0.29 
1 1 1 24  6  24 o 101.5355 7.944250 175.7333  148.2 -4.281731      15.88850 0.98 
1 1 1 24  6  25 o 45.52186 11.86687 56.78020  160.9 -17.04885      23.73373 0.78 
1 1 1 24  6  26 o 47.35949 10.39012 41.97867  199.5 37.78368       20.78025 0.74 
1 1 1 24  6  27 x ?        ?        82.02103  158.0 ?              ?        0.00 
1 1 1 24  8  0  f 534.5059 5.769015 799.9405  337.8 25.94501       11.53803 0.00 
1 1 1 24  8  1  o 167.2309 2.951629 270.3884  284.5 -17.74658      5.903259 0.91 
1 1 1 24  8  2  o 499.9153 4.798073 758.5008  217.1 -27.52762      9.596147 0.99 
1 1 1 24  8  3  o 75.72371 5.385931 152.8374  254.9 74.53573       10.77186 0.72 
1 1 1 24  8  4  o 165.8438 3.411247 256.0863  308.3 18.62126       6.822495 0.94 
1 1 1 24  8  5  o 173.3196 2.858807 348.2796  155.8 -14.50267      5.717614 0.96 
1 1 1 24  8  6  o 187.9961 3.021053 308.1372  120.4 -7.124817      6.042107 0.97 
1 1 1 24  8  7  o 266.5022 3.266295 383.1078  340.1 31.58290       6.532590 0.98 
1 1 1 24  8  8  o 297.3836 4.501569 463.8875  349.7 -36.24066      9.003139 0.99 
1 1 1 24  8  9  o 126.6889 4.262370 282.3242  308.8 28.49110       8.524739 0.95 
1 1 1 24  8  10 o 94.33087 4.523967 85.44831  352.5 12.06144       9.047934 0.77 
1 1 1 24  8  11 o 135.1440 3.560128 192.2164  328.2 -0.8490601     7.120256 0.95 
1 1 1 24  8  12 o 186.7448 3.352122 279.6167  53.7  6.803818       6.704244 0.98 
1 1 1 24  8  13 o 152.7263 3.582895 182.5004  92.9  0.1010284      7.165791 0.96 
1 1 1 24  8  14 o 126.2404 3.949648 149.7773  97.6  26.52103       7.899296 0.95 
1 1 1 24  8  15 o 58.76109 11.36766 69.52794  70.8  -17.65658      22.73532 0.76 
1 1 1 24  8  16 o 39.90374 10.47388 67.33017  60.4  15.08336       20.94776 0.70 
1 1 1 24  8  17 o 61.28966 10.87523 68.93632  112.5 4.746452       21.75046 0.76 
1 1 1 24  8  18 o 39.76811 11.12652 59.67407  228.9 5.305801       22.25305 0.53 
1 1 1 24  8  19 o 203.5915 5.168466 261.7043  282.1 -13.36964      10.33693 0.99 
1 1 1 24  8  20 o 45.37835 12.52220 113.1763  343.8 -7.147530      25.04441 0.84 
1 1 1 24  8  21 o 164.4068 6.245927 247.7630  138.5 33.86047       12.49185 0.99 
1 1 1 24  8  22 o 40.08009 11.75805 66.41323  85.2  -9.333252      23.51609 0.79 
1 1 1 24  8  23 o 59.24139 12.57738 77.59145  1.2   0.8471680E-01  25.15475 0.89 
1 1 1 24  8  24 f 46.51022 12.59985 115.1352  341.7 -15.88467      25.19970 0.00 
1 1 1 24  8  25 o 36.31410 11.57438 50.30239  112.1 ?              ?        0.74 
1 1 1 24  10 0  o 118.9065 3.181916 203.2148  331.4 -27.20544      6.363833 0.93 
1 1 1 24  10 1  o 260.9495 3.233756 495.5808  84.1  -3.796112      6.467513 0.99 
1 1 1 24  10 2  o 137.3665 2.985259 224.6026  84.8  37.89476       5.970518 0.95 
1 1 1 24  10 3  o 163.1093 3.131008 293.5320  265.8 -28.88615      6.262016 0.97 
1 1 1 24  10 4  o 351.5633 3.582958 608.5723  323.6 -7.596252      7.165915 0.99 
1 1 1 24  10 5  o 182.9037 3.080663 286.9563  30.4  -10.33960      6.161325 0.97 
1 1 1 24  10 6  o 208.7119 3.222904 320.3576  359.1 -15.18062      6.445808 0.98 
1 1 1 24  10 7  o 105.0167 5.662262 114.4693  292.8 -41.15382      11.32452 0.91 
1 1 1 24  10 8  o 257.1671 3.812684 421.7421  141.5 19.73137       7.625367 0.99 
1 1 1 24  10 9  o 268.7950 3.870157 466.7607  187.9 -13.46680      7.740313 0.99 
1 1 1 24  10 10 o 47.84704 9.347454 132.9927  254.2 5.228813       18.69491 0.84 
1 1 1 24  10 11 o 182.5330 3.501663 273.9164  48.4  -2.990021      7.003326 0.99 
1 1 1 24  10 12 o 113.2725 4.667038 157.5954  142.1 -3.012260      9.334076 0.97 
1 1 1 24  10 13 o 123.2404 4.592539 123.4404  229.8 7.424881       9.185079 0.96 
1 1 1 24  10 14 f 199.7546 3.784436 236.3346  283.2 0.1914368      7.568871 0.00 
1 1 1 24  10 15 o 156.5342 5.917647 240.1042  193.0 -27.77130      11.83529 0.98 
1 1 1 24  10 16 o 156.4672 4.935256 227.4448  133.1 -5.177460      9.870512 0.98 
1 1 1 24  10 17 o 73.83880 11.19831 145.0869  102.9 -0.8965302     22.39663 0.93 
1 1 1 24  10 18 f 50.57867 12.91017 64.01481  218.8 -27.69256      25.82034 0.00 
1 1 1 24  10 19 o 99.60036 8.950058 120.0757  169.2 -10.50692      17.90012 0.96 
1 1 1 24  10 20 o 160.9641 6.320361 212.5276  84.2  -22.21068      12.64072 0.99 
1 1 1 24  10 21 o 124.6409 8.367132 128.9082  159.4 -30.19676      16.73426 0.97 
1 1 1 24  10 22 o 92.11623 10.95039 130.9892  204.8 -60.74668      21.90079 0.97 
1 1 1 24  10 23 o 37.20309 12.31653 42.68956  104.7 ?              ?        0.70 
1 1 1 24  12 0  o 134.0735 3.380663 186.1149  135.0 6.401108       6.761327 0.97 
1 1 1 24  12 1  o 158.8947 4.512321 188.8914  161.1 5.663010       9.024641 0.97 
1 1 1 24  12 2  o 111.4426 4.087851 161.5031  207.9 12.59103       8.175702 0.95 
1 1 1 24  12 3  o 94.95337 4.805760 175.9186  337.3 -18.64869      9.611521 0.95 
1 1 1 24  12 4  o 142.5665 3.481988 201.3795  166.7 12.43166       6.963976 0.97 
1 1 1 24  12 5  o 160.6377 4.680310 288.6425  126.3 -18.80208      9.360620 0.99 
1 1 1 24  12 6  o 113.6943 5.189232 228.2295  172.5 22.28733       10.37846 0.98 
1 1 1 24  12 7  o 159.5679 4.017565 263.5880  272.2 26.98715       8.035130 0.99 
1 1 1 24  12 8  o 132.8614 4.123613 252.2693  267.9 5.782562       8.247226 0.98 
1 1 1 24  12 9  o 112.5261 6.312931 145.4704  167.0 -32.22971      12.62586 0.95 
1 1 1 24  12 10 o 53.67519 8.794335 31.95499  352.9 33.23462       17.58867 0.46 
1 1 1 24  12 11 o 161.7714 4.540030 244.5670  127.8 -0.7535248     9.080059 0.98 
1 1 1 24  12 12 o 156.4849 4.598723 232.5591  162.2 12.33208       9.197446 0.98 
1 1 1 24  12 13 o 97.39929 6.744652 133.0187  211.8 3.148148       13.48930 0.95 
1 1 1 24  12 14 o 71.29936 7.250681 93.38255  346.1 -0.6199341     14.50136 0.92 
1 1 1 24  12 15 o 89.38844 6.046419 134.1151  325.7 26.12106       12.09284 0.96 
1 1 1 24  12 16 o 60.65795 13.15261 110.6981  23.0  -25.11835      26.30522 0.93 
1 1 1 24  12 17 o 50.60318 13.34185 77.55871  173.6 -1.367702      26.68370 0.87 
1 1 1 24  12 18 f 125.7221 9.509761 186.4283  150.3 24.53838       19.01952 0.00 
1 1 1 24  12 19 o 77.55986 13.06720 135.1188  199.1 27.91489       26.13440 0.96 
1 1 1 24  12 20 o 45.52019 12.81175 70.12916  249.2 ?              ?        0.87 
1 1 1 24  14 0  o 54.57164 8.672443 119.8268  232.6 -18.79205      17.34489 0.88 
1 1 1 24  14 1  o 29.60185 8.628305 41.62955  154.4 19.43098       17.25661 0.39 
1 1 1 24  14 2  o 157.0511 3.762748 254.6631  285.9 -10.57367      7.525495 0.98 
1 1 1 24  14 3  o 180.4287 3.624331 375.7794  287.3 8.365585       7.248661 0.99 
1 1 1 24  14 4  o 45.49225 12.34479 79.10818  305.8 -0.8287582     24.68958 0.75 
1 1 1 24  14 5  o 55.10350 10.10760 33.26272  173.0 13.48721       20.21520 0.56 
1 1 1 24  14 6  o 87.25478 7.928460 155.6657  62.0  38.30236       15.85692 0.96 
1 1 1 24  14 7  o 89.70064 6.465340 138.8936  72.0  21.19938       12.93068 0.96 
1 1 1 24  14 8  o 43.12559 10.47820 64.76720  152.5 -1.470577      20.95640 0.78 
1 1 1 24  14 9  o 53.68581 9.393071 80.01873  180.3 22.79749       18.78614 0.88 
1 1 1 24  14 10 o 78.07172 6.919509 136.0042  41.8  15.68632       13.83902 0.96 
1 1 1 24  14 11 f 52.54984 8.633599 134.6841  129.1 32.59604       17.26720 0.00 
1 1 1 24  14 12 o 32.17578 13.43164 15.05341  267.4 ?              ?        0.26 
1 1 1 24  14 13 o 67.78986 13.30764 119.0034  255.9 -7.027695      26.61529 0.94 
1 1 1 24  14 14 o 61.74860 14.95848 30.25142  311.2 -29.01691      29.91696 0.68 
1 1 1 24  14 15 o 49.73254 12.53359 105.1733  345.2 ?              ?        0.92 
1 1 1 24  14 16 x ?        ?        19.64205  66.2  ?              ?        0.00 
1 1 1 24  16 0  o 70.66916 8.395123 145.5701  188.4 -7.344055      16.79025 0.97 
1 1 1 24  16 1  o 153.4859 4.990106 279.3559  205.3 -4.892059      9.980211 0.99 
1 1 1 24  16 2  o 34.20053 9.754662 88.20547  236.9 -11.73972      19.50932 0.87 
1 1 1 24  16 3  o 46.75465 10.62269 110.4808  6.3   -8.567055      21.24538 0.92 
1 1 1 24  16 4  o 50.21881 11.18342 41.67795  347.5 -27.91161      22.36685 0.78 
1 1 1 24  16 5  o 43.48652 11.38154 40.60146  88.5  2.271744       22.76307 0.73 
1 1 1 24  16 6  o 41.96448 12.85410 77.83823  87.9  -0.9499474     25.70820 0.86 
1 1 1 24  16 7  o 36.19939 10.67828 82.81301  171.6 -4.565983      21.35655 0.87 
1 1 1 24  16 8  o 34.14557 10.37522 39.55820  122.6 6.677580       20.75044 0.69 
1 1 1 24  16 9  o 44.39967 10.87833 86.49277  82.7  ?              ?        0.91 
1 1 1 24  16 10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 25  1  0  o 693.8683 6.169830 1071.475  338.7 -37.21973      12.33966 0.99 
1 1 1 25  1  1  o 645.6271 5.294370 902.8091  303.5 7.204346       10.58874 0.99 
1 1 1 25  1  2  o 424.6140 4.260612 235.4190  268.2 31.38171       8.521225 0.94 
1 1 1 25  1  3  o 906.2296 6.262571 1072.940  349.8 -13.31750      12.52514 0.99 
1 1 1 25  1  4  o 496.8594 4.054568 796.7784  329.7 45.64917       8.109137 0.98 
1 1 1 25  1  5  o 218.7784 2.214082 600.5606  42.1  -9.634125      4.428164 0.94 
1 1 1 25  1  6  o 61.40829 3.587394 164.7991  121.4 5.357269       7.174787 0.32 
1 1 1 25  1  7  o 362.9825 2.823511 522.9730  110.8 17.50656       5.647022 0.97 
1 1 1 25  1  8  o 664.7377 5.506735 854.5339  10.6  -7.884521      11.01347 0.99 
1 1 1 25  1  9  o 332.7820 3.283102 484.0219  170.0 65.93903       6.566204 0.96 
1 1 1 25  1  10 o 96.62578 3.961455 102.2882  318.0 -43.90618      7.922910 0.43 
1 1 1 25  1  11 f 130.7820 2.610388 28.46280  123.8 -25.76549      5.220775 0.00 
1 1 1 25  1  12 o 129.8763 2.868957 268.2484  129.0 -48.17250      5.737915 0.89 
1 1 1 25  1  13 o 266.4075 3.009452 356.8372  62.4  10.41415       6.018904 0.97 
1 1 1 25  1  14 o 411.6337 3.891714 555.8817  54.5  -44.59924      7.783427 0.99 
1 1 1 25  1  15 o 233.7948 2.970550 302.5152  79.6  17.26532       5.941101 0.97 
1 1 1 25  1  16 o 83.98714 4.120698 96.46492  143.3 -3.071167      8.241397 0.77 
1 1 1 25  1  17 o 105.7900 3.920866 126.1065  337.9 -9.205048      7.841733 0.90 
1 1 1 25  1  18 o 175.3938 3.147205 237.4486  131.0 9.517090       6.294410 0.97 
1 1 1 25  1  19 o 87.76114 4.428493 132.1895  81.7  -26.44756      8.856986 0.91 
1 1 1 25  1  20 o 80.29916 6.640098 75.47352  210.7 3.272797       13.28020 0.86 
1 1 1 25  1  21 o 137.7711 3.687031 189.9873  58.7  -5.566620      7.374062 0.97 
1 1 1 25  1  22 f 98.71626 5.094999 161.4775  23.8  -16.66495      10.19000 0.00 
1 1 1 25  1  23 o 67.32666 7.577139 128.0701  153.6 27.77341       15.15428 0.89 
1 1 1 25  1  24 o 66.51681 7.712238 114.3729  226.4 20.05740       15.42448 0.90 
1 1 1 25  1  25 o 111.7818 6.137527 144.1710  296.4 -6.582146      12.27505 0.97 
1 1 1 25  1  26 o 79.82734 6.364449 125.4810  46.5  -24.89719      12.72890 0.96 
1 1 1 25  1  27 o 34.04761 9.973653 61.44882  319.7 -6.613503      19.94731 0.73 
1 1 1 25  1  28 o 33.66212 9.879030 10.09540  349.3 ?              ?        0.20 
1 1 1 25  3  0  o 345.5546 3.294476 544.7717  183.2 75.11902       6.588952 0.96 
1 1 1 25  3  1  o 181.6589 2.559215 116.6625  264.5 20.70497       5.118430 0.61 
1 1 1 25  3  2  o 224.0045 2.603929 414.1678  40.4  -36.79340      5.207858 0.88 
1 1 1 25  3  3  o 465.2366 3.687380 717.6964  195.0 -20.60086      7.374760 0.98 
1 1 1 25  3  4  o 163.7267 2.705794 385.0367  270.0 12.34056       5.411587 0.84 
1 1 1 25  3  5  o 283.0836 3.311001 363.6958  21.8  -21.72299      6.622003 0.93 
1 1 1 25  3  6  o 760.2524 5.651270 1121.767  98.0  -54.75745      11.30254 0.99 
1 1 1 25  3  7  o 196.7287 2.651731 199.6576  147.7 -18.94635      5.303461 0.81 
1 1 1 25  3  8  o 444.3037 3.609201 588.1456  313.5 41.97205       7.218402 0.98 
1 1 1 25  3  9  o 238.0067 2.495424 292.2257  173.8 -27.40112      4.990848 0.91 
1 1 1 25  3  10 o 216.4062 2.596464 290.0432  77.7  -1.954956      5.192928 0.93 
1 1 1 25  3  11 o 153.6045 2.623219 203.7572  179.4 4.698441       5.246439 0.90 
1 1 1 25  3  12 o 284.6133 3.051143 330.5587  132.9 -5.669769      6.102285 0.97 
1 1 1 25  3  13 o 111.6818 3.277589 203.9011  209.9 -13.37236      6.555178 0.92 
1 1 1 25  3  14 o 148.5334 2.894408 163.5303  136.5 -9.368362      5.788816 0.92 
1 1 1 25  3  15 o 306.1730 3.368435 442.7372  335.2 15.42911       6.736871 0.99 
1 1 1 25  3  16 o 26.88794 7.268882 60.44966  350.0 -17.61776      14.53776 0.27 
1 1 1 25  3  17 o 60.72941 6.339458 49.62193  351.7 19.98252       12.67892 0.55 
1 1 1 25  3  18 o 77.85621 5.349534 34.84551  345.9 33.34006       10.69907 0.55 
1 1 1 25  3  19 o 166.5962 4.012905 261.4196  231.4 -6.030579      8.025810 0.98 
1 1 1 25  3  20 o 159.6820 4.373558 238.5346  270.5 10.37479       8.747115 0.98 
1 1 1 25  3  21 o 195.9586 4.375663 264.2439  293.8 -1.403488      8.751327 0.98 
1 1 1 25  3  22 o 48.97355 10.40439 15.24037  282.7 -17.08902      20.80878 0.19 
1 1 1 25  3  23 o 122.8917 5.538175 157.2139  150.6 -3.426773      11.07635 0.96 
1 1 1 25  3  24 o 224.8905 4.615028 279.9302  191.8 4.544907       9.230056 0.99 
1 1 1 25  3  25 o 48.26005 11.32343 40.86411  168.2 6.221546       22.64687 0.68 
1 1 1 25  3  26 o 66.36397 10.75838 85.91972  0.9   -25.49067      21.51675 0.91 
1 1 1 25  3  27 o 40.18021 11.23274 52.95644  296.6 10.82080       22.46547 0.74 
1 1 1 25  3  28 o 55.72193 11.26500 95.72235  164.0 ?              ?        0.92 
1 1 1 25  5  0  o 72.91736 3.748799 276.2957  7.4   -10.12621      7.497598 0.55 
1 1 1 25  5  1  o 524.0369 4.116358 796.0649  203.9 19.39575       8.232717 0.98 
1 1 1 25  5  2  o 271.9442 3.340913 402.2739  224.4 -27.06677      6.681826 0.94 
1 1 1 25  5  3  o 550.5239 6.868311 689.9636  133.8 -15.85455      13.73662 0.98 
1 1 1 25  5  4  o 517.2177 4.677697 723.0361  135.4 19.41315       9.355394 0.98 
1 1 1 25  5  5  o 451.3085 4.652560 510.1882  117.2 27.86005       9.305120 0.97 
1 1 1 25  5  6  o 93.85701 3.738105 72.55621  205.6 27.75349       7.476209 0.34 
1 1 1 25  5  7  o 286.3867 2.962956 370.3979  70.0  -0.2812195     5.925911 0.95 
1 1 1 25  5  8  f 291.2363 2.993667 198.3913  140.7 -18.71521      5.987334 0.00 
1 1 1 25  5  9  o 281.1584 3.306920 273.7061  210.2 -4.299683      6.613839 0.96 
1 1 1 25  5  10 o 167.2645 2.829379 280.9120  66.1  1.977478       5.658758 0.94 
1 1 1 25  5  11 o 226.3211 2.961012 243.6379  319.6 9.467285       5.922024 0.97 
1 1 1 25  5  12 f 36.78698 7.753604 89.18919  30.4  -1.653980      15.50721 0.00 
1 1 1 25  5  13 o 192.8554 3.195825 318.3448  321.9 -3.345947      6.391651 0.97 
1 1 1 25  5  14 o 54.26033 8.132101 76.99114  42.7  20.43085       16.26420 0.54 
1 1 1 25  5  15 o 80.87151 6.025207 98.82430  67.3  15.05338       12.05041 0.83 
1 1 1 25  5  16 o 166.5289 3.855332 170.6302  354.9 -19.39050      7.710664 0.96 
1 1 1 25  5  17 o 116.7694 4.750296 147.4410  128.0 23.02335       9.500591 0.94 
1 1 1 25  5  18 o 102.3825 5.417481 141.2419  248.6 -24.23245      10.83496 0.94 
1 1 1 25  5  19 o 215.1609 4.147033 273.9351  257.6 -42.78773      8.294066 0.99 
1 1 1 25  5  20 o 161.6796 4.649257 193.6587  342.8 0.9671021E-01  9.298513 0.97 
1 1 1 25  5  21 o 43.24120 11.34279 54.23693  291.2 -15.05614      22.68558 0.52 
1 1 1 25  5  22 o 231.3614 4.258948 260.6708  242.8 -2.030609      8.517896 0.99 
1 1 1 25  5  23 o 222.4209 4.376355 284.6133  295.0 0.5974426      8.752709 0.99 
1 1 1 25  5  24 o 132.2771 6.002111 186.9976  271.3 -0.3818207     12.00422 0.98 
1 1 1 25  5  25 o 99.10020 7.843071 129.8834  222.4 -16.70621      15.68614 0.97 
1 1 1 25  5  26 o 48.52136 11.17570 68.39074  222.3 23.22729       22.35139 0.85 
1 1 1 25  5  27 o 39.82127 11.33051 49.75839  137.9 ?              ?        0.76 
1 1 1 25  7  0  o 256.9883 3.264298 483.2917  335.0 38.70358       6.528596 0.95 
1 1 1 25  7  1  o 160.2268 4.493597 312.6869  4.9   43.00122       8.987193 0.90 
1 1 1 25  7  2  o 355.5110 4.170128 567.0802  273.5 -41.81165      8.340256 0.98 
1 1 1 25  7  3  o 343.7623 4.845382 335.1897  246.9 -7.013245      9.690764 0.96 
1 1 1 25  7  4  o 233.7134 3.379364 391.8726  159.9 -10.80589      6.758727 0.96 
1 1 1 25  7  5  o 53.91970 7.662517 204.0178  237.3 0.9005356E-01  15.32503 0.62 
1 1 1 25  7  6  o 89.47884 4.420125 138.3880  152.7 -17.09181      8.840251 0.74 
1 1 1 25  7  7  o 159.4261 3.003132 254.3492  105.9 -26.63513      6.006263 0.94 
1 1 1 25  7  8  o 287.4567 3.097181 487.5667  98.5  45.46149       6.194363 0.99 
1 1 1 25  7  9  o 297.9373 3.116330 444.2269  355.4 -12.93060      6.232659 0.99 
1 1 1 25  7  10 o 55.76342 7.366612 75.19585  261.3 39.24550       14.73322 0.47 
1 1 1 25  7  11 o 148.4331 3.454677 191.4152  256.4 21.62939       6.909353 0.94 
1 1 1 25  7  12 o 109.5360 3.970203 131.6030  152.6 -0.7874146     7.940406 0.90 
1 1 1 25  7  13 o 75.38348 5.351201 54.88909  77.3  -10.47279      10.70240 0.69 
1 1 1 25  7  14 o 143.5707 5.439579 233.3420  201.2 32.63667       10.87916 0.97 
1 1 1 25  7  15 o 198.0233 4.108343 356.6572  140.9 -31.94362      8.216686 0.99 
1 1 1 25  7  16 o 70.20939 9.671142 127.2430  91.8  -23.86368      19.34228 0.91 
1 1 1 25  7  17 o 104.9284 7.262392 116.2106  58.1  -2.594147      14.52478 0.94 
1 1 1 25  7  18 o 52.08928 11.48902 66.18349  97.3  2.864227       22.97803 0.67 
1 1 1 25  7  19 o 106.7231 6.391335 149.9979  288.7 0.7026749      12.78267 0.94 
1 1 1 25  7  20 o 168.8799 4.990122 217.6999  321.7 -0.6927185     9.980245 0.98 
1 1 1 25  7  21 o 37.06467 10.75670 39.08017  134.9 -11.14201      21.51340 0.47 
1 1 1 25  7  22 o 65.71545 10.63932 91.22884  327.2 31.93703       21.27865 0.90 
1 1 1 25  7  23 o 74.02267 11.14738 77.81816  227.9 -9.382568      22.29475 0.92 
1 1 1 25  7  24 o 49.21246 13.09873 77.97188  9.4   -9.392761      26.19746 0.85 
1 1 1 25  7  25 o 35.37128 11.29098 46.72927  69.7  0.9064064      22.58195 0.68 
1 1 1 25  7  26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 25  9  0  o 120.4336 3.114381 236.1017  182.4 -31.37781      6.228762 0.93 
1 1 1 25  9  1  o 97.88655 3.610146 118.1159  168.8 -7.004189      7.220292 0.84 
1 1 1 25  9  2  o 235.1566 3.031324 292.9777  168.6 44.17160       6.062649 0.98 
1 1 1 25  9  3  o 239.7094 3.331549 426.0514  76.9  16.69760       6.663097 0.98 
1 1 1 25  9  4  o 301.0345 3.468703 509.0023  31.7  -4.027893      6.937406 0.99 
1 1 1 25  9  5  o 268.4701 3.339986 357.4825  103.5 -3.475128      6.679973 0.98 
1 1 1 25  9  6  o 175.6869 3.124650 220.8640  222.0 -26.30301      6.249300 0.96 
1 1 1 25  9  7  f 66.50763 5.862852 98.42034  244.5 -33.73739      11.72570 0.00 
1 1 1 25  9  8  o 277.4916 3.456514 357.7248  23.3  -12.46786      6.913029 0.99 
1 1 1 25  9  9  o 30.30399 8.812853 67.59471  192.0 -4.961130      17.62571 0.42 
1 1 1 25  9  10 o 61.89316 7.654091 35.57716  143.8 0.3415642      15.30818 0.48 
1 1 1 25  9  11 o 281.4186 3.304334 396.4051  329.2 25.59296       6.608668 0.99 
1 1 1 25  9  12 o 77.42500 6.455558 136.6054  16.9  5.503868       12.91112 0.91 
1 1 1 25  9  13 o 48.49820 8.773972 85.99944  193.9 -21.31668      17.54794 0.79 
1 1 1 25  9  14 o 186.6342 3.968971 295.1600  268.1 -14.79079      7.937942 0.99 
1 1 1 25  9  15 o 150.8082 5.977504 208.4023  296.5 61.96540       11.95501 0.98 
1 1 1 25  9  16 o 101.2787 7.585871 102.2868  82.5  10.10154       15.17174 0.91 
1 1 1 25  9  17 o 68.82483 11.32754 132.7725  130.1 22.04812       22.65508 0.90 
1 1 1 25  9  18 o 58.62728 11.07933 98.66068  39.6  19.29139       22.15866 0.86 
1 1 1 25  9  19 o 172.5876 6.316803 207.3000  5.4   4.652328       12.63361 0.98 
1 1 1 25  9  20 o 196.9993 5.963728 218.3077  50.9  20.01790       11.92746 0.99 
1 1 1 25  9  21 o 85.90203 11.88834 107.0790  188.6 2.627396       23.77668 0.95 
1 1 1 25  9  22 o 64.79796 13.43494 73.43665  249.3 18.85411       26.86989 0.89 
1 1 1 25  9  23 o 39.50181 12.39738 31.01068  9.1   -7.856327      24.79476 0.57 
1 1 1 25  9  24 x ?        ?        31.16589  351.7 ?              ?        0.00 
1 1 1 25  11 0  o 166.1217 3.899184 342.1966  175.7 -4.432434      7.798369 0.98 
1 1 1 25  11 1  o 163.6811 3.351716 336.3190  159.8 17.37402       6.703432 0.98 
1 1 1 25  11 2  o 106.7702 4.515590 92.62719  44.7  18.56995       9.031180 0.90 
1 1 1 25  11 3  o 56.03057 6.692059 132.7206  330.4 -29.49162      13.38412 0.86 
1 1 1 25  11 4  o 134.7884 3.594723 274.6712  24.6  12.02020       7.189447 0.98 
1 1 1 25  11 5  o 130.2006 3.621633 255.0304  35.6  11.20200       7.243266 0.97 
1 1 1 25  11 6  o 184.8849 4.509919 241.7151  257.7 -22.94618      9.019838 0.98 
1 1 1 25  11 7  o 254.0635 3.725483 376.2104  233.1 4.765778       7.450967 0.99 
1 1 1 25  11 8  o 63.07717 7.763513 53.85670  123.4 11.94464       15.52703 0.75 
1 1 1 25  11 9  o 174.7146 3.775432 226.3679  34.7  -39.61484      7.550864 0.99 
1 1 1 25  11 10 o 70.79337 7.470668 126.7993  313.1 -14.35946      14.94134 0.93 
1 1 1 25  11 11 o 145.6179 4.088368 177.3006  120.4 -4.948730      8.176736 0.97 
1 1 1 25  11 12 o 128.0237 4.314103 194.3248  152.2 24.18343       8.628205 0.97 
1 1 1 25  11 13 o 63.81357 8.305420 135.8032  38.9  -42.80369      16.61084 0.90 
1 1 1 25  11 14 o 120.5453 5.198712 193.7346  34.5  -9.688637      10.39742 0.97 
1 1 1 25  11 15 o 50.35098 10.07876 31.87912  12.8  3.221409       20.15751 0.52 
1 1 1 25  11 16 o 80.51776 11.42194 118.6983  245.4 12.33383       22.84389 0.94 
1 1 1 25  11 17 o 110.8967 8.562971 140.9879  359.4 -11.25299      17.12594 0.97 
1 1 1 25  11 18 o 70.42954 12.10870 82.22710  112.9 21.38887       24.21741 0.92 
1 1 1 25  11 19 o 98.48154 11.79081 135.6643  198.9 44.66405       23.58162 0.97 
1 1 1 25  11 20 o 39.61211 11.77146 47.73907  282.4 4.209209       23.54292 0.73 
1 1 1 25  11 21 o 33.74844 11.40059 56.78607  125.6 ?              ?        0.77 
1 1 1 25  13 0  o 93.97876 4.839391 161.6121  294.2 -34.89642      9.678782 0.97 
1 1 1 25  13 1  o 36.50825 8.563644 67.86669  106.3 20.29002       17.12729 0.73 
1 1 1 25  13 2  o 148.3733 3.669774 261.3282  295.9 10.75781       7.339549 0.99 
1 1 1 25  13 3  o 41.91524 9.152777 165.9522  337.0 13.97990       18.30555 0.90 
1 1 1 25  13 4  o 56.81677 7.704774 49.83534  33.5  0.3706741      15.40955 0.70 
1 1 1 25  13 5  o 59.21175 8.693103 156.2557  17.4  40.79612       17.38621 0.91 
1 1 1 25  13 6  o 30.66390 9.024650 53.29994  2.1   7.735506       18.04930 0.46 
1 1 1 25  13 7  o 187.4152 4.045208 230.1237  323.1 -5.380066      8.090417 0.98 
1 1 1 25  13 8  o 201.3098 4.345638 307.6066  1.5   15.56587       8.691276 0.99 
1 1 1 25  13 9  o 102.8538 5.744572 165.7223  103.8 -10.42213      11.48914 0.96 
1 1 1 25  13 10 o 166.5579 4.156060 264.4203  164.9 -0.5686340     8.312119 0.99 
1 1 1 25  13 11 o 173.6082 4.042674 302.3286  188.3 -2.895737      8.085348 0.99 
1 1 1 25  13 12 o 84.79950 6.382370 142.1869  226.0 -24.16872      12.76474 0.96 
1 1 1 25  13 13 o 76.97200 8.174971 135.3378  262.9 17.61451       16.34994 0.96 
1 1 1 25  13 14 o 96.37053 6.122187 153.7835  360.0 -6.978622      12.24437 0.98 
1 1 1 25  13 15 o 61.70158 9.394240 117.4281  6.4   3.305782       18.78848 0.94 
1 1 1 25  13 16 o 49.67274 13.19640 88.00682  230.5 -0.6529999     26.39281 0.89 
1 1 1 25  13 17 o 40.40543 11.96170 45.36100  164.7 ?              ?        0.75 
1 1 1 25  13 18 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 25  15 0  o 35.45740 9.864914 39.68061  336.1 2.299606       19.72983 0.55 
1 1 1 25  15 1  o 59.15071 8.728564 85.15131  107.9 -11.56327      17.45713 0.90 
1 1 1 25  15 2  o 36.79797 9.632735 35.59285  207.6 9.124149       19.26547 0.56 
1 1 1 25  15 3  o 43.59110 10.01220 74.50790  215.7 11.99519       20.02439 0.84 
1 1 1 25  15 4  f 53.65612 8.884289 50.27810  172.4 14.92163       17.76858 0.00 
1 1 1 25  15 5  o 79.84319 8.903929 89.55604  32.8  -10.16274      17.80786 0.94 
1 1 1 25  15 6  o 65.68811 12.28903 105.4663  34.2  -6.930534      24.57805 0.94 
1 1 1 25  15 7  o 84.05672 7.031405 105.4850  157.9 -29.03410      14.06281 0.96 
1 1 1 25  15 8  o 69.59554 9.330867 144.5171  158.7 -4.716316      18.66173 0.96 
1 1 1 25  15 9  o 94.52185 6.924236 161.1484  151.1 -4.245323      13.84847 0.98 
1 1 1 25  15 10 o 35.68491 9.842055 20.36664  33.8  -1.745388      19.68411 0.44 
1 1 1 25  15 11 o 33.97377 9.807642 55.13374  278.1 -7.562315      19.61528 0.78 
1 1 1 25  15 12 o 32.72104 9.655460 56.35500  265.4 ?              ?        0.80 
1 1 1 25  15 13 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 25  17 0  o 68.77878 9.159760 112.7796  313.6 25.26529       18.31952 0.96 
1 1 1 25  17 1  f 66.96371 10.29206 86.63470  227.6 ?              ?        0.00 
1 1 1 25  17 2  o 33.08603 10.32955 72.71346  242.8 ?              ?        0.85 
1 1 1 25  17 3  o 29.65586 9.569107 87.20847  352.3 ?              ?        0.87 
1 1 1 25  17 4  x ?        ?        62.35760  253.4 ?              ?        0.00 
1 1 1 26  0  0  o 371.7137 4.955104 615.6234  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  1  o 404.8230 5.209098 806.8513  180.0 0.000000       0.000000 1.00 
1 1 1 26  0  2  o 75.44204 5.968110 106.9562  0.0   0.000000       0.000000 0.18 
1 1 1 26  0  3  f 140.3529 4.509634 405.9803  0.0   0.000000       0.000000 0.00 
1 1 1 26  0  4  o 560.5048 5.714031 654.9647  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  5  o 727.7968 7.089712 662.5990  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  6  o 183.5576 3.200256 96.09541  180.0 0.000000       0.000000 0.77 
1 1 1 26  0  7  o 165.9787 3.540379 262.8515  0.0   0.000000       0.000000 0.97 
1 1 1 26  0  8  o 50.57120 7.007685 100.5563  0.0   0.000000       0.000000 0.20 
1 1 1 26  0  9  o 376.9318 4.815534 396.2994  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  10 o 58.49763 6.687692 72.34108  0.0   0.000000       0.000000 0.27 
1 1 1 26  0  11 o 58.74878 7.623350 258.5786  0.0   0.000000       0.000000 0.73 
1 1 1 26  0  12 o 57.06895 7.517497 203.1557  0.0   0.000000       0.000000 0.78 
1 1 1 26  0  13 o 172.8707 4.121311 325.2677  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  14 o 81.43730 6.186950 30.84586  180.0 0.000000       0.000000 0.41 
1 1 1 26  0  15 o 242.3281 4.260615 307.9810  180.0 0.000000       0.000000 1.00 
1 1 1 26  0  16 o 46.74976 12.13271 39.29678  180.0 0.000000       0.000000 0.28 
1 1 1 26  0  17 o 87.84529 5.512269 76.70670  0.0   0.000000       0.000000 0.90 
1 1 1 26  0  18 o 57.26947 10.45814 80.82487  180.0 0.000000       0.000000 0.79 
1 1 1 26  0  19 o 93.80146 6.901750 2.144015  180.0 0.000000       0.000000 0.05 
1 1 1 26  0  20 o 25.44546 14.36069 2.129035  0.0   0.000000       0.000000 0.02 
1 1 1 26  0  21 o 151.3124 4.949303 178.2726  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  22 f 186.6864 8.277366 208.5341  180.0 0.000000       0.000000 0.00 
1 1 1 26  0  23 o 34.19799 17.23309 31.24625  0.0   0.000000       0.000000 0.29 
1 1 1 26  0  24 o 24.45323 15.16785 23.35241  180.0 0.000000       0.000000 0.20 
1 1 1 26  0  25 o 90.12222 11.34585 79.21286  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  26 o 124.2201 6.481529 139.7489  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  27 o 87.34968 9.568595 116.0728  0.0   0.000000       0.000000 1.00 
1 1 1 26  0  28 o 40.41554 18.97011 72.44835  0.0   ?              ?        0.92 
1 1 1 26  2  0  o 384.2026 5.767385 573.5801  145.7 -18.44595      11.53477 0.96 
1 1 1 26  2  1  f 756.4320 5.694903 983.3521  271.9 -19.86823      11.38981 0.00 
1 1 1 26  2  2  o 713.6157 5.951135 1041.018  355.9 17.98145       11.90227 0.99 
1 1 1 26  2  3  o 331.2415 2.998140 557.9191  315.2 15.50012       5.996281 0.96 
1 1 1 26  2  4  o 490.2133 3.973374 516.1895  251.4 -58.27060      7.946747 0.98 
1 1 1 26  2  5  o 286.9139 3.515805 225.3029  343.1 -29.20999      7.031609 0.90 
1 1 1 26  2  6  o 463.2509 3.970728 626.2593  28.2  -13.01831      7.941455 0.98 
1 1 1 26  2  7  o 262.8901 2.688189 280.4365  230.3 -30.92004      5.376377 0.91 
1 1 1 26  2  8  o 515.8413 4.797420 709.0240  253.4 -14.88690      9.594839 0.98 
1 1 1 26  2  9  o 195.9690 2.472769 378.8744  167.4 17.03880       4.945537 0.92 
1 1 1 26  2  10 o 521.5850 3.802685 696.9362  315.3 3.559753       7.605370 0.99 
1 1 1 26  2  11 o 250.4573 3.002702 357.9257  314.1 2.526825       6.005403 0.96 
1 1 1 26  2  12 o 136.8702 2.870156 81.79360  204.3 35.19040       5.740311 0.78 
1 1 1 26  2  13 o 150.9736 3.088614 145.0092  155.0 0.8491516      6.177228 0.91 
1 1 1 26  2  14 o 180.5077 2.773379 134.3902  175.2 -38.02422      5.546758 0.93 
1 1 1 26  2  15 o 157.1331 2.852199 230.6731  251.4 21.66093       5.704398 0.95 
1 1 1 26  2  16 o 135.8481 3.310312 208.0292  286.1 17.22918       6.620624 0.95 
1 1 1 26  2  17 o 53.62803 8.055493 77.83628  289.4 -17.87942      16.11099 0.66 
1 1 1 26  2  18 o 71.75376 5.989333 120.1149  186.6 34.10507       11.97867 0.87 
1 1 1 26  2  19 o 180.4729 3.131904 225.0197  122.4 -25.92809      6.263808 0.98 
1 1 1 26  2  20 o 62.01657 8.319267 64.16416  241.4 5.330463       16.63853 0.79 
1 1 1 26  2  21 o 93.29962 4.533896 105.1968  116.9 22.75876       9.067793 0.90 
1 1 1 26  2  22 o 60.33463 8.227053 98.79194  357.4 -45.68742      16.45411 0.82 
1 1 1 26  2  23 o 35.53405 8.951815 35.46598  47.6  14.90140       17.90363 0.36 
1 1 1 26  2  24 o 57.04434 9.243522 57.94606  342.1 37.33525       18.48704 0.78 
1 1 1 26  2  25 o 119.2078 4.986854 119.9647  67.8  -26.99421      9.973707 0.97 
1 1 1 26  2  26 o 63.56660 8.846464 94.24722  247.1 -11.63851      17.69293 0.92 
1 1 1 26  2  27 o 48.43888 11.85185 59.88135  231.6 -24.01596      23.70369 0.81 
1 1 1 26  2  28 x ?        ?        10.82043  83.1  ?              ?        0.00 
1 1 1 26  4  0  o 211.4857 2.512898 441.2875  308.3 22.45271       5.025795 0.92 
1 1 1 26  4  1  o 496.3651 4.012683 799.9050  50.8  -72.64920      8.025367 0.98 
1 1 1 26  4  2  o 332.8896 3.247876 335.8569  299.5 11.45557       6.495753 0.91 
1 1 1 26  4  3  o 692.3491 7.950888 789.2798  220.7 23.90698       15.90178 0.99 
1 1 1 26  4  4  o 352.0128 3.319798 456.4758  182.9 33.47626       6.639596 0.96 
1 1 1 26  4  5  o 441.1250 3.697321 552.0048  58.7  -38.71259      7.394643 0.97 
1 1 1 26  4  6  o 299.9438 3.175343 318.1034  97.3  4.887482       6.350685 0.93 
1 1 1 26  4  7  o 770.9111 5.534986 1020.034  81.3  -18.89038      11.06997 0.99 
1 1 1 26  4  8  f 461.8263 3.904658 612.7269  110.0 -36.00516      7.809317 0.00 
1 1 1 26  4  9  o 218.4145 2.667841 269.1043  273.2 38.09241       5.335682 0.94 
1 1 1 26  4  10 o 165.2884 2.699769 307.4299  12.1  -29.69023      5.399537 0.94 
1 1 1 26  4  11 o 154.7625 2.683951 284.5185  184.1 39.86482       5.367903 0.95 
1 1 1 26  4  12 o 338.7632 3.301026 366.1684  42.6  -38.72937      6.602052 0.99 
1 1 1 26  4  13 o 156.9496 2.770744 173.9827  249.4 -6.025070      5.541488 0.93 
1 1 1 26  4  14 o 160.9314 2.910504 233.0645  88.7  9.618515       5.821008 0.96 
1 1 1 26  4  15 o 227.6171 3.248764 300.2252  327.3 23.49724       6.497529 0.98 
1 1 1 26  4  16 o 242.8527 3.139243 322.8069  235.5 -6.938248      6.278486 0.99 
1 1 1 26  4  17 o 136.7160 3.640447 209.6408  175.3 0.6374664      7.280894 0.96 
1 1 1 26  4  18 o 298.4737 4.340539 352.0677  305.1 27.00815       8.681078 0.99 
1 1 1 26  4  19 f 243.1353 3.992844 372.0848  239.8 -8.594177      7.985688 0.00 
1 1 1 26  4  20 o 124.2287 5.028779 142.3495  258.6 -32.23853      10.05756 0.95 
1 1 1 26  4  21 o 65.74596 9.826497 59.89758  251.8 -19.99219      19.65299 0.70 
1 1 1 26  4  22 o 201.3851 4.470479 249.5018  229.8 -7.970901      8.940958 0.98 
1 1 1 26  4  23 o 90.24954 7.811847 152.4798  266.9 -30.51586      15.62369 0.95 
1 1 1 26  4  24 o 100.7188 7.905704 122.6154  54.6  13.35342       15.81141 0.96 
1 1 1 26  4  25 o 97.50351 8.226512 83.68432  89.1  18.91085       16.45302 0.94 
1 1 1 26  4  26 o 53.73316 11.18683 59.28531  312.8 -40.26434      22.37365 0.83 
1 1 1 26  4  27 o 69.13492 12.58381 113.9881  340.4 ?              ?        0.94 
1 1 1 26  6  0  o 227.5192 3.132339 294.3804  325.2 0.6221161      6.264678 0.91 
1 1 1 26  6  1  o 341.3869 5.349079 591.2410  254.6 -8.790894      10.69816 0.97 
1 1 1 26  6  2  o 566.4468 5.088445 717.3862  97.9  26.08514       10.17689 0.98 
1 1 1 26  6  3  o 327.8208 3.583206 459.1498  124.2 38.77557       7.166412 0.96 
1 1 1 26  6  4  o 624.7432 5.605981 863.0298  59.9  37.42615       11.21196 0.99 
1 1 1 26  6  5  o 328.0699 3.198913 475.2070  40.4  -9.432312      6.397825 0.97 
1 1 1 26  6  6  o 43.66034 6.661615 83.85907  236.8 -35.35935      13.32323 0.23 
1 1 1 26  6  7  o 115.9419 3.108013 270.2362  320.6 -27.71689      6.216025 0.90 
1 1 1 26  6  8  o 136.7207 2.996146 185.1044  20.1  39.99162       5.992292 0.91 
1 1 1 26  6  9  o 200.6671 2.710088 224.8417  297.7 -30.52798      5.420177 0.96 
1 1 1 26  6  10 o 165.1165 2.971857 262.2556  131.0 2.293030       5.943715 0.96 
1 1 1 26  6  11 o 53.66817 6.895287 54.25696  156.6 -10.56812      13.79057 0.39 
1 1 1 26  6  12 o 74.46098 4.713607 122.2450  219.2 -17.19289      9.427215 0.82 
1 1 1 26  6  13 o 126.0632 3.868051 292.7932  308.3 -19.18261      7.736101 0.96 
1 1 1 26  6  14 o 308.3412 4.441485 420.2957  200.7 -33.46204      8.882971 0.99 
1 1 1 26  6  15 o 230.5760 4.328363 291.7240  265.6 -17.77745      8.656726 0.98 
1 1 1 26  6  16 o 44.62753 9.981728 59.38272  34.6  0.7171555      19.96346 0.57 
1 1 1 26  6  17 o 172.6211 3.862963 250.3879  130.9 8.065170       7.725926 0.98 
1 1 1 26  6  18 o 34.40874 9.655003 23.89546  140.3 -8.590488      19.31001 0.25 
1 1 1 26  6  19 o 29.92684 9.266383 37.50038  352.2 -0.6252441     18.53277 0.27 
1 1 1 26  6  20 o 130.2851 5.892193 143.1255  73.7  11.87576       11.78439 0.95 
1 1 1 26  6  21 o 32.57071 10.16483 50.63171  139.4 -14.69250      20.32965 0.47 
1 1 1 26  6  22 o 135.6594 6.069427 159.5001  248.0 3.975006       12.13885 0.97 
1 1 1 26  6  23 o 84.13594 10.47156 117.5654  202.4 39.66935       20.94313 0.95 
1 1 1 26  6  24 o 48.58562 10.83948 56.91580  341.3 -31.50061      21.67896 0.80 
1 1 1 26  6  25 o 69.76889 11.42138 96.90443  136.5 11.05358       22.84276 0.93 
1 1 1 26  6  26 o 47.16886 11.71447 90.46420  95.3  ?              ?        0.90 
1 1 1 26  8  0  o 433.4326 5.068534 553.2560  136.2 -4.034363      10.13707 0.99 
1 1 1 26  8  1  o 285.1500 3.237417 426.8824  120.6 -2.204803      6.474834 0.98 
1 1 1 26  8  2  o 259.1017 3.093321 285.2366  306.5 2.944214       6.186642 0.96 
1 1 1 26  8  3  o 123.4711 3.215910 182.9579  86.0  11.66462       6.431820 0.90 
1 1 1 26  8  4  o 78.89880 5.183359 61.30369  108.2 -8.535629      10.36672 0.58 
1 1 1 26  8  5  o 145.1750 3.376324 136.3712  225.0 14.06821       6.752649 0.91 
1 1 1 26  8  6  o 317.4007 3.557667 549.6877  196.5 0.9024658      7.115333 0.99 
1 1 1 26  8  7  o 232.0052 2.810755 388.6849  139.6 2.846909       5.621511 0.98 
1 1 1 26  8  8  f 165.7047 3.058523 292.3573  344.6 -12.92493      6.117045 0.00 
1 1 1 26  8  9  f 89.25478 4.336544 139.9597  185.5 9.507698       8.673087 0.00 
1 1 1 26  8  10 o 403.1635 4.148173 647.2291  186.8 -16.39236      8.296346 1.00 
1 1 1 26  8  11 o 31.68516 8.861494 67.42117  199.7 -1.032820      17.72299 0.44 
1 1 1 26  8  12 o 81.22929 5.441460 152.0370  347.5 21.35788       10.88292 0.92 
1 1 1 26  8  13 o 252.5934 3.413958 337.4168  339.8 1.031754       6.827915 0.99 
1 1 1 26  8  14 o 92.51649 5.542712 110.9954  57.1  1.233551       11.08542 0.92 
1 1 1 26  8  15 o 210.2327 4.961001 318.8159  149.4 -6.204681      9.922003 0.99 
1 1 1 26  8  16 o 160.9399 5.157116 174.0414  10.4  4.953079       10.31423 0.97 
1 1 1 26  8  17 o 135.2610 5.614938 177.7023  9.8   -0.2950439     11.22988 0.96 
1 1 1 26  8  18 o 51.13298 12.18139 47.60334  42.8  -9.758835      24.36277 0.56 
1 1 1 26  8  19 o 78.59152 11.37769 118.8708  337.1 5.653099       22.75538 0.92 
1 1 1 26  8  20 o 47.58702 12.06260 66.52778  82.9  6.124401       24.12520 0.77 
1 1 1 26  8  21 o 61.12110 11.99648 114.0203  187.1 14.53826       23.99296 0.92 
1 1 1 26  8  22 o 84.76414 12.04375 164.2949  240.7 50.04504       24.08750 0.97 
1 1 1 26  8  23 o 72.79015 12.25596 110.6195  229.7 -20.73648      24.51192 0.94 
1 1 1 26  8  24 o 37.43963 11.71545 29.85839  105.5 ?              ?        0.55 
1 1 1 26  10 0  o 111.6085 3.524216 244.5167  331.7 32.68521       7.048432 0.94 
1 1 1 26  10 1  o 161.3872 3.073804 312.0339  336.7 19.29100       6.147609 0.97 
1 1 1 26  10 2  o 103.6027 3.912940 106.1741  199.4 39.27828       7.825879 0.85 
1 1 1 26  10 3  o 383.2823 4.011640 502.0081  148.7 3.873810       8.023279 0.99 
1 1 1 26  10 4  o 149.5241 3.390984 203.4140  75.8  -13.81816      6.781968 0.96 
1 1 1 26  10 5  o 175.6462 3.247292 252.2435  340.7 -4.321655      6.494584 0.98 
1 1 1 26  10 6  o 109.1835 4.109080 109.3558  354.0 5.919106       8.218160 0.92 
1 1 1 26  10 7  o 108.0777 4.510654 134.7166  53.5  3.853378       9.021308 0.93 
1 1 1 26  10 8  o 88.99908 5.403178 120.3097  20.7  -7.993484      10.80636 0.91 
1 1 1 26  10 9  o 240.7532 3.382830 298.8229  235.1 -4.687943      6.765661 0.99 
1 1 1 26  10 10 o 106.2494 4.752391 180.3583  224.3 -0.3164139     9.504782 0.96 
1 1 1 26  10 11 o 259.2357 3.427063 378.9613  18.6  15.70044       6.854126 0.99 
1 1 1 26  10 12 o 175.2238 3.884919 265.9265  52.0  -7.277115      7.769838 0.99 
1 1 1 26  10 13 f 43.92806 10.28722 82.50830  51.3  22.52427       20.57444 0.00 
1 1 1 26  10 14 o 52.68824 9.644240 111.9486  242.0 1.525116       19.28848 0.83 
1 1 1 26  10 15 f 79.38486 6.893474 57.13693  125.9 5.926865       13.78695 0.00 
1 1 1 26  10 16 f 52.48331 12.04912 67.61205  194.8 3.831745       24.09823 0.00 
1 1 1 26  10 17 o 104.8965 8.700861 104.3430  330.4 0.3659210      17.40172 0.95 
1 1 1 26  10 18 o 48.08982 13.15240 22.76191  238.2 -2.678375      26.30481 0.44 
1 1 1 26  10 19 o 84.36340 11.19904 140.4163  343.4 -44.29466      22.39808 0.96 
1 1 1 26  10 20 o 148.2870 6.734692 229.5077  356.8 -8.348236      13.46938 0.99 
1 1 1 26  10 21 o 119.3950 9.368263 167.9929  11.1  -12.77789      18.73653 0.98 
1 1 1 26  10 22 o 55.47159 13.29792 124.8012  357.5 ?              ?        0.94 
1 1 1 26  12 0  o 42.65665 8.049038 108.7798  2.3   -22.17754      16.09808 0.79 
1 1 1 26  12 1  o 287.7514 3.426406 462.4707  21.3  31.78375       6.852812 0.99 
1 1 1 26  12 2  f 301.1484 3.580845 465.9713  359.1 13.00406       7.161690 0.00 
1 1 1 26  12 3  f 146.7116 4.876062 233.0320  53.2  15.37277       9.752125 0.00 
1 1 1 26  12 4  o 97.47701 4.569479 176.7699  31.5  20.90913       9.138959 0.96 
1 1 1 26  12 5  o 126.9304 4.395471 246.2947  324.3 -11.25656      8.790942 0.98 
1 1 1 26  12 6  o 65.69675 6.606923 83.71677  124.5 34.57595       13.21385 0.89 
1 1 1 26  12 7  o 113.2527 5.294590 159.0305  265.2 -35.70193      10.58918 0.96 
1 1 1 26  12 8  f 174.3547 4.347489 214.8735  295.0 -9.417206      8.694978 0.00 
1 1 1 26  12 9  o 155.3592 4.824387 244.1994  40.6  -10.09781      9.648773 0.98 
1 1 1 26  12 10 o 66.92290 8.459389 96.68891  1.2   20.71329       16.91878 0.87 
1 1 1 26  12 11 o 141.8246 4.391862 180.4062  266.1 -18.72229      8.783725 0.97 
1 1 1 26  12 12 o 70.25925 7.618201 64.17788  84.5  -18.04900      15.23640 0.85 
1 1 1 26  12 13 o 33.49166 9.837589 44.92722  213.2 2.511311       19.67518 0.56 
1 1 1 26  12 14 o 65.36829 8.991837 126.9242  237.2 -33.14887      17.98367 0.94 
1 1 1 26  12 15 o 54.10167 9.751853 53.17848  273.7 30.71790       19.50371 0.84 
1 1 1 26  12 16 o 41.77071 12.43113 47.00754  289.0 8.208035       24.86227 0.72 
1 1 1 26  12 17 o 123.8244 8.619723 149.7816  15.4  ?              ?        0.98 
1 1 1 26  12 18 o 33.28582 10.95321 52.44898  279.0 2.713926       21.90643 0.73 
1 1 1 26  12 19 o 35.04574 11.64216 63.34416  164.3 ?              ?        0.81 
1 1 1 26  14 0  o 131.5947 4.425092 276.4518  149.8 1.979263       8.850184 0.98 
1 1 1 26  14 1  o 98.82159 4.995632 137.1043  94.1  4.822037       9.991264 0.95 
1 1 1 26  14 2  o 39.78865 8.973447 30.35992  51.0  25.33143       17.94689 0.40 
1 1 1 26  14 3  o 92.28841 5.214242 170.8610  177.8 6.831467       10.42848 0.96 
1 1 1 26  14 4  o 180.3762 3.854223 332.5578  193.4 50.48006       7.708446 0.99 
1 1 1 26  14 5  o 37.68201 9.082046 47.05435  173.9 -15.18492      18.16409 0.60 
1 1 1 26  14 6  o 102.1610 8.527831 137.3188  263.7 17.04004       17.05566 0.96 
1 1 1 26  14 7  o 78.95631 9.976868 140.7735  254.0 52.88417       19.95374 0.95 
1 1 1 26  14 8  o 30.48183 9.539124 72.26202  253.1 -1.707603      19.07825 0.76 
1 1 1 26  14 9  o 112.2293 5.159937 191.4013  218.8 6.496727       10.31987 0.98 
1 1 1 26  14 10 o 40.21439 10.25178 84.51237  182.8 10.02597       20.50357 0.88 
1 1 1 26  14 11 o 47.96149 10.54611 56.58237  113.5 4.561680       21.09223 0.84 
1 1 1 26  14 12 f 64.36574 8.716323 119.9039  223.6 -31.26004      17.43265 0.00 
1 1 1 26  14 13 o 50.25281 10.15806 61.02834  285.8 16.94301       20.31612 0.87 
1 1 1 26  14 14 o 43.31667 10.01009 89.03396  179.2 ?              ?        0.90 
1 1 1 26  14 15 x ?        ?        88.86390  122.2 ?              ?        0.00 
1 1 1 26  16 0  o 42.93537 10.49779 100.0048  296.3 -10.49158      20.99558 0.91 
1 1 1 26  16 1  o 29.02467 9.449910 41.80838  23.7  8.139601       18.89982 0.64 
1 1 1 26  16 2  o 25.03474 8.339546 58.54123  87.0  -3.441420      16.67909 0.73 
1 1 1 26  16 3  o 30.37322 9.470583 64.08567  57.2  -3.204283      18.94117 0.79 
1 1 1 26  16 4  o 46.87908 10.84395 44.43063  132.3 -6.796005      21.68790 0.79 
1 1 1 26  16 5  o 39.27772 9.590889 99.78912  320.3 -15.82219      19.18178 0.91 
1 1 1 26  16 6  o 36.84976 11.01084 94.02325  271.1 -6.517502      22.02168 0.89 
1 1 1 26  16 7  o 38.15768 10.56101 59.66939  286.7 ?              ?        0.83 
1 1 1 26  16 8  o 37.65416 11.72702 68.34727  357.7 ?              ?        0.85 
1 1 1 27  1  0  o 641.3172 6.314849 923.7709  119.6 -23.13684      12.62970 0.99 
1 1 1 27  1  1  o 603.1257 5.078149 718.0658  126.8 -11.97327      10.15630 0.99 
1 1 1 27  1  2  o 500.8074 3.964756 660.6078  79.5  68.58347       7.929513 0.97 
1 1 1 27  1  3  o 250.7738 2.944937 172.5471  289.3 -12.05974      5.889875 0.74 
1 1 1 27  1  4  o 439.7067 3.691198 582.2914  295.2 62.15958       7.382395 0.98 
1 1 1 27  1  5  f 465.1969 3.641619 425.8601  342.1 30.32898       7.283238 0.00 
1 1 1 27  1  6  o 706.1966 5.191241 1031.078  132.3 4.956055       10.38248 0.99 
1 1 1 27  1  7  o 35.86314 6.614047 85.49442  3.6   13.92172       13.22809 0.11 
1 1 1 27  1  8  o 102.2326 3.200138 129.3640  192.2 8.681343       6.400276 0.36 
1 1 1 27  1  9  o 289.0743 2.736910 298.2290  11.6  8.487183       5.473819 0.94 
1 1 1 27  1  10 o 621.0661 5.098624 779.5626  260.8 15.40039       10.19725 0.99 
1 1 1 27  1  11 o 298.2595 2.982720 380.6805  221.0 -16.20255      5.965440 0.97 
1 1 1 27  1  12 o 377.3393 3.595677 464.5284  259.3 -40.44312      7.191354 0.99 
1 1 1 27  1  13 o 395.1001 3.756268 512.1277  259.1 14.48859       7.512536 0.99 
1 1 1 27  1  14 o 231.9508 2.805903 335.6112  215.1 -50.81808      5.611807 0.98 
1 1 1 27  1  15 o 253.7410 3.111834 274.7572  198.6 -12.25267      6.223668 0.98 
1 1 1 27  1  16 o 134.7754 3.036906 156.9549  247.8 -7.655365      6.073813 0.94 
1 1 1 27  1  17 o 163.8560 3.248809 213.5011  233.2 -7.240540      6.497617 0.97 
1 1 1 27  1  18 o 156.3252 3.220029 201.2549  38.9  8.178070       6.440058 0.97 
1 1 1 27  1  19 o 58.61356 8.351492 52.95908  38.4  22.00941       16.70298 0.68 
1 1 1 27  1  20 o 44.33407 7.056684 57.54443  317.9 -39.00974      14.11337 0.63 
1 1 1 27  1  21 o 71.55949 7.174215 146.9236  280.4 13.58434       14.34843 0.90 
1 1 1 27  1  22 o 73.71245 6.268718 77.77392  231.5 -11.90057      12.53744 0.82 
1 1 1 27  1  23 o 89.43126 5.325671 134.0505  47.3  0.7238312      10.65134 0.94 
1 1 1 27  1  24 o 92.25001 6.782879 110.4939  7.3   9.735275       13.56576 0.94 
1 1 1 27  1  25 o 73.55648 7.511682 45.35043  80.8  -34.98758      15.02336 0.85 
1 1 1 27  1  26 o 111.0059 5.827377 101.7880  223.8 -3.415535      11.65475 0.96 
1 1 1 27  1  27 o 46.00501 11.09020 98.48144  100.0 -12.52482      22.18040 0.89 
1 1 1 27  1  28 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 27  3  0  o 336.2900 3.574140 362.1580  105.5 8.306122       7.148280 0.94 
1 1 1 27  3  1  o 383.7393 3.344524 574.7128  47.9  -12.86542      6.689048 0.96 
1 1 1 27  3  2  o 475.6700 4.012677 589.8815  257.6 -13.11530      8.025353 0.98 
1 1 1 27  3  3  o 381.3805 3.966001 640.4236  189.0 17.39288       7.932001 0.97 
1 1 1 27  3  4  o 818.0281 5.673152 1035.111  189.5 -29.50000      11.34630 0.99 
1 1 1 27  3  5  o 495.8034 4.256002 676.7694  296.4 15.54611       8.512005 0.98 
1 1 1 27  3  6  o 187.5184 2.635621 255.0080  10.2  8.380829       5.271241 0.89 
1 1 1 27  3  7  o 336.8254 3.322195 416.9828  90.7  25.93253       6.644389 0.96 
1 1 1 27  3  8  o 126.3073 2.919316 163.9114  295.6 1.323997       5.838633 0.73 
1 1 1 27  3  9  o 67.95070 4.892618 81.17354  259.0 53.13964       9.785236 0.31 
1 1 1 27  3  10 o 35.49137 6.053379 173.7454  261.8 -28.61093      12.10676 0.43 
1 1 1 27  3  11 o 212.2598 2.528821 253.7229  71.5  10.15884       5.057642 0.96 
1 1 1 27  3  12 o 272.5888 3.129163 413.3503  20.7  -26.75674      6.258326 0.98 
1 1 1 27  3  13 o 30.76381 7.936169 31.13363  86.3  8.885988       15.87234 0.09 
1 1 1 27  3  14 o 72.55779 6.035749 137.0033  36.6  22.98625       12.07150 0.80 
1 1 1 27  3  15 o 146.4093 3.265769 168.5926  343.3 -4.252533      6.531538 0.94 
1 1 1 27  3  16 o 239.9337 3.016860 320.6671  148.0 -16.95305      6.033720 0.99 
1 1 1 27  3  17 o 102.5030 4.056633 170.8828  208.9 28.23743       8.113267 0.94 
1 1 1 27  3  18 o 394.7704 3.743487 534.9699  277.2 -19.36945      7.486975 1.00 
1 1 1 27  3  19 o 178.1470 3.407611 246.6168  82.7  -28.76796      6.815221 0.99 
1 1 1 27  3  20 o 103.9821 4.213068 96.11733  70.9  23.46918       8.426135 0.91 
1 1 1 27  3  21 o 147.2285 3.868784 165.2573  271.1 9.925644       7.737568 0.96 
1 1 1 27  3  22 o 60.24270 8.596478 86.75526  96.5  39.15019       17.19296 0.82 
1 1 1 27  3  23 o 84.56559 5.879290 144.0914  84.7  -6.964890      11.75858 0.95 
1 1 1 27  3  24 o 63.08163 7.978690 95.73506  69.3  -22.35093      15.95738 0.91 
1 1 1 27  3  25 o 59.43398 12.30857 78.59364  131.1 10.02779       24.61714 0.88 
1 1 1 27  3  26 o 54.33849 12.26872 36.37828  332.5 -8.497025      24.53745 0.69 
1 1 1 27  3  27 o 46.96941 12.59185 72.13751  53.7  ?              ?        0.85 
1 1 1 27  5  0  o 854.3734 6.006958 1164.404  35.7  -3.723083      12.01392 0.99 
1 1 1 27  5  1  o 477.8932 3.957504 553.9924  221.7 43.04889       7.915008 0.98 
1 1 1 27  5  2  o 571.0504 5.121138 796.6164  26.0  -41.67249      10.24228 0.99 
1 1 1 27  5  3  f 495.8654 4.568088 548.5295  281.2 -18.09241      9.136175 0.00 
1 1 1 27  5  4  o 298.8857 2.999732 468.0331  305.1 -24.09317      5.999464 0.95 
1 1 1 27  5  5  o 196.3471 2.652187 95.86076  83.1  -20.88179      5.304375 0.72 
1 1 1 27  5  6  o 211.4512 2.730533 331.1841  324.3 -15.35802      5.461066 0.93 
1 1 1 27  5  7  o 191.2731 2.706333 223.5696  31.8  -56.32959      5.412665 0.92 
1 1 1 27  5  8  o 161.4113 2.696962 257.1573  177.9 -19.35468      5.393924 0.93 
1 1 1 27  5  9  o 185.1354 3.105453 371.6354  322.5 -17.09293      6.210905 0.97 
1 1 1 27  5  10 o 250.5763 3.067773 375.2151  265.1 -29.32832      6.135545 0.98 
1 1 1 27  5  11 o 161.5943 2.775573 271.6289  195.2 23.75708       5.551146 0.96 
1 1 1 27  5  12 f 108.9737 3.385049 184.5612  254.1 5.631577       6.770098 0.00 
1 1 1 27  5  13 o 107.3406 4.347021 188.9018  254.5 5.250755       8.694041 0.92 
1 1 1 27  5  14 o 342.4658 3.563093 551.8782  150.3 -22.97131      7.126186 0.99 
1 1 1 27  5  15 f 245.9154 3.175704 401.5617  207.2 -14.93767      6.351409 0.00 
1 1 1 27  5  16 o 227.9032 3.070802 337.8078  251.7 -10.77495      6.141604 0.99 
1 1 1 27  5  17 o 44.13454 10.23512 55.16658  88.7  -3.626160      20.47024 0.58 
1 1 1 27  5  18 o 165.5859 4.016367 233.8700  100.5 5.976501       8.032734 0.98 
1 1 1 27  5  19 o 217.4369 4.244816 252.0957  121.7 -4.919708      8.489633 0.98 
1 1 1 27  5  20 o 98.49695 6.824168 106.7040  14.7  -15.35187      13.64834 0.91 
1 1 1 27  5  21 o 75.91870 9.065657 120.0267  150.8 16.84628       18.13131 0.90 
1 1 1 27  5  22 o 39.61079 11.07030 16.38279  170.3 -5.944523      22.14060 0.23 
1 1 1 27  5  23 o 140.1012 5.766611 190.3610  75.2  -15.55322      11.53322 0.98 
1 1 1 27  5  24 o 80.35445 9.757257 68.30373  96.5  -22.50778      19.51451 0.91 
1 1 1 27  5  25 o 42.13409 12.28670 52.21565  238.8 -13.74988      24.57340 0.73 
1 1 1 27  5  26 o 33.35283 10.62154 32.02271  254.1 ?              ?        0.54 
1 1 1 27  7  0  o 266.1520 4.110489 430.9590  116.1 ?              ?        0.96 
1 1 1 27  7  1  o 178.5335 2.875574 290.3714  187.6 -4.572586      5.751147 0.91 
1 1 1 27  7  2  o 118.4175 3.347280 257.4623  260.6 29.45179       6.694560 0.86 
1 1 1 27  7  3  o 90.93268 5.328225 142.1793  25.8  7.885590       10.65645 0.69 
1 1 1 27  7  4  o 164.3955 2.986509 171.2630  37.7  34.80025       5.973017 0.90 
1 1 1 27  7  5  o 269.4213 3.566469 410.9549  329.5 -13.75101      7.132938 0.98 
1 1 1 27  7  6  f 254.7468 2.875204 409.7718  287.8 14.07204       5.750409 0.00 
1 1 1 27  7  7  o 197.3675 2.980812 233.1649  166.0 -18.27286      5.961625 0.96 
1 1 1 27  7  8  o 39.81824 7.883130 114.5974  272.3 5.860027       15.76626 0.57 
1 1 1 27  7  9  o 62.55141 6.238850 68.03967  133.9 46.08402       12.47770 0.51 
1 1 1 27  7  10 o 123.1151 3.801193 186.3095  123.5 6.305252       7.602386 0.93 
1 1 1 27  7  11 o 199.4902 3.055166 285.2643  331.9 7.172867       6.110332 0.98 
1 1 1 27  7  12 o 148.1810 3.267544 150.2501  38.9  42.16129       6.535089 0.95 
1 1 1 27  7  13 o 134.0946 3.979106 222.0187  344.5 26.54020       7.958213 0.97 
1 1 1 27  7  14 o 201.2099 3.507425 315.6426  308.6 5.460434       7.014850 0.99 
1 1 1 27  7  15 o 87.90592 7.270313 101.5774  31.5  50.04876       14.54063 0.91 
1 1 1 27  7  16 o 137.1549 5.520391 176.3544  25.9  22.71887       11.04078 0.97 
1 1 1 27  7  17 o 124.0153 6.170600 118.8880  203.6 38.24834       12.34120 0.94 
1 1 1 27  7  18 o 96.82422 8.108847 129.3638  89.3  14.28873       16.21769 0.92 
1 1 1 27  7  19 o 258.1844 4.136814 358.6197  40.5  -12.03206      8.273627 0.99 
1 1 1 27  7  20 o 33.65137 10.14381 24.51029  280.8 1.233223       20.28762 0.28 
1 1 1 27  7  21 o 42.45358 11.34727 27.95099  283.5 5.858883       22.69454 0.45 
1 1 1 27  7  22 o 57.89527 12.35743 97.69358  234.7 -25.82933      24.71486 0.91 
1 1 1 27  7  23 o 104.9256 7.947548 142.9251  231.5 -16.92269      15.89510 0.97 
1 1 1 27  7  24 o 48.47735 11.12289 105.2760  229.2 24.03113       22.24578 0.91 
1 1 1 27  7  25 o 31.35912 10.62127 33.71337  216.6 ?              ?        0.57 
1 1 1 27  9  0  o 144.4415 3.219801 244.1319  61.1  -33.32781      6.439603 0.95 
1 1 1 27  9  1  o 179.7840 3.078271 361.3930  330.6 -6.812164      6.156542 0.98 
1 1 1 27  9  2  o 67.65139 5.710381 158.6008  257.1 34.04737       11.42076 0.84 
1 1 1 27  9  3  o 178.4366 3.382246 318.6678  146.7 11.55228       6.764493 0.97 
1 1 1 27  9  4  o 241.0921 3.065416 355.5745  114.4 -28.69220      6.130831 0.98 
1 1 1 27  9  5  o 128.5246 3.671627 193.4312  245.1 -17.53207      7.343253 0.94 
1 1 1 27  9  6  o 338.4194 3.601704 583.4734  144.5 -21.18747      7.203408 0.99 
1 1 1 27  9  7  o 198.1711 2.923300 313.0879  94.8  -24.96019      5.846599 0.98 
1 1 1 27  9  8  o 94.67343 4.165290 233.2274  330.0 -3.693649      8.330580 0.95 
1 1 1 27  9  9  o 91.87820 4.406973 185.4961  192.5 27.58315       8.813946 0.94 
1 1 1 27  9  10 o 158.5303 3.874537 249.5849  88.7  -24.03584      7.749073 0.98 
1 1 1 27  9  11 o 153.3710 4.089480 209.8536  44.0  -21.39938      8.178961 0.97 
1 1 1 27  9  12 o 39.61232 9.421063 43.76445  224.6 19.95821       18.84213 0.50 
1 1 1 27  9  13 o 175.6107 3.922431 268.9832  122.6 -7.614441      7.844861 0.99 
1 1 1 27  9  14 o 316.7970 3.711499 429.8184  128.1 6.111237       7.422999 0.99 
1 1 1 27  9  15 o 59.89928 11.32638 108.3785  128.8 7.498608       22.65277 0.84 
1 1 1 27  9  16 o 117.5393 7.615898 219.1674  324.0 -8.336540      15.23180 0.97 
1 1 1 27  9  17 o 45.81874 12.15005 77.77213  77.2  -0.2535896     24.30009 0.74 
1 1 1 27  9  18 o 43.69281 11.90184 65.63462  167.0 4.587704       23.80367 0.73 
1 1 1 27  9  19 o 96.57149 8.799265 115.1255  278.8 -7.647270      17.59853 0.95 
1 1 1 27  9  20 o 38.89106 12.21512 90.04742  138.2 -10.11201      24.43023 0.85 
1 1 1 27  9  21 f 80.73470 12.19049 119.7196  73.4  -16.43669      24.38098 0.00 
1 1 1 27  9  22 o 42.74449 13.16862 28.28254  339.9 -27.40889      26.33725 0.54 
1 1 1 27  9  23 o 38.53978 11.79865 27.05689  164.1 ?              ?        0.55 
1 1 1 27  11 0  o 115.4095 3.515701 159.3052  42.3  -21.78065      7.031401 0.95 
1 1 1 27  11 1  o 26.14952 7.931230 77.36498  222.8 2.532188       15.86246 0.47 
1 1 1 27  11 2  o 90.91605 5.260312 150.4036  294.6 -5.076935      10.52062 0.93 
1 1 1 27  11 3  o 146.9183 4.069679 217.8832  39.3  15.67368       8.139358 0.97 
1 1 1 27  11 4  o 149.9514 4.923058 207.0938  73.0  -8.432480      9.846115 0.97 
1 1 1 27  11 5  o 132.4123 3.552388 218.6749  80.1  20.71989       7.104776 0.97 
1 1 1 27  11 6  o 140.7649 4.533827 225.1127  66.2  0.5464630      9.067655 0.98 
1 1 1 27  11 7  o 36.48335 9.315736 81.54620  350.2 10.82995       18.63147 0.72 
1 1 1 27  11 8  o 86.98085 6.325859 65.96992  306.3 -12.54084      12.65172 0.90 
1 1 1 27  11 9  o 132.0088 4.359847 210.3411  17.5  -0.1629181     8.719693 0.98 
1 1 1 27  11 10 o 81.88525 7.119558 57.80955  174.3 12.26843       14.23912 0.82 
1 1 1 27  11 11 o 61.90266 8.681175 80.87038  106.3 37.54425       17.36235 0.81 
1 1 1 27  11 12 o 72.60957 8.387627 144.3586  62.9  10.93643       16.77525 0.92 
1 1 1 27  11 13 o 91.47076 8.084289 128.6872  248.8 -47.03252      16.16858 0.94 
1 1 1 27  11 14 o 60.70773 10.18466 80.94234  272.4 4.213375       20.36933 0.85 
1 1 1 27  11 15 o 32.52277 9.787252 17.08968  137.6 -0.6804962     19.57450 0.25 
1 1 1 27  11 16 o 82.57229 11.90091 101.9500  217.6 -14.61801      23.80182 0.94 
1 1 1 27  11 17 o 41.43584 12.62106 59.05599  299.6 -11.09910      25.24211 0.78 
1 1 1 27  11 18 o 73.72227 13.52374 98.30788  198.2 -4.061691      27.04749 0.93 
1 1 1 27  11 19 o 44.35436 12.74922 63.56602  46.6  -0.3058548     25.49844 0.82 
1 1 1 27  11 20 o 41.19028 12.83500 66.67130  284.1 ?              ?        0.83 
1 1 1 27  13 0  o 146.4555 3.950762 218.3316  118.4 2.259430       7.901525 0.98 
1 1 1 27  13 1  o 21.26162 7.137962 32.02671  7.1   0.4581661      14.27592 0.25 
1 1 1 27  13 2  o 69.41580 6.444184 163.5378  260.8 3.498940       12.88837 0.94 
1 1 1 27  13 3  o 101.0067 4.963800 140.2569  217.2 -34.10123      9.927601 0.95 
1 1 1 27  13 4  o 52.14899 8.061910 101.8790  154.3 2.845848       16.12382 0.84 
1 1 1 27  13 5  o 42.27705 9.217695 116.5049  185.4 10.30204       18.43539 0.82 
1 1 1 27  13 6  o 191.7823 4.018712 318.7770  219.2 -7.505096      8.037424 0.99 
1 1 1 27  13 7  o 51.82182 11.95522 61.33549  224.6 1.512810       23.91044 0.72 
1 1 1 27  13 8  o 130.5531 7.860799 187.0685  303.2 35.80374       15.72160 0.97 
1 1 1 27  13 9  o 72.41444 8.163261 134.2726  288.0 -20.66520      16.32652 0.94 
1 1 1 27  13 10 o 135.2145 4.676969 179.5619  43.2  -12.86600      9.353937 0.98 
1 1 1 27  13 11 o 148.3645 4.196643 194.0471  352.7 -2.402206      8.393287 0.99 
1 1 1 27  13 12 o 97.70012 5.886232 143.6026  250.7 -22.92601      11.77246 0.97 
1 1 1 27  13 13 o 75.69597 12.15101 120.9083  325.8 -26.21361      24.30203 0.95 
1 1 1 27  13 14 o 43.89057 10.98230 49.78486  156.5 7.983624       21.96459 0.78 
1 1 1 27  13 15 o 58.71552 10.77837 75.67948  104.3 -6.840210      21.55675 0.91 
1 1 1 27  13 16 o 40.46927 12.93609 30.81358  10.0  ?              ?        0.60 
1 1 1 27  13 17 x ?        ?        27.07256  315.1 ?              ?        0.00 
1 1 1 27  15 0  o 44.16283 10.02289 80.03414  242.6 -11.92342      20.04577 0.85 
1 1 1 27  15 1  o 102.1937 5.858466 208.2854  7.6   -1.121742      11.71693 0.98 
1 1 1 27  15 2  o 68.24509 8.403064 112.0892  14.1  -38.39607      16.80613 0.94 
1 1 1 27  15 3  o 85.58774 6.246096 148.9985  182.5 2.034943       12.49219 0.97 
1 1 1 27  15 4  o 218.4675 3.703608 313.1477  186.4 32.47461       7.407217 1.00 
1 1 1 27  15 5  o 36.69941 9.878786 50.92984  359.3 -10.59956      19.75757 0.77 
1 1 1 27  15 6  o 78.10771 6.607049 151.3819  339.1 6.040665       13.21410 0.97 
1 1 1 27  15 7  o 76.67161 9.159242 126.6058  295.1 24.64456       18.31848 0.96 
1 1 1 27  15 8  o 62.49438 9.967734 104.0662  298.0 35.80286       19.93547 0.94 
1 1 1 27  15 9  o 35.23394 10.36866 42.57983  233.2 -15.04207      20.73731 0.70 
1 1 1 27  15 10 o 92.14671 8.272769 168.4536  147.2 -15.96741      16.54554 0.98 
1 1 1 27  15 11 o 41.79316 10.59320 58.17682  140.1 ?              ?        0.84 
1 1 1 27  17 0  o 29.86717 9.757549 78.61649  176.7 ?              ?        0.86 
1 1 1 27  17 1  o 35.18018 10.73411 34.29600  60.7  ?              ?        0.67 
1 1 1 27  17 2  x ?        ?        52.10408  314.0 ?              ?        0.00 
1 1 1 28  0  0  o 484.6786 5.837578 239.5101  180.0 0.000000       0.000000 1.00 
1 1 1 28  0  1  o 174.5239 3.877520 243.6023  180.0 0.000000       0.000000 0.92 
1 1 1 28  0  2  o 59.81758 6.373102 175.0071  180.0 0.000000       0.000000 0.16 
1 1 1 28  0  3  o 154.1871 3.754529 82.67414  180.0 0.000000       0.000000 0.50 
1 1 1 28  0  4  o 114.4314 4.052927 470.5714  180.0 0.000000       0.000000 0.78 
1 1 1 28  0  5  o 243.6193 3.579667 388.0507  0.0   0.000000       0.000000 0.99 
1 1 1 28  0  6  o 179.8745 3.365092 241.3493  180.0 0.000000       0.000000 0.86 
1 1 1 28  0  7  o 46.93458 7.188124 111.7347  0.0   0.000000       0.000000 0.19 
1 1 1 28  0  8  o 118.3813 3.462687 61.32259  0.0   0.000000       0.000000 0.21 
1 1 1 28  0  9  o 220.9892 4.471637 413.9752  180.0 0.000000       0.000000 1.00 
1 1 1 28  0  10 o 712.3152 7.343903 1034.584  180.0 0.000000       0.000000 1.00 
1 1 1 28  0  11 o 313.8715 4.422666 420.2158  180.0 0.000000       0.000000 1.00 
1 1 1 28  0  12 o 38.48505 13.90207 183.2821  180.0 0.000000       0.000000 0.71 
1 1 1 28  0  13 o 212.8944 4.055809 193.9597  0.0   0.000000       0.000000 1.00 
1 1 1 28  0  14 o 184.7354 3.952071 232.9654  0.0   0.000000       0.000000 1.00 
1 1 1 28  0  15 o 38.39384 13.91691 91.12968  180.0 0.000000       0.000000 0.49 
1 1 1 28  0  16 o 109.1584 5.240633 128.0086  180.0 0.000000       0.000000 1.00 
1 1 1 28  0  17 o 65.47840 8.791042 113.1656  180.0 0.000000       0.000000 0.94 
1 1 1 28  0  18 o 223.9479 4.611472 407.4799  0.0   0.000000       0.000000 1.00 
1 1 1 28  0  19 o 56.88938 12.31253 123.3135  0.0   0.000000       0.000000 0.98 
1 1 1 28  0  20 o 135.0850 5.285030 195.5358  0.0   0.000000       0.000000 1.00 
1 1 1 28  0  21 o 73.47019 9.451655 53.73811  180.0 0.000000       0.000000 0.76 
1 1 1 28  0  22 o 95.36697 10.97344 135.7153  0.0   0.000000       0.000000 1.00 
1 1 1 28  0  23 o 82.20455 9.866984 82.08595  180.0 0.000000       0.000000 0.98 
1 1 1 28  0  24 o 28.95126 16.80967 107.3611  180.0 0.000000       0.000000 0.86 
1 1 1 28  0  25 o 47.79310 16.23621 94.97857  180.0 0.000000       0.000000 0.98 
1 1 1 28  0  26 o 119.8224 7.787269 152.3970  180.0 0.000000       0.000000 1.00 
1 1 1 28  0  27 o 42.43578 19.93285 89.53858  180.0 ?              ?        0.96 
1 1 1 28  2  0  o 131.4723 2.926458 195.9582  283.8 0.8048553      5.852915 0.80 
1 1 1 28  2  1  o 727.7935 5.655846 724.2517  83.5  -9.049744      11.31169 0.99 
1 1 1 28  2  2  o 396.9252 3.414003 785.9802  199.4 -6.982758      6.828007 0.97 
1 1 1 28  2  3  o 512.6284 4.864053 457.8028  193.4 6.578888       9.728106 0.97 
1 1 1 28  2  4  o 717.3807 5.136060 1001.445  169.0 -5.978821      10.27212 0.99 
1 1 1 28  2  5  f 366.8138 3.907533 570.2668  285.5 15.91727       7.815066 0.00 
1 1 1 28  2  6  o 159.9289 3.088332 262.7699  244.9 70.96810       6.176664 0.83 
1 1 1 28  2  7  o 275.0437 2.685173 456.1627  335.3 -15.33755      5.370346 0.95 
1 1 1 28  2  8  o 72.19250 4.296187 85.63888  221.2 2.062637       8.592375 0.39 
1 1 1 28  2  9  o 308.6265 2.976732 400.5337  352.9 9.322906       5.953464 0.97 
1 1 1 28  2  10 o 145.1454 2.690151 155.1455  307.8 37.06950       5.380302 0.83 
1 1 1 28  2  11 o 179.3344 2.902917 277.7021  163.6 -41.71362      5.805834 0.95 
1 1 1 28  2  12 o 252.4991 3.136487 319.9734  311.0 17.82948       6.272974 0.98 
1 1 1 28  2  13 o 159.6138 2.797942 219.9680  299.0 0.1203613      5.595884 0.95 
1 1 1 28  2  14 o 104.4227 3.719993 69.97653  304.7 -23.65511      7.439986 0.72 
1 1 1 28  2  15 o 189.4543 3.004215 182.0087  237.5 -5.100464      6.008430 0.96 
1 1 1 28  2  16 o 49.06381 7.401729 71.54436  151.1 -32.64291      14.80346 0.60 
1 1 1 28  2  17 o 137.1302 3.861047 173.0733  262.8 -9.071854      7.722095 0.96 
1 1 1 28  2  18 o 198.7448 3.177412 213.0400  179.5 -20.76712      6.354824 0.98 
1 1 1 28  2  19 o 116.0114 4.018867 126.0577  22.8  -7.973526      8.037734 0.95 
1 1 1 28  2  20 o 128.0243 4.651340 112.4931  121.2 20.74610       9.302679 0.93 
1 1 1 28  2  21 o 119.6053 4.220121 131.1405  219.2 -5.447884      8.440243 0.94 
1 1 1 28  2  22 o 75.50856 6.952758 127.8191  56.5  5.090286       13.90552 0.91 
1 1 1 28  2  23 o 40.06438 10.18205 23.74025  336.1 9.187164       20.36409 0.33 
1 1 1 28  2  24 o 57.17641 9.409980 112.2111  120.2 12.08834       18.81996 0.91 
1 1 1 28  2  25 o 47.56735 10.03646 51.58001  97.8  17.10666       20.07292 0.77 
1 1 1 28  2  26 o 78.41945 8.133755 57.55269  243.5 -15.30788      16.26751 0.90 
1 1 1 28  2  27 o 41.12873 11.85450 37.49566  142.4 ?              ?        0.66 
1 1 1 28  4  0  o 701.1873 5.385534 924.0233  74.2  22.56989       10.77107 0.99 
1 1 1 28  4  1  f 228.3717 3.027078 343.6875  160.6 -18.04753      6.054156 0.00 
1 1 1 28  4  2  o 242.3266 2.722902 408.8271  300.3 -41.16672      5.445805 0.93 
1 1 1 28  4  3  o 152.8311 2.597016 151.3601  130.0 -0.7498016     5.194032 0.65 
1 1 1 28  4  4  o 143.5661 2.775405 113.9729  45.8  31.88815       5.550810 0.57 
1 1 1 28  4  5  o 500.6763 4.358196 651.8705  337.3 22.23807       8.716392 0.98 
1 1 1 28  4  6  o 401.6572 3.663954 387.6045  290.8 -6.384796      7.327909 0.97 
1 1 1 28  4  7  o 349.4818 3.583210 479.6528  16.0  -31.35181      7.166421 0.97 
1 1 1 28  4  8  o 165.0591 2.623043 424.2962  79.1  1.583603       5.246087 0.95 
1 1 1 28  4  9  o 149.0979 2.911469 274.0075  69.6  6.053574       5.822939 0.93 
1 1 1 28  4  10 o 571.3456 4.727345 746.0604  230.9 -33.77692      9.454691 1.00 
1 1 1 28  4  11 o 30.21943 7.381110 36.41706  14.4  -10.14908      14.76222 0.17 
1 1 1 28  4  12 o 56.98473 5.572320 61.54372  36.6  -9.422451      11.14464 0.38 
1 1 1 28  4  13 o 107.5003 3.564582 189.4041  93.3  -9.131172      7.129164 0.92 
1 1 1 28  4  14 o 151.6231 3.330845 230.0503  93.3  -12.68370      6.661690 0.96 
1 1 1 28  4  15 o 184.7483 2.989274 223.4211  88.7  -1.862778      5.978548 0.97 
1 1 1 28  4  16 o 95.54010 4.348104 92.53064  125.1 2.532127       8.696207 0.87 
1 1 1 28  4  17 o 97.31728 4.829865 129.9068  109.4 39.63011       9.659731 0.93 
1 1 1 28  4  18 o 48.51151 9.144998 69.93920  354.9 18.50768       18.29000 0.76 
1 1 1 28  4  19 o 163.3618 3.709929 173.9408  92.9  -15.61810      7.419858 0.97 
1 1 1 28  4  20 o 39.21778 9.926993 60.28315  281.7 -1.846001      19.85399 0.51 
1 1 1 28  4  21 o 55.97604 8.811584 103.7248  167.7 -18.90475      17.62317 0.83 
1 1 1 28  4  22 o 214.1975 3.731941 250.8294  204.2 -3.639923      7.463883 0.99 
1 1 1 28  4  23 o 45.45261 10.13036 86.16331  120.6 -3.464523      20.26073 0.84 
1 1 1 28  4  24 o 27.05029 9.093456 52.69807  71.6  4.462385       18.18691 0.61 
1 1 1 28  4  25 o 37.26321 11.41647 56.71506  295.9 -9.825066      22.83294 0.72 
1 1 1 28  4  26 o 44.28470 12.33353 67.73602  183.9 ?              ?        0.83 
1 1 1 28  6  0  o 311.5667 3.006889 424.4998  299.7 -15.08139      6.013777 0.95 
1 1 1 28  6  1  o 531.0659 4.714656 755.5568  234.9 16.98773       9.429313 0.99 
1 1 1 28  6  2  f 185.6531 2.837168 496.4871  194.4 49.95438       5.674335 0.00 
1 1 1 28  6  3  o 129.4131 3.303062 20.02156  79.3  -13.65086      6.606123 0.31 
1 1 1 28  6  4  o 478.7225 4.486088 663.2176  314.8 11.08731       8.972176 0.99 
1 1 1 28  6  5  o 326.1207 3.059798 453.1639  298.6 -50.55093      6.119595 0.98 
1 1 1 28  6  6  o 136.4230 3.169558 341.5329  263.2 -30.52544      6.339116 0.94 
1 1 1 28  6  7  o 77.94180 4.257965 104.4417  69.5  21.40372       8.515930 0.62 
1 1 1 28  6  8  o 89.63080 4.552654 46.81068  310.8 28.12418       9.105308 0.51 
1 1 1 28  6  9  o 49.36567 7.043591 85.41784  353.8 -24.00312      14.08718 0.51 
1 1 1 28  6  10 o 142.0968 3.146345 231.5271  320.3 -1.032349      6.292690 0.95 
1 1 1 28  6  11 o 170.2503 2.920623 238.0035  219.8 7.452850       5.841246 0.96 
1 1 1 28  6  12 o 210.2181 3.035493 271.6936  72.2  16.20929       6.070987 0.98 
1 1 1 28  6  13 f 239.2067 3.029383 341.9959  107.1 -24.16322      6.058766 0.00 
1 1 1 28  6  14 o 131.9312 3.860047 143.1626  182.5 6.946899       7.720095 0.95 
1 1 1 28  6  15 o 61.37286 7.194820 100.9395  259.1 21.77214       14.38964 0.84 
1 1 1 28  6  16 o 119.7329 4.327628 158.3115  342.2 27.50474       8.655256 0.96 
1 1 1 28  6  17 o 41.09844 10.48431 27.60989  327.4 -15.66127      20.96861 0.33 
1 1 1 28  6  18 o 111.5887 6.695410 162.5567  307.8 ?              ?        0.95 
1 1 1 28  6  19 o 300.1656 4.391652 370.6485  349.1 4.996155       8.783304 0.99 
1 1 1 28  6  20 o 61.94116 10.65023 129.6314  343.9 17.02639       21.30046 0.89 
1 1 1 28  6  21 o 78.54151 8.371303 100.7907  79.5  -5.772522      16.74261 0.92 
1 1 1 28  6  22 o 108.2116 6.878066 118.8975  119.2 13.23534       13.75613 0.96 
1 1 1 28  6  23 o 49.09760 12.23485 95.80342  336.4 -3.596241      24.46971 0.89 
1 1 1 28  6  24 o 55.55427 10.85785 90.84334  295.4 32.48338       21.71569 0.90 
1 1 1 28  6  25 o 40.97673 12.06758 78.98822  288.7 ?              ?        0.85 
1 1 1 28  8  0  o 97.57744 3.660335 102.3501  152.7 1.316246       7.320669 0.70 
1 1 1 28  8  1  o 222.7188 3.055292 251.8576  237.1 -31.14610      6.110584 0.96 
1 1 1 28  8  2  o 311.3635 3.431593 492.5337  48.9  -9.831696      6.863186 0.99 
1 1 1 28  8  3  o 218.6248 3.162124 367.1833  4.5   -0.3794250     6.324249 0.98 
1 1 1 28  8  4  o 213.8815 3.459038 277.2259  70.8  8.187256       6.918077 0.97 
1 1 1 28  8  5  o 65.91937 6.222011 194.9539  302.0 0.6685715      12.44402 0.87 
1 1 1 28  8  6  o 163.2731 2.813951 181.8141  123.1 4.638672       5.627902 0.94 
1 1 1 28  8  7  o 50.82685 6.923521 76.29599  258.5 -5.622852      13.84704 0.54 
1 1 1 28  8  8  o 228.4010 3.314764 408.5804  8.4   22.55273       6.629528 0.99 
1 1 1 28  8  9  o 174.6195 3.124010 302.5845  29.6  12.86676       6.248020 0.98 
1 1 1 28  8  10 o 69.86515 6.039540 136.3647  30.8  21.68158       12.07908 0.88 
1 1 1 28  8  11 o 81.71851 5.280849 186.1248  163.4 2.151825       10.56170 0.93 
1 1 1 28  8  12 o 171.0502 3.383787 281.4842  171.1 -8.617661      6.767574 0.98 
1 1 1 28  8  13 f 50.17757 9.047384 96.45292  17.3  1.991364       18.09477 0.00 
1 1 1 28  8  14 f 150.0516 4.248303 224.3724  258.0 36.29768       8.496607 0.00 
1 1 1 28  8  15 o 188.6132 5.136079 250.8417  225.5 2.589661       10.27216 0.98 
1 1 1 28  8  16 o 181.3456 5.717921 228.1949  327.0 -9.711288      11.43584 0.98 
1 1 1 28  8  17 o 121.1536 6.305769 155.2999  296.0 12.25744       12.61154 0.96 
1 1 1 28  8  18 o 120.4709 7.430409 174.0115  239.1 14.80701       14.86082 0.97 
1 1 1 28  8  19 o 49.54411 9.980424 11.28511  213.2 35.24069       19.96085 0.23 
1 1 1 28  8  20 o 57.17251 10.54633 124.7291  307.3 35.75423       21.09267 0.93 
1 1 1 28  8  21 o 80.57268 11.97569 146.4383  294.5 11.68064       23.95137 0.96 
1 1 1 28  8  22 o 45.54460 12.55238 63.62372  253.7 11.63620       25.10477 0.81 
1 1 1 28  8  23 o 37.68933 12.05881 51.72354  217.7 -1.507866      24.11762 0.73 
1 1 1 28  8  24 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 28  10 0  o 270.5577 3.131430 433.3410  150.9 1.947723       6.262860 0.99 
1 1 1 28  10 1  o 124.2979 3.752558 173.1973  341.1 -2.400871      7.505116 0.94 
1 1 1 28  10 2  o 321.2059 3.262442 504.6992  291.5 -3.568878      6.524884 0.99 
1 1 1 28  10 3  o 85.64283 8.129745 130.3670  88.1  -34.75656      16.25949 0.89 
1 1 1 28  10 4  o 258.3984 4.152533 441.0224  130.5 20.52205       8.305065 0.99 
1 1 1 28  10 5  o 121.0371 5.032543 139.0875  116.6 51.71990       10.06509 0.94 
1 1 1 28  10 6  o 209.9012 4.040270 317.9518  139.9 20.27557       8.080541 0.99 
1 1 1 28  10 7  o 257.4807 4.058444 363.4659  89.7  7.208649       8.116888 0.99 
1 1 1 28  10 8  o 111.2521 4.312387 201.5787  38.0  -9.177055      8.624773 0.96 
1 1 1 28  10 9  o 27.33081 8.545913 45.54398  184.6 9.112640       17.09183 0.39 
1 1 1 28  10 10 o 73.52764 5.753650 88.99803  129.9 30.25271       11.50730 0.91 
1 1 1 28  10 11 o 96.17678 6.059974 118.0200  7.3   -25.41563      12.11995 0.94 
1 1 1 28  10 12 o 150.0215 4.544961 239.4247  17.0  -13.30968      9.089923 0.98 
1 1 1 28  10 13 o 105.8365 4.912267 124.2778  272.7 34.25059       9.824533 0.94 
1 1 1 28  10 14 o 58.77593 8.689916 104.7737  200.9 46.20924       17.37983 0.86 
1 1 1 28  10 15 f 76.08656 7.899922 89.51718  226.9 35.64103       15.79984 0.00 
1 1 1 28  10 16 o 56.91641 12.61215 43.66804  5.1   -0.5335960     25.22430 0.69 
1 1 1 28  10 17 o 121.7334 7.936790 160.8170  102.1 -2.285469      15.87358 0.98 
1 1 1 28  10 18 o 129.9705 7.710017 156.9933  123.9 -31.61051      15.42003 0.98 
1 1 1 28  10 19 o 40.30869 11.87553 52.81888  321.8 2.361557       23.75107 0.74 
1 1 1 28  10 20 o 61.62130 11.87017 90.31620  223.1 35.41274       23.74033 0.92 
1 1 1 28  10 21 o 37.74053 12.15208 69.52816  22.6  ?              ?        0.82 
1 1 1 28  12 0  o 186.6417 3.577523 348.4598  227.5 15.27475       7.155046 0.99 
1 1 1 28  12 1  o 150.4701 3.631508 294.0875  229.5 20.46071       7.263017 0.99 
1 1 1 28  12 2  o 44.23576 8.380363 49.96692  128.9 7.164684       16.76073 0.65 
1 1 1 28  12 3  o 68.59245 6.204052 59.58505  353.5 15.41259       12.40810 0.85 
1 1 1 28  12 4  o 57.58905 6.976815 91.08300  271.4 -0.4691315     13.95363 0.88 
1 1 1 28  12 5  o 92.77138 4.742259 161.0807  187.4 7.658195       9.484517 0.96 
1 1 1 28  12 6  f 79.99739 5.024373 107.2808  256.2 9.396614       10.04875 0.00 
1 1 1 28  12 7  f 96.09096 4.546515 89.42834  75.7  7.191704       9.093030 0.00 
1 1 1 28  12 8  o 94.42768 5.010805 124.2769  237.5 8.571564       10.02161 0.93 
1 1 1 28  12 9  o 49.03752 10.41994 70.72618  302.5 -25.17517      20.83989 0.73 
1 1 1 28  12 10 o 121.4422 4.928830 142.8221  37.4  3.711098       9.857659 0.96 
1 1 1 28  12 11 o 54.24613 10.21786 68.42249  333.4 11.45887       20.43571 0.80 
1 1 1 28  12 12 o 30.84864 9.584293 19.66933  135.2 0.2155876      19.16859 0.27 
1 1 1 28  12 13 o 136.0210 5.209574 209.7076  29.9  55.33358       10.41915 0.99 
1 1 1 28  12 14 o 103.7405 5.632716 162.1625  66.5  14.68876       11.26543 0.98 
1 1 1 28  12 15 o 93.59605 6.523309 89.83069  113.4 17.88712       13.04662 0.96 
1 1 1 28  12 16 o 106.8818 10.96775 157.0106  185.9 -1.288017      21.93550 0.97 
1 1 1 28  12 17 o 57.75910 13.26240 69.90707  150.5 14.35102       26.52479 0.88 
1 1 1 28  12 18 o 37.77515 11.73484 72.21884  299.3 ?              ?        0.84 
1 1 1 28  14 0  o 62.16044 8.269379 67.76002  236.8 -21.03529      16.53876 0.82 
1 1 1 28  14 1  o 56.21845 8.653380 117.0776  5.6   25.71090       17.30676 0.89 
1 1 1 28  14 2  o 69.61867 6.956154 114.5309  351.8 3.010712       13.91231 0.92 
1 1 1 28  14 3  o 114.4262 4.505380 153.6913  11.8  -13.23806      9.010760 0.97 
1 1 1 28  14 4  o 45.29725 9.793075 72.06193  112.3 8.059128       19.58615 0.80 
1 1 1 28  14 5  o 42.50632 9.205583 104.9781  83.5  18.86633       18.41117 0.88 
1 1 1 28  14 6  o 66.54399 7.401244 119.6154  98.3  14.94039       14.80249 0.94 
1 1 1 28  14 7  o 121.6498 4.244526 233.9778  68.1  18.36265       8.489052 0.99 
1 1 1 28  14 8  o 72.06297 8.638098 162.1161  18.7  62.30183       17.27620 0.97 
1 1 1 28  14 9  o 82.27281 7.888924 138.7835  303.5 14.01250       15.77785 0.97 
1 1 1 28  14 10 o 53.18227 10.03121 62.81090  191.0 10.65292       20.06241 0.87 
1 1 1 28  14 11 o 53.86193 11.11094 104.2298  348.5 12.75972       22.22187 0.92 
1 1 1 28  14 12 o 57.85992 11.64115 129.9828  312.2 0.2752647      23.28231 0.94 
1 1 1 28  14 13 o 30.32324 9.771559 55.68932  333.3 ?              ?        0.76 
1 1 1 28  14 14 x ?        ?        70.98627  234.8 ?              ?        0.00 
1 1 1 28  16 0  o 75.01012 8.757429 170.8836  212.4 2.408752       17.51486 0.97 
1 1 1 28  16 1  o 50.07281 11.12600 128.2025  261.3 4.671757       22.25200 0.94 
1 1 1 28  16 2  o 41.61616 10.38325 17.49306  179.9 -6.266277      20.76651 0.44 
1 1 1 28  16 3  o 29.56299 9.449990 34.41533  53.7  7.648172       18.89998 0.59 
1 1 1 28  16 4  o 69.13290 8.522171 93.61207  18.0  11.51258       17.04434 0.95 
1 1 1 28  16 5  o 61.92303 9.319283 124.8449  108.7 -31.04040      18.63857 0.96 
1 1 1 28  16 6  o 46.33672 10.72553 124.5116  188.3 ?              ?        0.94 
1 1 1 28  16 7  o 34.12699 9.427398 71.14837  191.8 ?              ?        0.87 
1 1 1 29  1  0  o 468.6646 4.131012 473.6216  267.6 32.47321       8.262025 0.97 
1 1 1 29  1  1  o 167.0711 2.633377 307.0501  292.5 19.69122       5.266753 0.83 
1 1 1 29  1  2  o 329.2655 3.353628 454.3011  171.9 3.058472       6.707255 0.94 
1 1 1 29  1  3  o 726.7471 5.320116 1191.276  99.4  36.24591       10.64023 0.99 
1 1 1 29  1  4  o 45.93965 6.125633 53.99350  334.3 29.14296       12.25127 0.04 
1 1 1 29  1  5  o 101.2702 3.234719 236.4267  10.3  50.06426       6.469439 0.66 
1 1 1 29  1  6  o 543.0134 3.874023 701.1074  172.0 -12.83844      7.748046 0.98 
1 1 1 29  1  7  o 49.71001 5.952508 142.9130  49.3  -27.86413      11.90502 0.32 
1 1 1 29  1  8  f 323.7208 2.960796 497.7422  82.6  4.187378       5.921593 0.00 
1 1 1 29  1  9  o 297.5808 2.949162 320.3093  319.0 -32.35577      5.898324 0.96 
1 1 1 29  1  10 o 104.2416 3.385197 227.6645  97.2  15.76404       6.770395 0.86 
1 1 1 29  1  11 o 378.7016 3.728440 631.2061  78.8  -2.141022      7.456880 0.99 
1 1 1 29  1  12 o 311.4045 3.214827 414.8916  40.6  -11.92657      6.429654 0.99 
1 1 1 29  1  13 o 167.8713 2.940190 252.9139  54.9  -17.33510      5.880379 0.96 
1 1 1 29  1  14 o 200.9682 2.938853 307.7791  318.0 -20.23090      5.877706 0.97 
1 1 1 29  1  15 o 98.59286 3.750535 141.5991  208.1 19.88338       7.501070 0.90 
1 1 1 29  1  16 o 91.60170 3.986226 146.2895  163.5 -9.384224      7.972451 0.91 
1 1 1 29  1  17 o 47.36169 7.658184 116.9356  278.8 31.36984       15.31637 0.78 
1 1 1 29  1  18 o 89.85832 4.488265 100.2768  222.9 12.68862       8.976529 0.91 
1 1 1 29  1  19 o 104.1441 5.275439 115.3237  281.8 -16.07127      10.55088 0.94 
1 1 1 29  1  20 o 33.60391 9.141212 107.1230  303.0 -7.341404      18.28242 0.66 
1 1 1 29  1  21 o 157.2751 3.920965 168.2798  257.4 2.786652       7.841930 0.96 
1 1 1 29  1  22 o 76.95358 7.051296 62.34163  289.4 18.16788       14.10259 0.81 
1 1 1 29  1  23 o 154.3880 3.948931 193.5646  229.2 -8.040649      7.897862 0.98 
1 1 1 29  1  24 o 72.66219 7.482273 122.2953  148.4 -18.59312      14.96455 0.94 
1 1 1 29  1  25 o 39.98442 10.42677 58.28222  137.9 6.873077       20.85353 0.75 
1 1 1 29  1  26 o 48.22715 10.61439 72.51929  174.4 1.785427       21.22877 0.85 
1 1 1 29  1  27 x ?        ?        43.33797  235.0 ?              ?        0.00 
1 1 1 29  3  0  o 259.3335 2.901634 364.8851  98.5  -36.31116      5.803269 0.89 
1 1 1 29  3  1  o 329.8880 4.008436 476.7772  147.8 -47.56299      8.016871 0.95 
1 1 1 29  3  2  o 155.1863 2.368068 87.35218  320.6 33.06670       4.736136 0.42 
1 1 1 29  3  3  f 375.0048 3.270562 524.1041  53.6  1.141327       6.541123 0.00 
1 1 1 29  3  4  o 401.5828 3.499082 564.2443  135.1 1.316864       6.998164 0.97 
1 1 1 29  3  5  o 622.3940 4.863978 739.3981  303.0 32.86957       9.727956 0.99 
1 1 1 29  3  6  o 317.5818 3.122747 444.1124  257.0 -2.315887      6.245493 0.96 
1 1 1 29  3  7  o 427.3759 3.826916 526.0511  359.3 -7.485962      7.653833 0.98 
1 1 1 29  3  8  o 56.95018 5.263352 85.80080  128.1 1.829201       10.52670 0.30 
1 1 1 29  3  9  o 106.4405 3.230307 103.0485  127.2 -1.055672      6.460614 0.69 
1 1 1 29  3  10 o 102.8667 3.182447 136.2942  210.9 3.085670       6.364893 0.81 
1 1 1 29  3  11 o 163.1982 2.761013 255.9232  217.8 -47.90298      5.522027 0.96 
1 1 1 29  3  12 o 169.5375 3.062964 207.0282  225.9 -17.64719      6.125929 0.95 
1 1 1 29  3  13 o 102.7133 3.828071 78.00442  83.8  -29.48532      7.656142 0.75 
1 1 1 29  3  14 o 237.5146 3.537861 309.7939  259.1 0.5039063      7.075723 0.98 
1 1 1 29  3  15 o 71.58701 5.552838 80.29790  271.3 17.93542       11.10568 0.77 
1 1 1 29  3  16 o 316.7364 3.437648 436.5384  31.0  -6.979370      6.875297 0.99 
1 1 1 29  3  17 f 54.58537 7.545604 100.2388  117.2 -6.908440      15.09121 0.00 
1 1 1 29  3  18 o 288.4232 3.365150 371.3347  200.2 -28.25922      6.730300 0.99 
1 1 1 29  3  19 o 156.0109 3.535122 169.6317  108.6 -26.61990      7.070244 0.97 
1 1 1 29  3  20 o 57.59407 8.204861 82.85687  125.7 -21.91260      16.40972 0.76 
1 1 1 29  3  21 o 59.28056 8.368589 71.12466  237.9 -26.70598      16.73718 0.75 
1 1 1 29  3  22 o 73.03884 6.693866 56.81148  243.4 15.88953       13.38773 0.81 
1 1 1 29  3  23 o 90.59309 6.460592 108.3928  330.1 6.223763       12.92118 0.94 
1 1 1 29  3  24 o 51.59914 9.808333 58.76501  282.9 -23.89389      19.61667 0.82 
1 1 1 29  3  25 o 61.39748 9.754154 109.2306  305.3 27.49068       19.50831 0.93 
1 1 1 29  3  26 o 32.60870 10.06659 53.49567  135.8 ?              ?        0.71 
1 1 1 29  5  0  o 489.6926 4.196187 521.8752  153.2 -73.31604      8.392375 0.98 
1 1 1 29  5  1  o 489.6981 3.921305 731.0173  351.8 43.46237       7.842609 0.98 
1 1 1 29  5  2  o 285.5143 2.731444 470.2840  296.5 -3.299805      5.462889 0.95 
1 1 1 29  5  3  o 155.4867 2.994927 148.2141  334.0 50.90540       5.989855 0.71 
1 1 1 29  5  4  o 422.2366 3.739380 465.2340  312.2 27.76147       7.478761 0.98 
1 1 1 29  5  5  o 490.4201 3.933816 722.2289  277.5 -40.64941      7.867632 0.99 
1 1 1 29  5  6  o 115.5143 3.482995 118.5180  143.0 3.100281       6.965990 0.68 
1 1 1 29  5  7  o 122.8936 3.100133 316.9307  253.4 2.792961       6.200265 0.93 
1 1 1 29  5  8  f 181.7324 3.125602 235.2384  125.0 45.13098       6.251204 0.00 
1 1 1 29  5  9  o 187.9853 3.002197 267.1541  144.4 -9.101730      6.004395 0.96 
1 1 1 29  5  10 o 286.8812 3.149930 449.7141  303.3 -15.32074      6.299860 0.99 
1 1 1 29  5  11 o 223.8514 2.825086 357.6898  19.8  -13.01909      5.650173 0.98 
1 1 1 29  5  12 o 353.4617 3.865929 537.7554  52.9  -5.094208      7.731858 0.99 
1 1 1 29  5  13 o 150.8296 3.193142 323.9439  49.0  -7.040604      6.386284 0.98 
1 1 1 29  5  14 o 28.41798 7.996448 48.69939  31.9  3.172417       15.99290 0.30 
1 1 1 29  5  15 o 96.20990 4.704927 169.2293  186.4 5.274666       9.409854 0.94 
1 1 1 29  5  16 f 160.9425 3.639777 275.4144  298.3 -12.10568      7.279554 0.00 
1 1 1 29  5  17 o 361.0226 3.744676 460.1728  327.5 2.553070       7.489351 1.00 
1 1 1 29  5  18 o 94.87538 5.373410 152.1335  325.6 -30.37594      10.74682 0.94 
1 1 1 29  5  19 o 46.68008 9.944551 79.17824  21.9  5.751369       19.88910 0.68 
1 1 1 29  5  20 o 49.32249 10.01543 97.35799  158.5 12.63680       20.03085 0.79 
1 1 1 29  5  21 o 40.28709 9.128831 48.42371  66.8  -14.43218      18.25766 0.58 
1 1 1 29  5  22 o 63.61282 11.27721 90.79248  70.7  -4.007912      22.55441 0.90 
1 1 1 29  5  23 o 57.52628 12.20799 71.31709  24.7  5.222725       24.41598 0.87 
1 1 1 29  5  24 o 76.94768 10.86749 104.4406  105.9 12.08915       21.73498 0.94 
1 1 1 29  5  25 o 39.92376 12.24557 18.89774  174.1 -18.27180      24.49113 0.38 
1 1 1 29  7  0  o 314.0258 3.394074 492.6339  57.2  12.95605       6.788149 0.98 
1 1 1 29  7  1  f 167.1181 2.995818 202.3288  246.5 -33.38052      5.991636 0.00 
1 1 1 29  7  2  o 234.3520 3.871236 167.0784  204.9 ?              ?        0.93 
1 1 1 29  7  3  o 110.0988 3.611855 262.3509  309.5 10.32767       7.223710 0.90 
1 1 1 29  7  4  f 220.9810 3.249021 203.8500  104.7 9.773148       6.498042 0.00 
1 1 1 29  7  5  o 160.2399 3.791966 303.0363  116.8 -32.45384      7.583933 0.97 
1 1 1 29  7  6  o 125.1528 3.842963 117.3243  117.5 21.84150       7.685927 0.87 
1 1 1 29  7  7  o 109.0143 3.517460 126.9927  254.2 -19.70096      7.034920 0.88 
1 1 1 29  7  8  o 235.1461 2.906773 300.8418  251.1 37.53346       5.813547 0.98 
1 1 1 29  7  9  o 154.8723 3.026184 165.4997  48.5  -15.33395      6.052368 0.94 
1 1 1 29  7  10 o 101.6480 3.847527 143.1224  105.2 0.3626862      7.695054 0.91 
1 1 1 29  7  11 o 153.5771 3.086327 139.7951  244.6 38.03038       6.172653 0.95 
1 1 1 29  7  12 o 129.1615 3.465943 166.5183  232.5 24.95114       6.931886 0.95 
1 1 1 29  7  13 o 226.9909 3.057220 379.0844  232.1 -18.14557      6.114441 0.99 
1 1 1 29  7  14 o 221.4951 3.281278 309.2450  170.3 17.05635       6.562555 0.99 
1 1 1 29  7  15 o 140.0868 3.943264 175.6767  236.9 31.21280       7.886529 0.97 
1 1 1 29  7  16 o 310.7055 5.345394 352.0828  321.9 -13.55826      10.69079 0.99 
1 1 1 29  7  17 o 159.5746 5.808084 231.3927  253.2 7.861877       11.61617 0.98 
1 1 1 29  7  18 o 230.5593 5.306809 270.7661  215.3 11.27823       10.61362 0.99 
1 1 1 29  7  19 o 59.07971 9.774010 125.0673  267.2 38.18794       19.54802 0.90 
1 1 1 29  7  20 o 42.14184 11.36604 79.02692  292.5 -0.5931892     22.73208 0.79 
1 1 1 29  7  21 o 59.04513 11.63151 104.6696  179.5 16.41861       23.26303 0.92 
1 1 1 29  7  22 o 42.23766 12.00952 35.44868  40.3  -18.17598      24.01904 0.61 
1 1 1 29  7  23 o 62.22620 12.17146 126.9104  6.3   14.29301       24.34292 0.94 
1 1 1 29  7  24 o 56.74412 13.68032 44.52531  255.3 ?              ?        0.80 
1 1 1 29  9  0  o 248.1222 3.152513 347.7510  316.7 -55.34921      6.305027 0.98 
1 1 1 29  9  1  o 199.7127 2.973945 332.6004  333.8 -14.10217      5.947889 0.98 
1 1 1 29  9  2  o 114.8132 3.575435 171.8497  323.6 -20.89015      7.150870 0.91 
1 1 1 29  9  3  o 39.68092 8.597639 102.2349  71.4  -4.296566      17.19528 0.50 
1 1 1 29  9  4  o 120.5750 4.087846 245.4361  153.4 21.85270       8.175693 0.95 
1 1 1 29  9  5  o 106.5204 4.362531 269.0369  327.9 19.74443       8.725061 0.96 
1 1 1 29  9  6  o 100.9358 4.153697 178.8152  19.7  5.325546       8.307394 0.94 
1 1 1 29  9  7  o 154.6339 3.125607 204.9384  102.1 7.960800       6.251215 0.97 
1 1 1 29  9  8  o 66.98462 5.625017 57.70375  213.1 -1.726059      11.25003 0.70 
1 1 1 29  9  9  o 247.5867 3.047809 323.4834  291.9 24.02029       6.095619 0.99 
1 1 1 29  9  10 o 166.7919 3.555065 246.1854  307.1 -10.73203      7.110130 0.98 
1 1 1 29  9  11 o 33.45202 8.632189 89.47730  326.4 -11.14689      17.26438 0.72 
1 1 1 29  9  12 o 85.37611 5.191981 134.6575  328.8 6.568245       10.38396 0.94 
1 1 1 29  9  13 o 96.75502 5.321476 179.8821  297.8 11.50089       10.64295 0.95 
1 1 1 29  9  14 o 132.4431 4.232068 175.9558  346.5 5.897812       8.464136 0.96 
1 1 1 29  9  15 o 91.31866 6.096967 148.8416  242.2 10.19938       12.19393 0.94 
1 1 1 29  9  16 o 87.84270 10.10384 120.7440  298.0 5.545425       20.20768 0.93 
1 1 1 29  9  17 o 73.43237 11.27215 54.20021  325.1 30.92347       22.54430 0.82 
1 1 1 29  9  18 o 74.98694 11.57926 89.93977  262.6 -11.83681      23.15852 0.92 
1 1 1 29  9  19 o 53.66504 12.37284 65.69127  266.2 12.35861       24.74569 0.85 
1 1 1 29  9  20 o 141.1469 7.952550 179.8647  267.3 -12.26787      15.90510 0.98 
1 1 1 29  9  21 o 66.51862 11.26076 124.2054  300.1 48.96892       22.52152 0.95 
1 1 1 29  9  22 o 51.21006 14.54254 6.390162  43.7  ?              ?        0.18 
1 1 1 29  11 0  o 202.6178 3.073301 307.8625  301.8 2.901093       6.146601 0.99 
1 1 1 29  11 1  o 137.8405 3.949535 257.4289  299.3 4.912369       7.899070 0.98 
1 1 1 29  11 2  o 46.85098 10.12757 95.37492  32.8  -6.793976      20.25515 0.76 
1 1 1 29  11 3  o 181.3347 4.210095 264.2013  167.1 -22.07112      8.420191 0.98 
1 1 1 29  11 4  o 214.5623 3.844759 367.2955  181.2 -15.30275      7.689518 0.99 
1 1 1 29  11 5  o 90.50229 5.065902 216.7755  137.5 10.41971       10.13180 0.96 
1 1 1 29  11 6  o 105.9431 4.772713 175.3205  282.4 -2.692589      9.545425 0.97 
1 1 1 29  11 7  o 27.12275 8.393952 62.01740  182.2 -0.9242878     16.78790 0.57 
1 1 1 29  11 8  o 28.43043 8.642126 24.60144  239.7 -2.233952      17.28425 0.24 
1 1 1 29  11 9  o 75.83105 6.028832 138.1549  298.2 5.947701       12.05766 0.92 
1 1 1 29  11 10 o 90.21067 6.627765 154.6236  337.8 -5.177246      13.25553 0.94 
1 1 1 29  11 11 o 107.4329 5.385483 92.88091  95.2  3.722145       10.77097 0.92 
1 1 1 29  11 12 o 85.38435 6.499735 165.8096  101.0 -7.291847      12.99947 0.95 
1 1 1 29  11 13 o 56.29716 9.352963 40.07358  12.8  37.75471       18.70593 0.66 
1 1 1 29  11 14 o 38.00922 9.837999 72.10223  209.8 14.49496       19.67600 0.77 
1 1 1 29  11 15 o 75.40527 8.983565 121.1231  15.8  -29.98627      17.96713 0.95 
1 1 1 29  11 16 f 90.63432 11.13807 140.7623  80.4  26.36839       22.27614 0.00 
1 1 1 29  11 17 o 68.64514 10.82431 115.4690  123.0 57.22517       21.64862 0.94 
1 1 1 29  11 18 o 47.64426 13.99630 40.69902  129.0 -9.933750      27.99260 0.70 
1 1 1 29  11 19 o 109.6743 8.339142 139.9946  71.1  ?              ?        0.98 
1 1 1 29  13 0  o 78.31548 5.565101 121.8984  263.4 14.60685       11.13020 0.92 
1 1 1 29  13 1  o 57.86506 8.212321 91.49551  198.2 27.01868       16.42464 0.84 
1 1 1 29  13 2  o 144.0255 3.778027 187.1541  108.9 27.61728       7.556053 0.97 
1 1 1 29  13 3  o 71.19702 7.021946 171.6578  7.6   -21.34082      14.04389 0.94 
1 1 1 29  13 4  o 98.79750 5.058569 119.2857  12.5  12.11735       10.11714 0.94 
1 1 1 29  13 5  o 49.05609 9.045434 129.4970  65.7  -9.577244      18.09087 0.88 
1 1 1 29  13 6  o 106.5620 5.108714 166.3255  112.5 5.645515       10.21743 0.96 
1 1 1 29  13 7  o 108.9822 5.689833 120.9730  26.9  -10.70822      11.37967 0.96 
1 1 1 29  13 8  o 48.61732 9.813214 94.20434  322.6 11.25180       19.62643 0.87 
1 1 1 29  13 9  o 64.48284 9.989149 135.5800  199.9 -12.26320      19.97830 0.94 
1 1 1 29  13 10 o 72.61902 8.543269 101.0168  151.5 3.640427       17.08654 0.94 
1 1 1 29  13 11 o 40.90562 10.78492 51.13717  40.2  0.2085037      21.56985 0.77 
1 1 1 29  13 12 o 34.70625 10.09068 47.30454  231.2 -2.955887      20.18136 0.71 
1 1 1 29  13 13 o 44.54275 10.62799 37.89785  22.0  5.079475       21.25599 0.70 
1 1 1 29  13 14 o 56.46047 10.18962 102.1419  8.5   24.60780       20.37923 0.93 
1 1 1 29  13 15 o 47.45038 11.08884 75.75553  1.9   ?              ?        0.89 
1 1 1 29  13 16 x ?        ?        24.37604  234.5 ?              ?        0.00 
1 1 1 29  15 0  o 62.71647 9.919228 63.34461  143.8 2.159557       19.83846 0.88 
1 1 1 29  15 1  o 103.8111 5.786649 97.82318  305.8 4.508812       11.57330 0.97 
1 1 1 29  15 2  o 74.42009 7.182784 140.0730  359.6 12.29434       14.36557 0.97 
1 1 1 29  15 3  o 113.0028 5.466787 200.4237  350.4 28.44836       10.93357 0.99 
1 1 1 29  15 4  o 72.71674 7.939079 109.1272  296.5 -21.76218      15.87816 0.96 
1 1 1 29  15 5  o 101.4795 5.462873 172.4090  156.7 29.89805       10.92575 0.98 
1 1 1 29  15 6  o 67.06605 7.959153 92.36069  128.4 13.86090       15.91831 0.94 
1 1 1 29  15 7  o 50.16453 9.273338 97.46875  48.3  27.61757       18.54668 0.92 
1 1 1 29  15 8  o 51.90766 9.488062 84.18977  343.4 -1.188797      18.97612 0.92 
1 1 1 29  15 9  o 97.34679 5.593347 161.2129  329.8 ?              ?        0.98 
1 1 1 29  15 10 o 41.07967 10.38503 60.64455  325.4 ?              ?        0.85 
1 1 1 30  0  0  o 182.5409 3.902024 198.0356  0.0   0.000000       0.000000 0.92 
1 1 1 30  0  1  o 222.5619 4.760546 197.8192  0.0   0.000000       0.000000 0.95 
1 1 1 30  0  2  f 211.0502 5.106019 49.27933  180.0 0.000000       0.000000 0.00 
1 1 1 30  0  3  o 451.1510 6.193116 298.4369  180.0 0.000000       0.000000 1.00 
1 1 1 30  0  4  o 515.5704 5.418355 589.3715  180.0 0.000000       0.000000 1.00 
1 1 1 30  0  5  o 135.4878 3.352574 142.8183  0.0   0.000000       0.000000 0.76 
1 1 1 30  0  6  o 212.0507 3.273442 275.7229  0.0   0.000000       0.000000 0.99 
1 1 1 30  0  7  o 625.0920 6.404556 720.7882  0.0   0.000000       0.000000 1.00 
1 1 1 30  0  8  o 321.4983 4.151385 383.9362  0.0   0.000000       0.000000 1.00 
1 1 1 30  0  9  o 216.6349 3.245152 353.4607  180.0 0.000000       0.000000 1.00 
1 1 1 30  0  10 o 80.50011 6.490722 76.92204  0.0   0.000000       0.000000 0.55 
1 1 1 30  0  11 o 274.0295 4.676986 468.5741  0.0   0.000000       0.000000 1.00 
1 1 1 30  0  12 o 88.39346 4.963327 192.7992  0.0   0.000000       0.000000 0.98 
1 1 1 30  0  13 o 117.1699 4.416476 142.2908  0.0   0.000000       0.000000 0.98 
1 1 1 30  0  14 o 96.94527 5.262212 139.1128  0.0   0.000000       0.000000 0.98 
1 1 1 30  0  15 o 118.7635 4.658874 134.7017  180.0 0.000000       0.000000 1.00 
1 1 1 30  0  16 o 58.06222 10.44822 159.1510  180.0 0.000000       0.000000 0.97 
1 1 1 30  0  17 o 72.03270 7.947593 24.98348  180.0 0.000000       0.000000 0.44 
1 1 1 30  0  18 o 262.2441 5.023771 334.6481  180.0 0.000000       0.000000 1.00 
1 1 1 30  0  19 o 233.5996 4.572973 296.6559  0.0   0.000000       0.000000 1.00 
1 1 1 30  0  20 o 95.33677 7.074718 127.0458  180.0 0.000000       0.000000 1.00 
1 1 1 30  0  21 f 134.4734 5.844348 140.3653  180.0 0.000000       0.000000 0.00 
1 1 1 30  0  22 o 79.70496 13.39399 65.05097  0.0   0.000000       0.000000 0.94 
1 1 1 30  0  23 o 50.54681 16.69453 47.71458  0.0   0.000000       0.000000 0.75 
1 1 1 30  0  24 o 24.02796 14.98460 2.205990  0.0   0.000000       0.000000 0.03 
1 1 1 30  0  25 o 61.32116 15.97937 124.0638  0.0   0.000000       0.000000 1.00 
1 1 1 30  0  26 o 25.24380 16.05785 111.8665  0.0   0.000000       0.000000 0.92 
1 1 1 30  2  0  o 450.4680 4.242436 543.7439  258.0 -25.95990      8.484872 0.97 
1 1 1 30  2  1  o 690.8702 5.260285 754.1357  260.7 8.551331       10.52057 0.99 
1 1 1 30  2  2  o 51.79626 4.951724 93.45549  294.2 -23.73431      9.903448 0.18 
1 1 1 30  2  3  o 535.7517 4.457314 679.0739  96.3  56.10818       8.914627 0.98 
1 1 1 30  2  4  o 455.6025 3.673056 520.2230  54.8  -22.06158      7.346112 0.97 
1 1 1 30  2  5  o 485.4835 3.832500 587.1006  246.9 -53.02591      7.665000 0.98 
1 1 1 30  2  6  o 197.9520 2.691599 291.4286  121.4 17.93820       5.383198 0.90 
1 1 1 30  2  7  f 533.0560 4.323530 647.2079  46.4  18.66882       8.647059 0.00 
1 1 1 30  2  8  o 419.3600 3.664897 630.7874  145.8 23.80435       7.329794 0.99 
1 1 1 30  2  9  o 147.0194 2.979808 86.79076  345.1 -9.141769      5.959617 0.76 
1 1 1 30  2  10 o 248.0839 2.708724 480.3770  54.2  -10.17206      5.417449 0.98 
1 1 1 30  2  11 o 116.6511 3.139989 161.8790  51.6  8.692253       6.279977 0.89 
1 1 1 30  2  12 o 252.5023 2.901057 377.6501  299.7 13.44864       5.802114 0.98 
1 1 1 30  2  13 o 70.06182 5.747579 97.91920  152.1 -6.903076      11.49516 0.69 
1 1 1 30  2  14 o 103.3229 4.259902 139.3607  222.6 33.93126       8.519804 0.90 
1 1 1 30  2  15 o 234.8000 3.120086 333.7896  135.8 12.42706       6.240172 0.99 
1 1 1 30  2  16 o 238.2618 3.681288 269.8670  1.2   -6.802689      7.362576 0.98 
1 1 1 30  2  17 o 126.8304 3.766722 152.8666  14.2  18.03883       7.533443 0.95 
1 1 1 30  2  18 o 48.89200 8.725308 62.93476  185.5 10.65545       17.45062 0.73 
1 1 1 30  2  19 o 68.92077 6.820715 70.37972  31.0  -5.828156      13.64143 0.78 
1 1 1 30  2  20 o 120.7757 4.225495 151.3430  27.2  -24.49634      8.450991 0.95 
1 1 1 30  2  21 o 81.69572 6.415310 39.13526  166.4 12.57953       12.83062 0.68 
1 1 1 30  2  22 o 40.21568 9.988331 62.59093  221.1 8.265842       19.97666 0.66 
1 1 1 30  2  23 o 98.64195 5.652389 90.51495  343.6 -0.7893753     11.30478 0.94 
1 1 1 30  2  24 o 34.31573 10.14955 26.56473  301.2 3.109905       20.29911 0.43 
1 1 1 30  2  25 o 64.66740 9.354745 71.86583  253.7 -4.302120      18.70949 0.89 
1 1 1 30  2  26 o 45.59655 11.20083 72.94322  157.3 ?              ?        0.86 
1 1 1 30  4  0  f 266.4115 2.914315 291.0911  160.3 -15.74664      5.828630 0.00 
1 1 1 30  4  1  o 620.4534 5.098723 746.7230  251.8 -34.23676      10.19745 0.99 
1 1 1 30  4  2  o 244.2572 2.756166 308.7295  266.5 2.285660       5.512331 0.91 
1 1 1 30  4  3  o 509.9338 4.156321 600.0684  311.4 7.601227       8.312641 0.98 
1 1 1 30  4  4  o 239.6135 2.952738 246.4165  102.5 -9.495529      5.905476 0.92 
1 1 1 30  4  5  o 524.3348 4.426016 620.1957  209.6 6.476379       8.852033 0.99 
1 1 1 30  4  6  o 231.0025 2.756797 173.5389  182.5 33.79425       5.513593 0.90 
1 1 1 30  4  7  o 283.4278 2.960420 465.9552  238.8 -22.48367      5.920840 0.97 
1 1 1 30  4  8  o 143.6436 2.872473 267.5555  281.6 -19.69682      5.744946 0.93 
1 1 1 30  4  9  o 75.52171 4.494105 98.21131  334.7 18.45698       8.988210 0.73 
1 1 1 30  4  10 o 141.0759 3.169836 217.9334  12.0  -23.59665      6.339673 0.94 
1 1 1 30  4  11 o 117.6814 4.620619 314.3894  238.7 -13.18501      9.241239 0.95 
1 1 1 30  4  12 o 147.8869 2.839239 170.7934  260.8 7.485077       5.678478 0.94 
1 1 1 30  4  13 o 111.3558 3.692869 269.9298  28.3  32.99134       7.385739 0.96 
1 1 1 30  4  14 o 145.4441 3.243457 143.1548  120.9 -12.25066      6.486914 0.95 
1 1 1 30  4  15 o 89.23161 5.186913 117.0599  178.0 -11.48507      10.37383 0.90 
1 1 1 30  4  16 o 187.7689 3.449667 192.6331  351.9 -9.464600      6.899333 0.98 
1 1 1 30  4  17 o 239.4714 3.360211 347.1012  305.5 21.78687       6.720423 0.99 
1 1 1 30  4  18 f 159.4008 3.668442 121.5136  34.5  15.28844       7.336884 0.00 
1 1 1 30  4  19 o 118.1378 4.276151 141.2699  77.2  15.70953       8.552301 0.94 
1 1 1 30  4  20 o 108.0493 5.395165 100.4375  59.6  -28.67965      10.79033 0.92 
1 1 1 30  4  21 o 44.67274 9.550106 28.71081  135.5 10.50407       19.10021 0.41 
1 1 1 30  4  22 o 80.36447 7.159812 110.7615  104.3 29.50272       14.31962 0.94 
1 1 1 30  4  23 o 34.47740 10.20788 64.30112  254.4 -4.792721      20.41577 0.75 
1 1 1 30  4  24 o 36.04771 10.27555 31.12405  55.4  4.579983       20.55109 0.50 
1 1 1 30  4  25 o 81.09624 7.286373 84.65670  38.5  -2.442162      14.57275 0.94 
1 1 1 30  4  26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 30  6  0  o 200.7731 2.823972 234.7964  275.3 11.61726       5.647944 0.89 
1 1 1 30  6  1  o 113.1750 4.731541 80.76435  190.9 11.40897       9.463082 0.52 
1 1 1 30  6  2  o 279.0926 4.298545 453.8351  268.2 3.308044       8.597090 0.97 
1 1 1 30  6  3  o 241.3438 3.790984 386.4701  276.0 52.35866       7.581968 0.96 
1 1 1 30  6  4  o 112.8023 3.728290 90.91592  359.3 2.459084       7.456579 0.77 
1 1 1 30  6  5  o 95.09750 4.203271 150.8292  47.9  -44.91898      8.406543 0.82 
1 1 1 30  6  6  o 300.6969 3.298582 390.6970  185.1 -16.56793      6.597164 0.98 
1 1 1 30  6  7  o 41.46287 7.599849 92.51297  273.1 22.46688       15.19970 0.53 
1 1 1 30  6  8  o 62.07413 5.906752 55.21651  179.4 1.161835       11.81350 0.52 
1 1 1 30  6  9  o 186.3122 2.881113 165.7992  16.9  1.079117       5.762226 0.94 
1 1 1 30  6  10 o 124.0006 3.383731 81.89377  40.3  -5.318443      6.767462 0.85 
1 1 1 30  6  11 o 61.57975 7.034433 140.7395  25.4  -28.41630      14.06887 0.84 
1 1 1 30  6  12 o 152.8836 3.362500 223.5953  215.9 2.337524       6.725000 0.97 
1 1 1 30  6  13 o 237.8629 3.116973 324.9109  269.2 -9.328186      6.233946 0.99 
1 1 1 30  6  14 f 272.2333 3.521015 385.8971  27.0  -18.98785      7.042031 0.00 
1 1 1 30  6  15 f 146.3322 3.762123 134.8235  270.9 0.1857758      7.524246 0.00 
1 1 1 30  6  16 o 138.2246 4.027043 231.3324  255.3 -0.7996979     8.054086 0.98 
1 1 1 30  6  17 o 199.6081 3.775071 261.2714  189.1 -20.05592      7.550141 0.98 
1 1 1 30  6  18 o 193.6658 3.752984 213.3798  188.4 2.594284       7.505967 0.98 
1 1 1 30  6  19 o 70.77049 9.368493 96.04813  225.9 -37.28360      18.73699 0.87 
1 1 1 30  6  20 o 91.93816 5.719298 101.7260  343.7 -0.7881546     11.43860 0.93 
1 1 1 30  6  21 f 57.18677 9.040884 83.89531  106.9 -16.49206      18.08177 0.00 
1 1 1 30  6  22 o 130.7322 6.850500 171.6610  124.9 33.68719       13.70100 0.98 
1 1 1 30  6  23 o 44.83212 11.56848 64.91154  40.6  10.00324       23.13696 0.81 
1 1 1 30  6  24 o 39.06770 10.94192 61.55938  52.8  ?              ?        0.80 
1 1 1 30  8  0  o 119.3983 3.331503 55.07456  306.8 -28.83937      6.663007 0.68 
1 1 1 30  8  1  o 268.7707 3.254744 342.5901  337.0 -40.68910      6.509489 0.98 
1 1 1 30  8  2  o 143.0397 3.454770 212.9603  286.2 -39.35678      6.909541 0.95 
1 1 1 30  8  3  o 114.0445 3.718689 160.0097  43.8  10.38095       7.437379 0.90 
1 1 1 30  8  4  o 45.86758 7.770151 48.51540  152.8 -21.22153      15.54030 0.29 
1 1 1 30  8  5  o 56.44412 7.684577 83.72246  138.3 -14.94045      15.36915 0.59 
1 1 1 30  8  6  o 101.1857 3.798151 182.4395  221.2 -3.600410      7.596303 0.92 
1 1 1 30  8  7  o 95.93065 4.246500 150.7758  259.4 -0.6399918     8.492999 0.91 
1 1 1 30  8  8  o 104.9759 3.748297 208.8712  208.3 26.47732       7.496594 0.95 
1 1 1 30  8  9  o 91.69624 4.339642 135.0342  243.1 16.16022       8.679283 0.92 
1 1 1 30  8  10 o 153.5788 3.094054 226.5417  30.9  -20.69347      6.188107 0.97 
1 1 1 30  8  11 o 87.86285 5.184612 116.8960  317.7 4.752281       10.36922 0.91 
1 1 1 30  8  12 o 43.82018 7.854565 32.55688  88.7  -28.94917      15.70913 0.43 
1 1 1 30  8  13 o 127.7806 3.750140 208.6691  121.4 23.14686       7.500280 0.98 
1 1 1 30  8  14 o 92.39859 5.072322 144.8643  88.0  1.512505       10.14464 0.94 
1 1 1 30  8  15 o 84.50536 6.127902 99.95633  221.4 -5.180916      12.25580 0.89 
1 1 1 30  8  16 o 101.3729 5.606551 153.4657  72.7  -1.137268      11.21310 0.95 
1 1 1 30  8  17 o 29.64606 9.732800 48.42606  101.5 -2.792284      19.46560 0.43 
1 1 1 30  8  18 o 142.5354 5.313000 185.8495  184.6 -16.12090      10.62600 0.98 
1 1 1 30  8  19 o 77.10792 11.02228 146.1686  65.6  18.94374       22.04457 0.95 
1 1 1 30  8  20 o 71.91107 13.11292 103.3706  110.5 8.358955       26.22585 0.93 
1 1 1 30  8  21 o 37.38326 11.57368 34.97932  51.4  3.447067       23.14736 0.56 
1 1 1 30  8  22 o 45.31913 12.72911 78.04156  53.8  2.893982       25.45821 0.86 
1 1 1 30  8  23 x ?        ?        36.45858  148.2 ?              ?        0.00 
1 1 1 30  10 0  o 57.43610 6.768562 65.56727  341.4 28.41561       13.53712 0.59 
1 1 1 30  10 1  o 139.5422 3.645280 221.4969  222.2 -2.329193      7.290559 0.97 
1 1 1 30  10 2  o 116.5090 4.745339 112.7672  339.6 11.26533       9.490679 0.92 
1 1 1 30  10 3  o 59.73492 7.560055 138.3958  217.6 0.6471176      15.12011 0.87 
1 1 1 30  10 4  o 166.1864 3.378295 284.7910  181.5 -35.52979      6.756591 0.98 
1 1 1 30  10 5  o 47.16079 8.922604 71.07398  287.4 -4.702606      17.84521 0.66 
1 1 1 30  10 6  o 254.2249 3.427078 420.1431  274.5 8.645416       6.854156 0.99 
1 1 1 30  10 7  o 61.52243 6.638765 52.84955  166.8 -4.479744      13.27753 0.71 
1 1 1 30  10 8  o 255.6721 3.150820 332.7120  20.7  2.493652       6.301641 0.99 
1 1 1 30  10 9  o 34.47829 9.808121 69.01669  294.3 -0.1763191     19.61624 0.68 
1 1 1 30  10 10 o 134.0878 4.098848 245.8979  208.7 -29.95874      8.197696 0.98 
1 1 1 30  10 11 o 114.0707 4.548121 204.4038  174.2 6.398750       9.096243 0.96 
1 1 1 30  10 12 o 79.64695 6.543052 74.77733  270.3 5.165039       13.08610 0.85 
1 1 1 30  10 13 o 81.96283 6.473806 94.27750  3.6   17.61059       12.94761 0.90 
1 1 1 30  10 14 o 41.50934 10.68635 8.697807  176.0 -3.343323      21.37269 0.12 
1 1 1 30  10 15 o 125.4358 5.340054 186.8089  229.5 4.163895       10.68011 0.98 
1 1 1 30  10 16 o 59.69731 12.15388 44.67605  96.9  24.53870       24.30777 0.76 
1 1 1 30  10 17 o 29.17154 9.897756 23.56347  342.6 -1.178272      19.79551 0.37 
1 1 1 30  10 18 o 47.27512 13.31870 30.63167  156.0 -19.97358      26.63740 0.59 
1 1 1 30  10 19 o 94.38392 8.961579 151.0337  123.3 -2.696518      17.92316 0.97 
1 1 1 30  10 20 o 65.49638 11.88920 96.51086  233.2 ?              ?        0.93 
1 1 1 30  12 0  o 96.55592 4.865059 144.7970  27.8  -5.479271      9.730118 0.96 
1 1 1 30  12 1  o 160.6404 3.601341 250.3221  167.0 15.56079       7.202682 0.99 
1 1 1 30  12 2  o 134.0134 4.047797 229.4995  114.1 21.90177       8.095593 0.98 
1 1 1 30  12 3  o 154.4301 3.574587 262.8162  71.7  -2.538132      7.149174 0.99 
1 1 1 30  12 4  o 64.32143 6.937100 140.8831  95.5  19.65478       13.87420 0.92 
1 1 1 30  12 5  o 95.63203 5.233780 110.4861  106.5 -5.939758      10.46756 0.93 
1 1 1 30  12 6  o 163.5877 4.222437 242.7057  87.0  21.40453       8.444874 0.98 
1 1 1 30  12 7  o 32.29577 8.534748 29.66352  312.7 22.74200       17.06950 0.30 
1 1 1 30  12 8  o 78.06403 6.075706 146.2012  223.2 13.17815       12.15141 0.94 
1 1 1 30  12 9  o 41.60347 10.16469 13.02778  163.6 -0.4019203     20.32937 0.19 
1 1 1 30  12 10 o 64.77153 8.215664 104.7676  326.9 -20.07881      16.43133 0.91 
1 1 1 30  12 11 o 52.39171 8.281834 127.3664  113.5 -37.52165      16.56367 0.92 
1 1 1 30  12 12 o 127.1284 5.240348 183.7830  197.6 10.21676       10.48070 0.98 
1 1 1 30  12 13 o 93.40634 6.529116 161.3505  272.7 5.038849       13.05823 0.98 
1 1 1 30  12 14 o 126.4373 5.117310 203.4385  11.2  4.369263       10.23462 0.99 
1 1 1 30  12 15 o 111.3859 6.428009 195.9193  29.0  3.051369       12.85602 0.98 
1 1 1 30  12 16 o 30.22462 9.425135 57.36797  225.4 7.153940       18.85027 0.74 
1 1 1 30  12 17 o 45.02169 13.23075 92.32590  261.8 ?              ?        0.89 
1 1 1 30  14 0  o 127.9303 4.708466 190.7881  280.0 -5.378006      9.416932 0.98 
1 1 1 30  14 1  o 74.51561 6.691511 122.3071  217.3 15.68483       13.38302 0.94 
1 1 1 30  14 2  o 148.2945 3.945126 268.3623  145.7 5.401276       7.890251 0.99 
1 1 1 30  14 3  o 61.47861 8.874140 124.2402  156.7 8.318913       17.74828 0.93 
1 1 1 30  14 4  o 76.29785 6.634679 110.1261  294.4 -2.833626      13.26936 0.95 
1 1 1 30  14 5  o 89.32044 5.607258 151.2079  247.9 33.06137       11.21452 0.97 
1 1 1 30  14 6  o 37.83117 8.978071 49.10067  227.9 -19.03409      17.95614 0.74 
1 1 1 30  14 7  o 30.15024 8.806146 84.37996  90.4  -11.87755      17.61229 0.84 
1 1 1 30  14 8  o 126.9327 4.531860 188.9176  81.9  7.996559       9.063720 0.99 
1 1 1 30  14 9  f 58.09328 8.687405 87.11501  41.9  -28.24099      17.37481 0.00 
1 1 1 30  14 10 f 48.27795 10.65188 66.81090  72.7  7.068882       21.30376 0.00 
1 1 1 30  14 11 o 136.0116 9.316480 224.9941  98.8  13.27119       18.63296 0.99 
1 1 1 30  14 12 o 32.88774 10.07536 92.48706  114.0 ?              ?        0.88 
1 1 1 30  14 13 x ?        ?        17.23516  124.9 ?              ?        0.00 
1 1 1 30  16 0  o 58.45584 10.24347 113.8441  46.5  -0.3842850     20.48693 0.94 
1 1 1 30  16 1  o 42.37243 10.70969 48.57557  323.5 17.33754       21.41937 0.79 
1 1 1 30  16 2  o 84.74171 7.911280 110.4720  192.9 -17.98047      15.82256 0.97 
1 1 1 30  16 3  o 30.28923 9.407102 35.46683  264.3 -7.492638      18.81420 0.63 
1 1 1 30  16 4  f 128.6066 5.392123 254.7740  341.1 ?              ?        0.00 
1 1 1 30  16 5  o 44.33134 9.908771 123.9925  329.4 ?              ?        0.94 
1 1 1 30  16 6  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 31  1  0  o 315.3298 3.570289 359.6952  93.4  16.85773       7.140579 0.93 
1 1 1 31  1  1  o 651.8438 5.739574 557.6204  257.0 1.826843       11.47915 0.98 
1 1 1 31  1  2  o 197.2881 2.993440 177.4504  137.1 32.21964       5.986880 0.82 
1 1 1 31  1  3  f 476.1406 4.006849 790.1129  149.4 34.88443       8.013698 0.00 
1 1 1 31  1  4  o 377.1922 3.438665 540.3030  60.3  -22.85822      6.877330 0.97 
1 1 1 31  1  5  o 206.9411 2.792249 283.6342  63.0  69.98914       5.584497 0.88 
1 1 1 31  1  6  o 611.9920 4.188381 851.4892  348.4 12.87463       8.376762 0.99 
1 1 1 31  1  7  o 184.0585 2.375286 237.0067  322.0 -10.24007      4.750573 0.90 
1 1 1 31  1  8  o 192.1994 2.288407 251.3633  165.7 27.14050       4.576815 0.92 
1 1 1 31  1  9  o 209.8611 2.581500 278.8528  224.6 22.71187       5.162999 0.95 
1 1 1 31  1  10 o 181.2520 3.025234 307.1273  53.2  -39.47446      6.050468 0.96 
1 1 1 31  1  11 o 196.2208 2.837925 284.3067  304.2 -22.85664      5.675849 0.97 
1 1 1 31  1  12 o 326.2293 3.469823 553.1024  216.2 10.44458       6.939646 0.99 
1 1 1 31  1  13 o 259.9590 3.338045 266.2722  154.5 -43.99689      6.676090 0.98 
1 1 1 31  1  14 o 132.1009 3.514281 274.2010  72.2  -23.04256      7.028562 0.96 
1 1 1 31  1  15 o 94.69797 4.587063 115.6762  78.6  24.96930       9.174127 0.89 
1 1 1 31  1  16 o 62.93919 5.752113 69.16252  74.0  -2.698368      11.50423 0.71 
1 1 1 31  1  17 o 225.1733 3.069350 230.2896  350.2 -20.53374      6.138700 0.98 
1 1 1 31  1  18 o 42.03213 9.337132 55.07758  10.2  5.689571       18.67426 0.60 
1 1 1 31  1  19 o 205.5818 3.925602 224.7620  61.3  -5.535690      7.851204 0.98 
1 1 1 31  1  20 o 85.14948 6.158785 69.16055  194.2 -15.01835      12.31757 0.82 
1 1 1 31  1  21 o 152.2912 3.611596 166.0566  162.0 27.78448       7.223193 0.97 
1 1 1 31  1  22 o 69.51739 9.204727 93.25220  131.9 16.71904       18.40945 0.89 
1 1 1 31  1  23 o 76.69406 6.685421 89.99966  334.2 0.4635086      13.37084 0.93 
1 1 1 31  1  24 o 120.3414 6.755401 125.0825  316.7 3.345764       13.51080 0.97 
1 1 1 31  1  25 o 30.09044 9.499332 15.93808  308.6 9.375103       18.99866 0.25 
1 1 1 31  1  26 o 34.01784 9.687699 28.76560  108.5 ?              ?        0.52 
1 1 1 31  3  0  o 521.4760 4.339885 812.8657  260.6 -36.69424      8.679770 0.98 
1 1 1 31  3  1  o 285.4776 3.258557 445.1280  187.5 -9.173340      6.517114 0.94 
1 1 1 31  3  2  o 350.0709 3.457335 437.9226  24.7  -22.54065      6.914671 0.96 
1 1 1 31  3  3  f 574.0463 4.442352 856.1487  290.4 -0.7034912     8.884705 0.00 
1 1 1 31  3  4  o 354.2051 3.090147 396.2296  347.7 -28.89075      6.180293 0.96 
1 1 1 31  3  5  o 193.3056 2.595461 236.7124  220.5 30.63428       5.190922 0.87 
1 1 1 31  3  6  o 205.7371 2.905281 209.0730  155.4 43.25305       5.810562 0.90 
1 1 1 31  3  7  o 152.1925 2.912853 195.4795  338.2 11.35670       5.825706 0.88 
1 1 1 31  3  8  o 217.0282 2.732371 370.5068  164.5 -11.35564      5.464742 0.97 
1 1 1 31  3  9  o 104.7758 3.844459 152.5308  49.6  -17.67313      7.688919 0.86 
1 1 1 31  3  10 o 217.5082 2.862625 229.9590  29.7  5.817886       5.725250 0.96 
1 1 1 31  3  11 o 104.2001 3.225657 137.3590  240.3 -5.931877      6.451314 0.86 
1 1 1 31  3  12 o 287.1207 2.879604 395.3947  330.1 -22.27444      5.759208 0.99 
1 1 1 31  3  13 o 49.11070 7.915583 85.85780  99.9  -3.789680      15.83117 0.61 
1 1 1 31  3  14 o 159.6721 3.136894 178.9266  128.4 -2.497040      6.273788 0.96 
1 1 1 31  3  15 o 266.6048 3.374670 277.5855  219.1 8.412201       6.749340 0.99 
1 1 1 31  3  16 o 69.74654 6.658387 72.37101  23.2  -22.07510      13.31677 0.80 
1 1 1 31  3  17 o 128.0118 4.253531 121.8343  268.3 1.729843       8.507062 0.96 
1 1 1 31  3  18 o 94.07724 5.180773 130.2024  16.2  5.687798       10.36155 0.93 
1 1 1 31  3  19 o 74.85455 6.677247 66.44760  70.8  30.09873       13.35449 0.77 
1 1 1 31  3  20 o 55.66047 9.229845 22.14051  118.6 19.09224       18.45969 0.32 
1 1 1 31  3  21 o 129.8697 4.303671 144.6928  141.8 35.72255       8.607342 0.96 
1 1 1 31  3  22 o 111.6232 5.211679 112.9006  42.0  1.729172       10.42336 0.96 
1 1 1 31  3  23 o 67.99149 8.914250 113.2427  319.0 -11.42481      17.82850 0.94 
1 1 1 31  3  24 o 59.78927 10.27124 79.15635  282.2 17.99923       20.54248 0.89 
1 1 1 31  3  25 f 94.43703 6.472445 75.47047  292.6 -9.840637      12.94489 0.00 
1 1 1 31  3  26 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 31  5  0  o 261.2339 2.780970 402.9113  217.1 2.690979       5.561939 0.94 
1 1 1 31  5  1  o 271.5824 2.962675 430.5333  5.8   -17.62891      5.925350 0.96 
1 1 1 31  5  2  o 270.9667 2.936468 233.1804  73.1  9.757019       5.872936 0.91 
1 1 1 31  5  3  f 93.66251 3.849916 190.5625  139.3 -17.10812      7.699832 0.00 
1 1 1 31  5  4  o 271.0787 2.906998 427.0515  189.1 -27.48639      5.813995 0.97 
1 1 1 31  5  5  o 171.7106 2.851515 283.2658  119.0 -15.56812      5.703030 0.94 
1 1 1 31  5  6  o 203.0609 2.724645 337.1178  182.2 12.06544       5.449291 0.96 
1 1 1 31  5  7  f 103.3837 3.583975 149.7802  252.9 -23.76730      7.167949 0.00 
1 1 1 31  5  8  o 58.91486 7.609762 54.71944  27.6  -38.16676      15.21952 0.39 
1 1 1 31  5  9  o 90.06566 4.145494 80.77030  181.7 -5.866814      8.290989 0.72 
1 1 1 31  5  10 o 107.2684 3.683230 166.0141  168.1 -15.72418      7.366460 0.90 
1 1 1 31  5  11 o 63.34903 6.511576 56.05165  144.3 -40.81762      13.02315 0.54 
1 1 1 31  5  12 o 126.5488 3.832429 175.9533  141.6 -28.95406      7.664857 0.95 
1 1 1 31  5  13 o 169.2539 3.240413 204.9787  160.5 -53.68387      6.480826 0.97 
1 1 1 31  5  14 o 67.93993 7.112376 104.8496  231.6 -24.34059      14.22475 0.84 
1 1 1 31  5  15 o 65.28892 6.388104 126.4601  170.0 -12.47473      12.77621 0.90 
1 1 1 31  5  16 o 172.9436 3.634487 222.1183  133.6 -9.092834      7.268973 0.98 
1 1 1 31  5  17 f 178.0350 3.577581 148.9379  178.6 -8.459366      7.155162 0.00 
1 1 1 31  5  18 o 88.30476 5.986152 99.06563  353.3 12.36736       11.97230 0.89 
1 1 1 31  5  19 o 97.77945 5.321260 109.4521  31.9  33.12608       10.64252 0.92 
1 1 1 31  5  20 o 35.04727 9.495362 47.27277  193.4 12.44180       18.99072 0.51 
1 1 1 31  5  21 o 92.09239 6.367657 124.8811  160.4 30.40213       12.73531 0.95 
1 1 1 31  5  22 o 127.9298 5.164325 171.7130  64.6  6.092690       10.32865 0.98 
1 1 1 31  5  23 o 125.2883 4.843162 185.6002  328.5 6.694351       9.686323 0.98 
1 1 1 31  5  24 o 46.75661 10.26031 59.54778  344.2 23.33459       20.52063 0.82 
1 1 1 31  5  25 x ?        ?        63.29330  23.9  ?              ?        0.00 
1 1 1 31  7  0  o 148.7561 3.293594 175.3974  84.0  -44.18298      6.587188 0.88 
1 1 1 31  7  1  o 181.3546 3.177916 387.6741  190.5 11.39645       6.355832 0.97 
1 1 1 31  7  2  o 43.70298 7.727761 77.05959  201.0 -3.796730      15.45552 0.33 
1 1 1 31  7  3  o 62.20853 6.498610 204.2559  55.2  -16.77506      12.99722 0.86 
1 1 1 31  7  4  o 175.4399 3.344190 178.1774  262.7 25.06212       6.688379 0.95 
1 1 1 31  7  5  o 74.89508 4.761150 139.3104  207.9 -0.3004379     9.522300 0.81 
1 1 1 31  7  6  o 177.3390 2.920518 276.1465  22.5  -21.80785      5.841035 0.97 
1 1 1 31  7  7  o 169.3723 2.968268 293.3742  36.2  13.70033       5.936536 0.97 
1 1 1 31  7  8  o 58.90918 6.590654 79.54308  124.7 -15.75348      13.18131 0.63 
1 1 1 31  7  9  o 136.7464 3.338696 225.4764  198.0 9.556686       6.677393 0.96 
1 1 1 31  7  10 o 210.6606 2.968321 255.2951  17.6  7.775284       5.936642 0.98 
1 1 1 31  7  11 o 153.5352 3.262022 198.6918  69.1  -3.746078      6.524044 0.97 
1 1 1 31  7  12 o 125.8358 3.949469 170.6042  241.9 -13.34035      7.898938 0.96 
1 1 1 31  7  13 f 151.0994 3.708192 115.7242  24.7  0.4707794      7.416384 0.00 
1 1 1 31  7  14 o 54.41089 8.178826 85.73254  63.0  -7.974663      16.35765 0.83 
1 1 1 31  7  15 o 120.2189 4.759907 163.4619  202.7 5.978630       9.519814 0.96 
1 1 1 31  7  16 o 38.08394 9.988326 27.08599  200.4 4.288429       19.97665 0.26 
1 1 1 31  7  17 o 55.55436 8.987582 93.74513  113.7 28.79549       17.97516 0.82 
1 1 1 31  7  18 o 196.2708 3.973078 229.9795  109.9 6.671127       7.946156 0.99 
1 1 1 31  7  19 f 40.46795 10.54359 58.99382  353.7 2.860744       21.08718 0.00 
1 1 1 31  7  20 o 62.52829 9.359584 119.2654  78.6  11.85516       18.71917 0.93 
1 1 1 31  7  21 o 101.5354 6.357401 125.4625  147.2 9.527733       12.71480 0.97 
1 1 1 31  7  22 o 39.03481 12.02218 87.36692  143.2 -5.448788      24.04436 0.85 
1 1 1 31  7  23 o 61.27858 13.47848 88.87791  46.6  ?              ?        0.91 
1 1 1 31  9  0  o 208.3040 3.418338 447.4058  161.2 -30.80237      6.836676 0.98 
1 1 1 31  9  1  o 174.3956 3.380435 202.1249  95.5  29.16553       6.760870 0.96 
1 1 1 31  9  2  o 103.4395 3.782497 175.8522  356.2 -6.864769      7.564995 0.92 
1 1 1 31  9  3  o 99.19292 4.455514 138.7943  223.4 -16.78524      8.911028 0.90 
1 1 1 31  9  4  o 143.1422 3.796527 301.2148  233.0 -11.91272      7.593054 0.97 
1 1 1 31  9  5  o 70.23204 5.829737 97.02131  272.8 -2.143272      11.65947 0.83 
1 1 1 31  9  6  o 193.1320 3.603149 304.7871  290.7 -5.761703      7.206298 0.98 
1 1 1 31  9  7  o 108.3847 4.365749 177.7072  12.3  -8.596024      8.731498 0.95 
1 1 1 31  9  8  o 203.6184 3.378944 356.5794  22.9  3.142441       6.757889 0.99 
1 1 1 31  9  9  o 71.55795 5.979749 64.46609  228.0 -11.79562      11.95950 0.81 
1 1 1 31  9  10 o 220.9224 3.137327 273.8141  179.4 -12.90236      6.274655 0.99 
1 1 1 31  9  11 o 51.03836 8.051439 119.8949  221.6 -30.36466      16.10288 0.88 
1 1 1 31  9  12 o 130.4048 4.077512 241.3547  232.4 -4.959007      8.155024 0.97 
1 1 1 31  9  13 o 93.53711 5.348676 148.1087  151.9 18.72501       10.69735 0.94 
1 1 1 31  9  14 o 98.66806 5.710740 154.7969  49.8  -4.315773      11.42148 0.95 
1 1 1 31  9  15 o 105.7574 5.107152 156.1845  63.9  16.36446       10.21430 0.96 
1 1 1 31  9  16 o 175.8755 4.900407 247.7218  83.0  -14.87384      9.800814 0.99 
1 1 1 31  9  17 o 39.89815 12.26834 95.42450  15.6  -12.69191      24.53667 0.84 
1 1 1 31  9  18 o 43.15598 11.81114 30.94459  308.9 9.489899       23.62227 0.58 
1 1 1 31  9  19 o 123.3969 7.360122 158.9933  91.5  -17.45329      14.72024 0.98 
1 1 1 31  9  20 o 65.31324 14.01529 68.58508  261.9 -29.87652      28.03057 0.88 
1 1 1 31  9  21 o 43.07854 12.97615 81.59222  329.1 ?              ?        0.87 
1 1 1 31  11 0  o 121.5520 3.905125 145.9835  254.2 7.987740       7.810249 0.95 
1 1 1 31  11 1  o 159.5865 4.506191 212.9960  212.5 21.02925       9.012382 0.98 
1 1 1 31  11 2  o 49.09249 9.547023 132.7240  135.1 -12.51633      19.09405 0.87 
1 1 1 31  11 3  o 92.85036 5.131389 104.2173  126.3 -11.07897      10.26278 0.93 
1 1 1 31  11 4  f 39.08860 8.464408 40.80939  107.3 -23.54925      16.92882 0.00 
1 1 1 31  11 5  o 40.36194 9.293110 39.59338  307.8 -8.305893      18.58622 0.56 
1 1 1 31  11 6  o 107.5355 5.022730 165.9465  78.8  14.43970       10.04546 0.96 
1 1 1 31  11 7  o 114.0049 4.835958 148.5314  117.8 5.468231       9.671916 0.96 
1 1 1 31  11 8  o 100.3655 4.656416 136.7493  154.0 14.58981       9.312833 0.94 
1 1 1 31  11 9  o 90.45819 5.986514 132.9503  318.6 -7.300255      11.97303 0.93 
1 1 1 31  11 10 o 275.0412 3.621124 383.7881  334.6 11.91241       7.242248 0.99 
1 1 1 31  11 11 o 115.1704 4.550857 222.5222  27.6  -0.3810730     9.101713 0.97 
1 1 1 31  11 12 o 92.92740 7.356682 140.0641  193.1 -42.22060      14.71336 0.95 
1 1 1 31  11 13 o 92.09946 6.429267 143.9729  165.5 3.847069       12.85853 0.96 
1 1 1 31  11 14 f 73.43896 9.397061 66.58028  350.9 -19.46894      18.79412 0.00 
1 1 1 31  11 15 o 50.72407 10.56892 77.55089  251.8 30.44654       21.13785 0.88 
1 1 1 31  11 16 o 50.80645 11.70388 92.39874  294.7 24.96116       23.40777 0.90 
1 1 1 31  11 17 o 39.45023 12.32346 88.09896  306.5 -1.719090      24.64692 0.86 
1 1 1 31  11 18 o 63.47516 13.53499 85.06393  127.8 ?              ?        0.91 
1 1 1 31  13 0  o 82.25900 5.923448 138.6178  207.7 5.147224       11.84690 0.93 
1 1 1 31  13 1  o 40.41933 8.884576 175.1766  168.6 -15.68151      17.76915 0.89 
1 1 1 31  13 2  o 202.1850 3.631925 336.6305  48.1  -24.09583      7.263851 0.99 
1 1 1 31  13 3  o 150.3959 3.780182 234.7388  88.9  -6.070724      7.560363 0.98 
1 1 1 31  13 4  o 148.7335 4.044088 244.0401  251.1 -2.628387      8.088177 0.98 
1 1 1 31  13 5  o 110.6470 5.102179 170.0291  272.5 -3.041595      10.20436 0.97 
1 1 1 31  13 6  o 173.4100 4.162440 250.9887  106.1 10.52692       8.324880 0.99 
1 1 1 31  13 7  o 37.46630 9.169228 24.90423  1.9   -13.95732      18.33846 0.41 
1 1 1 31  13 8  o 56.41583 8.786960 102.5635  23.2  -18.54155      17.57392 0.92 
1 1 1 31  13 9  o 89.64662 6.716362 135.8127  95.2  4.804153       13.43272 0.97 
1 1 1 31  13 10 o 129.8812 4.387109 170.2166  192.6 40.56394       8.774219 0.99 
1 1 1 31  13 11 o 102.6221 5.404121 168.4645  112.8 17.59073       10.80824 0.98 
1 1 1 31  13 12 o 81.58136 6.940567 117.2451  62.3  -13.71447      13.88113 0.96 
1 1 1 31  13 13 o 33.33603 9.872580 52.92373  201.8 21.00410       19.74516 0.75 
1 1 1 31  13 14 o 35.73513 10.51539 35.07837  185.9 ?              ?        0.65 
1 1 1 31  13 15 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 31  15 0  o 36.70580 9.870446 84.70847  215.0 12.14085       19.74089 0.87 
1 1 1 31  15 1  o 67.01579 9.194801 106.9972  155.4 19.27390       18.38960 0.95 
1 1 1 31  15 2  o 49.26472 9.739493 126.0926  68.9  21.14965       19.47899 0.94 
1 1 1 31  15 3  o 64.77153 8.873456 96.73350  33.3  -10.21738      17.74691 0.94 
1 1 1 31  15 4  o 40.00251 10.46481 85.52123  296.2 4.460724       20.92962 0.88 
1 1 1 31  15 5  o 116.0381 4.880510 213.4498  238.0 -2.633301      9.761021 0.99 
1 1 1 31  15 6  o 54.87193 9.671177 102.3363  138.1 -6.288528      19.34235 0.93 
1 1 1 31  15 7  o 28.17956 8.697055 44.82391  72.8  4.517611       17.39411 0.68 
1 1 1 31  15 8  o 27.18219 8.737231 84.80975  266.3 ?              ?        0.85 
1 1 1 31  15 9  o 54.02960 9.282686 98.19646  270.4 ?              ?        0.94 
1 1 1 32  0  0  o 145.3957 4.475032 400.4139  0.0   0.000000       0.000000 0.95 
1 1 1 32  0  1  o 92.08474 6.041709 89.57951  0.0   0.000000       0.000000 0.50 
1 1 1 32  0  2  o 804.5010 8.891328 900.8665  0.0   0.000000       0.000000 1.00 
1 1 1 32  0  3  o 74.52473 5.797840 168.1322  180.0 0.000000       0.000000 0.47 
1 1 1 32  0  4  o 341.9728 4.996149 361.5161  0.0   0.000000       0.000000 1.00 
1 1 1 32  0  5  o 92.12115 4.072286 71.10923  180.0 0.000000       0.000000 0.35 
1 1 1 32  0  6  o 98.41019 4.448197 255.0861  180.0 0.000000       0.000000 0.88 
1 1 1 32  0  7  o 315.3333 3.922055 474.2410  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  8  o 61.24638 5.910342 65.30341  0.0   0.000000       0.000000 0.26 
1 1 1 32  0  9  o 132.2296 3.841263 271.9998  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  10 o 110.7471 4.757406 52.62355  180.0 0.000000       0.000000 0.73 
1 1 1 32  0  11 o 196.5560 4.121913 200.1150  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  12 o 295.9386 4.239702 484.5977  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  13 o 163.5956 4.465567 282.3912  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  14 o 176.1288 4.044709 254.3654  0.0   0.000000       0.000000 1.00 
1 1 1 32  0  15 f 56.40640 12.02944 66.45229  180.0 0.000000       0.000000 0.00 
1 1 1 32  0  16 o 27.63655 15.02956 63.10257  180.0 0.000000       0.000000 0.41 
1 1 1 32  0  17 o 93.77449 7.491747 37.39975  180.0 0.000000       0.000000 0.84 
1 1 1 32  0  18 o 16.48394 11.44529 27.29830  0.0   0.000000       0.000000 0.13 
1 1 1 32  0  19 o 126.4748 6.006648 186.0568  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  20 o 137.5462 6.497513 190.5762  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  21 f 63.03739 16.52999 99.49145  180.0 0.000000       0.000000 0.00 
1 1 1 32  0  22 o 23.15416 15.14725 27.00543  180.0 0.000000       0.000000 0.25 
1 1 1 32  0  23 o 62.88074 14.83368 80.80137  180.0 0.000000       0.000000 0.99 
1 1 1 32  0  24 o 18.26993 13.00628 1.579874  0.0   0.000000       0.000000 0.02 
1 1 1 32  0  25 o 88.86565 10.98515 101.2553  180.0 0.000000       0.000000 1.00 
1 1 1 32  0  26 x ?        ?        28.24365  180.0 ?              ?        0.00 
1 1 1 32  2  0  f 599.9485 5.243160 723.6606  68.8  20.45313       10.48632 0.00 
1 1 1 32  2  1  o 735.1024 5.766009 1026.577  68.7  -21.53943      11.53202 0.99 
1 1 1 32  2  2  o 362.0885 3.264141 603.0001  286.0 -7.256744      6.528282 0.97 
1 1 1 32  2  3  o 522.4378 4.099578 534.4893  232.4 44.65662       8.199157 0.98 
1 1 1 32  2  4  o 273.8637 2.994438 382.7606  229.3 36.33141       5.988876 0.94 
1 1 1 32  2  5  o 198.5775 2.583447 185.4154  258.1 40.88258       5.166894 0.85 
1 1 1 32  2  6  o 322.6131 2.812822 326.8247  334.4 14.89941       5.625645 0.96 
1 1 1 32  2  7  o 163.3401 2.554986 107.3614  274.8 49.74486       5.109972 0.79 
1 1 1 32  2  8  f 221.9970 2.714667 225.4427  95.5  1.125351       5.429334 0.00 
1 1 1 32  2  9  o 230.5713 2.771465 205.9722  302.2 20.62393       5.542929 0.96 
1 1 1 32  2  10 o 277.9990 2.838019 467.7500  149.3 29.10239       5.676037 0.99 
1 1 1 32  2  11 o 48.42919 6.084313 48.42570  103.5 49.48489       12.16863 0.35 
1 1 1 32  2  12 o 91.73677 3.913870 89.93642  328.7 8.130791       7.827739 0.77 
1 1 1 32  2  13 o 133.9821 3.351453 128.1838  161.2 24.25661       6.702905 0.92 
1 1 1 32  2  14 o 176.1635 3.331543 287.2054  127.8 16.76257       6.663086 0.98 
1 1 1 32  2  15 o 141.2439 3.490422 136.4861  164.9 15.17322       6.980844 0.94 
1 1 1 32  2  16 o 181.1642 3.653835 253.3140  117.0 26.96968       7.307671 0.98 
1 1 1 32  2  17 o 99.80976 4.906890 141.4960  90.0  17.63539       9.813781 0.95 
1 1 1 32  2  18 o 71.72710 6.400285 134.2320  348.5 -19.19043      12.80057 0.90 
1 1 1 32  2  19 o 63.62406 7.245733 99.81324  22.6  12.78376       14.49147 0.83 
1 1 1 32  2  20 o 33.09346 9.454655 73.63202  18.2  -8.254053      18.90931 0.56 
1 1 1 32  2  21 o 65.75150 8.105494 50.28595  75.9  3.908161       16.21099 0.75 
1 1 1 32  2  22 o 26.88326 8.534383 8.462913  236.8 8.246601       17.06877 0.10 
1 1 1 32  2  23 o 61.43506 9.935433 92.74371  287.0 2.451927       19.87087 0.91 
1 1 1 32  2  24 o 56.09572 10.36189 83.97061  349.8 7.595684       20.72378 0.89 
1 1 1 32  2  25 o 67.94162 8.237964 79.04158  256.8 2.420357       16.47593 0.92 
1 1 1 32  4  0  f 732.3362 5.356666 762.0627  278.2 -42.52966      10.71333 0.00 
1 1 1 32  4  1  o 533.0476 4.379913 647.4180  86.7  -3.992981      8.759827 0.98 
1 1 1 32  4  2  o 417.5683 3.658883 432.9110  64.6  21.19678       7.317766 0.97 
1 1 1 32  4  3  o 632.0920 4.680866 870.1833  250.6 -31.67578      9.361732 0.99 
1 1 1 32  4  4  o 211.5097 2.574848 363.2400  78.6  9.673767       5.149697 0.94 
1 1 1 32  4  5  o 474.3847 3.939532 676.0248  68.1  -7.422058      7.879065 0.99 
1 1 1 32  4  6  o 203.4182 2.889285 257.3814  256.7 -35.39252      5.778570 0.94 
1 1 1 32  4  7  o 145.6024 3.063885 166.9081  196.8 -36.71971      6.127769 0.92 
1 1 1 32  4  8  o 296.0176 3.311111 356.2888  179.2 -43.60120      6.622222 0.98 
1 1 1 32  4  9  o 131.5742 3.104265 154.1445  232.4 -18.14455      6.208530 0.91 
1 1 1 32  4  10 o 95.51436 4.276101 83.98099  357.1 34.51160       8.552201 0.78 
1 1 1 32  4  11 o 100.9798 4.966979 83.48706  146.0 -27.18301      9.933958 0.78 
1 1 1 32  4  12 f 95.33176 4.212131 140.0047  10.1  29.75169       8.424262 0.00 
1 1 1 32  4  13 o 238.3539 3.101782 286.2970  166.6 -4.386002      6.203564 0.98 
1 1 1 32  4  14 o 109.3973 4.160182 152.6806  273.1 -6.965630      8.320363 0.94 
1 1 1 32  4  15 o 99.88566 4.760064 98.19130  269.1 -6.364807      9.520128 0.91 
1 1 1 32  4  16 o 188.9550 3.596419 267.6854  178.0 9.912598       7.192839 0.99 
1 1 1 32  4  17 o 96.07681 5.057588 82.11871  150.3 31.21584       10.11518 0.88 
1 1 1 32  4  18 o 183.7083 3.663118 201.6003  193.6 2.018906       7.326236 0.97 
1 1 1 32  4  19 o 36.08304 9.486514 38.19402  254.4 -15.91051      18.97303 0.36 
1 1 1 32  4  20 o 98.09145 5.118636 96.76981  330.3 28.51709       10.23727 0.92 
1 1 1 32  4  21 o 87.99123 6.496444 117.6746  80.7  -18.99079      12.99289 0.95 
1 1 1 32  4  22 o 165.7376 4.430106 214.3393  42.0  -2.995758      8.860212 0.99 
1 1 1 32  4  23 o 52.49682 10.11744 76.95528  295.1 0.1376343      20.23489 0.87 
1 1 1 32  4  24 o 44.28843 9.752419 26.30616  106.1 35.10733       19.50484 0.55 
1 1 1 32  4  25 x ?        ?        87.33978  43.7  ?              ?        0.00 
1 1 1 32  6  0  o 502.8636 4.132934 760.2352  88.9  -24.62375      8.265867 0.99 
1 1 1 32  6  1  f 246.7232 3.382112 331.2931  118.6 5.283066       6.764224 0.00 
1 1 1 32  6  2  o 50.86983 8.163321 60.91269  44.4  18.37846       16.32664 0.21 
1 1 1 32  6  3  o 123.8425 3.361578 241.8384  132.1 24.69295       6.723156 0.92 
1 1 1 32  6  4  o 308.5674 3.388737 496.7495  331.7 13.60825       6.777473 0.99 
1 1 1 32  6  5  o 249.1721 4.187618 262.2144  13.4  -17.15216      8.375237 0.97 
1 1 1 32  6  6  o 147.1581 2.981554 183.1613  274.0 29.41144       5.963108 0.93 
1 1 1 32  6  7  o 252.4117 3.102290 333.3558  208.4 19.44421       6.204580 0.98 
1 1 1 32  6  8  o 199.3495 2.842328 390.3962  244.0 -16.58533      5.684656 0.98 
1 1 1 32  6  9  o 311.6349 3.596815 412.7946  209.5 24.50403       7.193629 0.99 
1 1 1 32  6  10 o 85.40875 4.879910 73.91687  110.3 -18.78905      9.759819 0.79 
1 1 1 32  6  11 o 340.0924 3.599532 398.8509  97.2  -37.84232      7.199064 0.99 
1 1 1 32  6  12 o 201.9090 3.158986 316.5642  177.2 24.17986       6.317971 0.98 
1 1 1 32  6  13 o 165.4663 3.363732 256.1924  169.5 11.59595       6.727464 0.98 
1 1 1 32  6  14 o 153.1567 3.521970 207.1372  223.8 -6.440704      7.043940 0.98 
1 1 1 32  6  15 o 190.6516 3.826601 232.2427  25.9  -6.157654      7.653202 0.98 
1 1 1 32  6  16 o 75.08952 7.157287 110.3121  6.7   15.25981       14.31457 0.87 
1 1 1 32  6  17 o 56.65086 8.649014 92.02997  307.2 -29.40796      17.29803 0.80 
1 1 1 32  6  18 o 210.6756 3.755423 244.3789  102.3 -14.80872      7.510845 0.99 
1 1 1 32  6  19 o 122.1195 5.031084 192.2970  150.0 -18.07532      10.06217 0.97 
1 1 1 32  6  20 o 90.93192 6.550494 125.9221  291.1 -4.622925      13.10099 0.96 
1 1 1 32  6  21 o 96.29059 6.453027 136.4448  244.1 13.71024       12.90605 0.97 
1 1 1 32  6  22 o 43.05017 10.86445 40.82492  298.1 18.26393       21.72890 0.67 
1 1 1 32  6  23 o 29.71808 9.225651 22.84905  143.9 -4.502281      18.45130 0.38 
1 1 1 32  6  24 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 32  8  0  o 104.0221 4.282584 177.9363  235.3 31.83996       8.565167 0.91 
1 1 1 32  8  1  o 119.0342 3.539690 215.6087  276.0 24.65757       7.079380 0.93 
1 1 1 32  8  2  o 110.0551 3.794573 156.8376  100.0 -20.98636      7.589145 0.90 
1 1 1 32  8  3  o 86.87442 5.313812 98.61087  71.2  -14.28429      10.62762 0.78 
1 1 1 32  8  4  o 56.10897 7.877702 134.2325  307.4 17.40714       15.75540 0.76 
1 1 1 32  8  5  o 272.0905 3.524457 362.4039  25.8  17.89038       7.048913 0.99 
1 1 1 32  8  6  f 31.79769 8.492815 4.439314  317.6 -4.884233      16.98563 0.00 
1 1 1 32  8  7  o 83.80490 5.246130 92.40125  268.3 -6.710472      10.49226 0.85 
1 1 1 32  8  8  o 298.0797 3.493770 463.7524  301.4 -11.31039      6.987540 0.99 
1 1 1 32  8  9  o 124.7303 4.019529 202.0680  310.6 -18.17329      8.039059 0.96 
1 1 1 32  8  10 o 96.70721 4.644680 181.3474  116.2 -11.32642      9.289359 0.95 
1 1 1 32  8  11 o 50.11880 8.649658 70.12560  296.4 3.855438       17.29932 0.76 
1 1 1 32  8  12 o 122.3184 4.119349 178.6424  243.0 7.689972       8.238697 0.97 
1 1 1 32  8  13 o 46.09383 8.546776 90.58060  116.5 -15.61765      17.09355 0.76 
1 1 1 32  8  14 o 155.8616 3.863158 186.1247  330.0 -24.72838      7.726316 0.97 
1 1 1 32  8  15 o 64.42296 7.174325 68.03139  12.3  -15.48024      14.34865 0.78 
1 1 1 32  8  16 o 73.97740 8.620078 112.0822  63.0  -10.64346      17.24016 0.91 
1 1 1 32  8  17 f 74.67619 7.251744 62.07775  133.2 23.65886       14.50349 0.00 
1 1 1 32  8  18 o 36.29819 9.505547 26.36552  218.6 32.51552       19.01109 0.43 
1 1 1 32  8  19 o 86.46532 8.398069 140.1168  297.7 -17.28178      16.79614 0.96 
1 1 1 32  8  20 o 107.0462 6.168014 137.4906  292.0 3.998657       12.33603 0.97 
1 1 1 32  8  21 o 29.00471 8.939511 24.09523  358.2 -5.502188      17.87902 0.40 
1 1 1 32  8  22 x ?        ?        64.64679  120.4 ?              ?        0.00 
1 1 1 32  10 0  o 162.9790 3.240445 231.5606  91.9  10.49232       6.480890 0.97 
1 1 1 32  10 1  o 176.6610 3.273294 340.2005  131.1 12.50337       6.546587 0.98 
1 1 1 32  10 2  o 69.90193 8.171457 152.6352  21.0  6.173012       16.34291 0.91 
1 1 1 32  10 3  o 111.3527 4.468894 175.4767  256.0 -41.64184      8.937788 0.95 
1 1 1 32  10 4  o 31.33387 8.716040 42.47727  336.7 0.6115570      17.43208 0.34 
1 1 1 32  10 5  o 57.25287 7.797411 102.4079  16.3  22.12346       15.59482 0.85 
1 1 1 32  10 6  o 95.77037 5.097144 123.0821  344.9 26.51182       10.19429 0.94 
1 1 1 32  10 7  o 93.12798 5.122656 178.5965  315.3 -20.23450      10.24531 0.96 
1 1 1 32  10 8  o 48.45843 8.312415 126.2512  51.3  -15.76095      16.62483 0.88 
1 1 1 32  10 9  o 137.8922 3.761750 219.3423  346.5 -7.988632      7.523499 0.98 
1 1 1 32  10 10 o 156.1276 3.808682 257.9114  325.8 17.36896       7.617364 0.98 
1 1 1 32  10 11 o 91.06337 5.843600 153.9550  71.1  17.79939       11.68720 0.94 
1 1 1 32  10 12 o 176.6735 3.519051 225.2030  205.9 0.2562103      7.038101 0.98 
1 1 1 32  10 13 o 156.2203 3.805880 219.3983  148.8 2.563950       7.611760 0.98 
1 1 1 32  10 14 o 81.96338 6.359044 102.0842  9.1   20.76498       12.71809 0.93 
1 1 1 32  10 15 f 73.81357 8.255208 95.19519  34.2  -4.011543      16.51042 0.00 
1 1 1 32  10 16 o 36.82390 10.64807 66.02482  321.9 3.498535       21.29613 0.79 
1 1 1 32  10 17 o 60.41149 9.896512 105.9907  346.9 9.449203       19.79302 0.93 
1 1 1 32  10 18 o 96.56471 12.45305 123.2326  291.3 18.13956       24.90609 0.96 
1 1 1 32  10 19 o 53.16876 13.66878 78.58826  226.0 ?              ?        0.88 
1 1 1 32  12 0  o 82.74640 5.824349 108.8319  313.0 22.72099       11.64870 0.93 
1 1 1 32  12 1  o 170.8392 3.823371 287.8334  221.5 -0.1485596     7.646743 0.99 
1 1 1 32  12 2  o 172.1352 4.100445 340.3710  256.5 25.00958       8.200890 0.99 
1 1 1 32  12 3  o 83.59114 5.574142 124.5630  116.0 -9.950340      11.14828 0.92 
1 1 1 32  12 4  o 76.07339 6.837766 75.69686  251.4 3.144234       13.67553 0.85 
1 1 1 32  12 5  o 168.7483 4.235589 244.6608  287.7 1.116653       8.471177 0.98 
1 1 1 32  12 6  o 107.9167 5.073073 146.2424  66.2  -1.582321      10.14615 0.95 
1 1 1 32  12 7  o 45.18752 9.475354 52.18539  138.2 -11.52780      18.95071 0.63 
1 1 1 32  12 8  o 54.04576 9.054111 102.6453  64.1  -20.32198      18.10822 0.87 
1 1 1 32  12 9  o 135.7774 4.954700 199.3837  54.9  9.284576       9.909400 0.98 
1 1 1 32  12 10 o 108.6592 5.002595 130.9455  219.2 9.812088       10.00519 0.97 
1 1 1 32  12 11 o 46.92833 10.16078 12.42487  205.4 5.688709       20.32156 0.30 
1 1 1 32  12 12 o 43.16454 10.53725 65.15068  306.2 6.722374       21.07449 0.83 
1 1 1 32  12 13 o 48.41501 10.28058 95.54900  144.9 -11.07022      20.56116 0.91 
1 1 1 32  12 14 o 60.90730 9.536061 73.61622  133.0 20.21917       19.07212 0.90 
1 1 1 32  12 15 o 56.17972 9.974371 58.75452  260.2 13.21645       19.94874 0.87 
1 1 1 32  12 16 o 42.72474 11.06409 63.58754  352.5 ?              ?        0.85 
1 1 1 32  14 0  o 105.5383 5.271735 180.1685  29.6  6.591362       10.54347 0.97 
1 1 1 32  14 1  o 81.51805 6.522250 120.2036  19.4  25.27857       13.04450 0.95 
1 1 1 32  14 2  f 85.72890 6.564132 198.6126  326.2 25.26086       13.12826 0.00 
1 1 1 32  14 3  o 39.62637 9.336365 26.55986  263.6 -16.72039      18.67273 0.50 
1 1 1 32  14 4  o 65.00455 8.380819 123.8186  138.3 32.46915       16.76164 0.95 
1 1 1 32  14 5  o 49.29711 9.540781 45.72830  330.8 -10.68126      19.08156 0.80 
1 1 1 32  14 6  o 44.41214 8.828782 51.28963  301.7 -31.25373      17.65756 0.82 
1 1 1 32  14 7  o 62.64449 8.439825 92.15485  300.2 -25.94312      16.87965 0.94 
1 1 1 32  14 8  o 83.49861 6.771106 141.4473  236.7 -6.079811      13.54221 0.97 
1 1 1 32  14 9  o 138.1528 4.783144 235.6920  268.2 2.067703       9.566287 0.99 
1 1 1 32  14 10 o 123.3159 4.968880 243.3220  338.6 -2.469688      9.937759 0.99 
1 1 1 32  14 11 o 33.77078 9.863588 97.03136  40.9  ?              ?        0.89 
1 1 1 32  14 12 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 32  16 0  o 42.82425 11.04702 89.18347  6.0   1.893719       22.09405 0.90 
1 1 1 32  16 1  o 56.83545 10.41822 76.83163  63.1  19.50201       20.83644 0.92 
1 1 1 32  16 2  o 30.60918 9.576371 46.62994  164.6 ?              ?        0.73 
1 1 1 32  16 3  o 125.2938 4.889665 210.9809  169.5 ?              ?        0.99 
1 1 1 32  16 4  x ?        ?        158.1623  138.6 ?              ?        0.00 
1 1 1 33  1  0  o 657.9319 5.380071 830.8988  295.7 39.71820       10.76014 0.99 
1 1 1 33  1  1  o 503.4580 4.336304 678.6449  81.1  4.010376       8.672607 0.98 
1 1 1 33  1  2  o 373.6097 3.641429 480.0811  150.0 -54.25131      7.282857 0.96 
1 1 1 33  1  3  f 545.7898 4.607604 737.5976  254.7 33.34924       9.215207 0.00 
1 1 1 33  1  4  o 665.3961 4.908314 1027.575  261.3 16.89246       9.816628 0.99 
1 1 1 33  1  5  o 356.0470 3.168346 637.7424  260.6 11.51404       6.336692 0.98 
1 1 1 33  1  6  o 188.6897 2.533099 353.2776  274.7 -11.75706      5.066197 0.94 
1 1 1 33  1  7  o 195.7489 2.513619 365.0521  302.8 -17.49362      5.027239 0.95 
1 1 1 33  1  8  o 54.48648 5.515606 77.10831  150.9 -22.03085      11.03121 0.38 
1 1 1 33  1  9  o 322.6270 3.018170 478.9103  180.3 -4.174072      6.036340 0.99 
1 1 1 33  1  10 o 175.3285 2.702779 156.7116  20.9  24.40195       5.405558 0.93 
1 1 1 33  1  11 o 195.2731 3.153046 319.0563  23.9  -23.78648      6.306092 0.97 
1 1 1 33  1  12 o 160.3274 3.079296 213.8996  107.8 18.20308       6.158591 0.95 
1 1 1 33  1  13 o 423.8330 3.939363 497.3923  133.8 30.90103       7.878725 0.99 
1 1 1 33  1  14 o 118.8555 3.908665 144.8750  83.0  36.59363       7.817329 0.93 
1 1 1 33  1  15 o 163.0234 3.323409 209.8107  294.7 35.12012       6.646819 0.97 
1 1 1 33  1  16 o 105.6566 4.134862 124.0345  242.7 18.44278       8.269725 0.94 
1 1 1 33  1  17 o 64.17210 6.141431 13.96948  283.7 0.2037811E-01  12.28286 0.29 
1 1 1 33  1  18 o 81.87130 5.887653 146.1245  90.8  16.72319       11.77531 0.91 
1 1 1 33  1  19 o 97.40005 6.625881 116.0599  62.2  0.4131470      13.25176 0.91 
1 1 1 33  1  20 o 109.0159 4.929287 114.8283  60.5  -16.21946      9.858574 0.93 
1 1 1 33  1  21 o 46.28892 9.953987 79.46519  54.5  -11.37203      19.90797 0.79 
1 1 1 33  1  22 o 72.66683 7.314570 83.63378  80.5  -8.119980      14.62914 0.91 
1 1 1 33  1  23 o 65.32378 8.370406 34.15462  188.0 39.40177       16.74081 0.75 
1 1 1 33  1  24 o 42.09007 11.58584 23.19575  337.4 -15.17338      23.17168 0.44 
1 1 1 33  1  25 o 80.40793 8.705418 107.0352  163.0 ?              ?        0.95 
1 1 1 33  3  0  o 211.1828 3.241915 336.5078  351.2 26.99388       6.483830 0.90 
1 1 1 33  3  1  o 256.6212 2.933470 320.5136  47.4  -5.175369      5.866940 0.93 
1 1 1 33  3  2  o 310.1753 2.985906 471.1811  315.7 -10.42755      5.971812 0.96 
1 1 1 33  3  3  o 670.8698 4.924943 776.0881  193.9 10.74780       9.849887 0.99 
1 1 1 33  3  4  o 252.0717 2.686269 197.6626  7.0   27.89850       5.372538 0.90 
1 1 1 33  3  5  o 579.5065 4.261005 541.3453  65.6  4.607117       8.522010 0.99 
1 1 1 33  3  6  o 250.1548 3.064119 291.8349  92.4  31.22517       6.128238 0.96 
1 1 1 33  3  7  o 90.45554 4.212453 207.6940  247.9 16.08524       8.424907 0.86 
1 1 1 33  3  8  o 150.5630 3.085139 183.1365  137.9 18.78267       6.170279 0.93 
1 1 1 33  3  9  o 149.4827 3.016731 265.6976  21.9  -4.076767      6.033462 0.95 
1 1 1 33  3  10 o 199.5035 2.932263 290.4372  179.4 -10.68091      5.864525 0.97 
1 1 1 33  3  11 o 196.1597 2.802381 297.3151  101.9 3.529663       5.604763 0.97 
1 1 1 33  3  12 o 181.4248 2.841706 225.8197  33.8  17.17570       5.683412 0.97 
1 1 1 33  3  13 o 42.05463 8.606683 44.83373  98.7  18.21842       17.21337 0.38 
1 1 1 33  3  14 o 108.2022 4.126845 206.4357  258.2 15.85606       8.253691 0.95 
1 1 1 33  3  15 o 34.74501 9.233458 69.37009  161.3 0.5258827      18.46692 0.55 
1 1 1 33  3  16 o 171.5910 3.483802 239.3728  161.8 -6.323898      6.967603 0.98 
1 1 1 33  3  17 o 154.2282 3.868487 200.6650  59.7  -22.91922      7.736974 0.97 
1 1 1 33  3  18 o 179.9973 3.812899 267.5044  101.7 25.08420       7.625799 0.98 
1 1 1 33  3  19 f 129.0997 4.480115 127.4693  176.9 -23.89301      8.960230 0.00 
1 1 1 33  3  20 o 120.9478 4.740924 114.9617  251.0 -11.05364      9.481848 0.95 
1 1 1 33  3  21 o 76.67796 7.521666 74.17583  111.0 -22.40546      15.04333 0.89 
1 1 1 33  3  22 o 142.5107 4.522933 185.6678  63.3  23.88185       9.045865 0.98 
1 1 1 33  3  23 o 29.62213 8.905511 61.36089  46.5  -12.39572      17.81102 0.69 
1 1 1 33  3  24 o 28.20175 9.149481 65.46129  305.4 -0.2341652     18.29896 0.72 
1 1 1 33  3  25 x ?        ?        78.81889  281.0 ?              ?        0.00 
1 1 1 33  5  0  o 472.3405 3.928102 638.1502  100.9 4.180359       7.856205 0.99 
1 1 1 33  5  1  o 471.6489 3.979831 577.6547  209.1 17.07199       7.959661 0.99 
1 1 1 33  5  2  o 306.3946 2.864005 304.6592  290.3 5.256714       5.728010 0.96 
1 1 1 33  5  3  o 141.3129 3.473705 288.1611  241.1 -7.568497      6.947410 0.92 
1 1 1 33  5  4  o 148.8511 2.916442 273.2615  5.0   12.19205       5.832884 0.94 
1 1 1 33  5  5  o 203.9766 2.780248 320.6797  107.6 -8.732742      5.560495 0.97 
1 1 1 33  5  6  o 201.2982 2.684290 284.5269  209.9 20.69829       5.368580 0.97 
1 1 1 33  5  7  o 150.6544 3.122650 207.7955  271.7 -9.233032      6.245300 0.94 
1 1 1 33  5  8  o 169.0103 3.642123 215.4794  330.5 3.730789       7.284245 0.95 
1 1 1 33  5  9  o 152.9047 3.166054 267.7535  149.3 10.56885       6.332107 0.96 
1 1 1 33  5  10 o 73.49557 5.425924 165.0359  171.5 -12.81622      10.85185 0.88 
1 1 1 33  5  11 o 138.0892 3.493083 192.2341  336.1 -27.88943      6.986167 0.96 
1 1 1 33  5  12 o 54.37536 6.781241 156.3834  87.4  -14.74813      13.56248 0.86 
1 1 1 33  5  13 o 266.6000 3.346643 360.4461  128.3 0.6952209      6.693285 0.99 
1 1 1 33  5  14 o 84.37197 5.828469 104.3567  227.8 -21.75064      11.65694 0.91 
1 1 1 33  5  15 f 170.8372 3.712268 221.8084  4.4   10.72604       7.424537 0.00 
1 1 1 33  5  16 o 32.62288 9.279391 52.94152  243.3 16.30862       18.55878 0.42 
1 1 1 33  5  17 o 34.21915 9.436448 86.51147  191.0 17.03571       18.87290 0.60 
1 1 1 33  5  18 o 88.90247 6.447134 78.95660  181.0 1.929428       12.89427 0.87 
1 1 1 33  5  19 o 122.2003 4.678653 122.7796  36.0  -0.1031494     9.357306 0.95 
1 1 1 33  5  20 o 112.2988 5.530437 148.9219  302.2 16.31207       11.06087 0.97 
1 1 1 33  5  21 o 164.3604 4.352252 189.1352  180.9 -23.97453      8.704505 0.99 
1 1 1 33  5  22 o 40.52621 10.51126 55.70534  52.4  2.274323       21.02251 0.75 
1 1 1 33  5  23 o 44.44679 11.12677 68.38019  72.2  -7.266369      22.25353 0.83 
1 1 1 33  5  24 x ?        ?        100.7190  166.0 ?              ?        0.00 
1 1 1 33  7  0  o 115.6201 3.398078 196.2859  255.1 -8.815681      6.796155 0.92 
1 1 1 33  7  1  o 131.8930 3.454401 270.8105  55.9  1.820129       6.908801 0.95 
1 1 1 33  7  2  o 121.8708 4.782186 156.4804  40.1  35.46720       9.564372 0.91 
1 1 1 33  7  3  o 71.61374 5.441779 124.3847  42.8  22.56918       10.88356 0.79 
1 1 1 33  7  4  o 169.8260 3.214867 263.9386  350.4 43.37708       6.429734 0.96 
1 1 1 33  7  5  o 121.7524 3.561403 176.0770  300.1 -50.46917      7.122805 0.92 
1 1 1 33  7  6  o 137.3860 3.571649 318.8284  205.6 3.625473       7.143298 0.97 
1 1 1 33  7  7  o 149.3918 3.595999 131.1213  178.1 1.784607       7.191999 0.93 
1 1 1 33  7  8  o 230.1957 3.393893 269.6749  264.0 -1.609680      6.787785 0.98 
1 1 1 33  7  9  o 195.3605 3.223924 276.6639  221.1 -7.844238      6.447848 0.98 
1 1 1 33  7  10 o 61.68153 6.005034 100.0976  128.6 7.984795       12.01007 0.82 
1 1 1 33  7  11 o 48.23315 7.971559 25.97569  310.4 20.84325       15.94312 0.34 
1 1 1 33  7  12 o 137.9525 3.757864 191.9892  121.6 -23.21416      7.515728 0.97 
1 1 1 33  7  13 o 248.8335 3.379277 285.2868  111.6 -33.91225      6.758554 0.99 
1 1 1 33  7  14 o 105.6038 4.681326 140.5256  316.6 -3.917137      9.362653 0.94 
1 1 1 33  7  15 o 83.58118 6.712237 90.41993  40.8  6.491417       13.42447 0.87 
1 1 1 33  7  16 o 95.59181 6.109100 152.6192  242.4 34.64655       12.21820 0.94 
1 1 1 33  7  17 o 73.58595 8.664574 103.9587  28.9  -32.93273      17.32915 0.90 
1 1 1 33  7  18 o 77.62698 8.819504 79.70030  77.5  -54.38993      17.63901 0.90 
1 1 1 33  7  19 o 94.49724 5.749152 145.9095  227.4 20.40894       11.49830 0.97 
1 1 1 33  7  20 o 127.4954 5.698891 165.7345  277.6 4.685196       11.39778 0.98 
1 1 1 33  7  21 o 39.99261 11.09239 58.36331  312.4 10.80762       22.18479 0.77 
1 1 1 33  7  22 o 32.64053 10.00488 33.35526  282.3 ?              ?        0.56 
1 1 1 33  9  0  o 143.5757 3.638704 218.4079  290.0 11.62091       7.277409 0.96 
1 1 1 33  9  1  o 36.43518 7.536530 187.6918  179.5 -22.00904      15.07306 0.79 
1 1 1 33  9  2  o 111.5323 4.308134 193.4224  14.3  -32.98712      8.616267 0.95 
1 1 1 33  9  3  o 36.91423 9.414996 50.90609  345.5 1.995106       18.82999 0.41 
1 1 1 33  9  4  o 107.0411 4.137020 109.2003  110.3 13.50787       8.274039 0.91 
1 1 1 33  9  5  o 132.5739 4.352320 189.0004  69.3  -4.005798      8.704639 0.96 
1 1 1 33  9  6  o 97.77892 4.963313 186.4495  185.2 -30.82931      9.926625 0.95 
1 1 1 33  9  7  o 70.79324 5.940431 70.45705  70.6  9.023849       11.88086 0.81 
1 1 1 33  9  8  o 109.0781 4.502910 202.4932  5.4   -4.424278      9.005819 0.97 
1 1 1 33  9  9  o 56.79831 7.981983 59.31926  358.4 3.091770       15.96397 0.79 
1 1 1 33  9  10 o 101.2948 4.644227 128.0702  124.0 2.392189       9.288454 0.94 
1 1 1 33  9  11 o 149.7200 3.896701 203.0907  88.9  13.59763       7.793402 0.97 
1 1 1 33  9  12 o 34.52140 9.518077 58.40287  282.2 2.462509       19.03615 0.49 
1 1 1 33  9  13 o 58.33833 8.459851 55.76133  204.2 -32.02911      16.91970 0.70 
1 1 1 33  9  14 o 64.59247 8.248310 96.10050  245.8 -14.18765      16.49662 0.88 
1 1 1 33  9  15 o 30.76602 8.929545 53.75212  275.9 -0.7745895     17.85909 0.57 
1 1 1 33  9  16 o 75.35954 9.440968 152.7805  279.8 -47.30966      18.88194 0.95 
1 1 1 33  9  17 o 88.39153 7.224456 73.85819  299.3 15.46716       14.44891 0.94 
1 1 1 33  9  18 o 36.70226 10.40841 21.97248  257.0 2.654900       20.81683 0.41 
1 1 1 33  9  19 o 51.72213 10.69641 97.79628  259.1 -21.45916      21.39281 0.91 
1 1 1 33  9  20 o 49.89026 11.01533 72.96992  12.4  ?              ?        0.88 
1 1 1 33  11 0  o 115.6691 4.397035 203.1857  16.2  14.39866       8.794069 0.97 
1 1 1 33  11 1  o 110.3383 4.322054 133.9129  247.8 -8.986031      8.644108 0.95 
1 1 1 33  11 2  o 90.16113 6.850442 123.5708  282.7 30.60207       13.70088 0.94 
1 1 1 33  11 3  o 57.82425 8.182452 112.8197  320.0 -34.80036      16.36490 0.91 
1 1 1 33  11 4  f 73.31084 5.985345 140.5116  170.9 25.22596       11.97069 0.00 
1 1 1 33  11 5  o 111.4356 4.931041 159.1239  218.1 -7.396782      9.862082 0.96 
1 1 1 33  11 6  o 146.2543 4.287416 214.0738  340.9 -3.547180      8.574832 0.98 
1 1 1 33  11 7  o 159.5282 3.762142 245.7260  297.3 -1.725967      7.524285 0.98 
1 1 1 33  11 8  o 114.3431 4.842638 159.8355  202.2 -3.389175      9.685276 0.96 
1 1 1 33  11 9  o 85.46468 6.424851 156.4835  128.7 2.563171       12.84970 0.94 
1 1 1 33  11 10 o 112.2846 5.090351 164.8805  178.2 4.559036       10.18070 0.97 
1 1 1 33  11 11 o 48.82916 8.984585 3.707013  203.8 35.59172       17.96917 0.08 
1 1 1 33  11 12 f 117.1942 5.076570 157.6984  264.9 16.88467       10.15314 0.00 
1 1 1 33  11 13 o 120.8887 5.160284 142.3044  182.0 14.23649       10.32057 0.98 
1 1 1 33  11 14 f 62.94958 9.816044 113.0250  128.3 -10.85638      19.63209 0.00 
1 1 1 33  11 15 o 68.17123 8.561328 113.3140  172.4 5.819443       17.12266 0.95 
1 1 1 33  11 16 o 80.44201 8.472248 152.4078  282.5 -7.504761      16.94450 0.97 
1 1 1 33  11 17 o 83.52812 8.968400 133.5618  295.9 ?              ?        0.97 
1 1 1 33  13 0  o 24.35781 7.934205 81.29105  214.7 0.5783577      15.86841 0.57 
1 1 1 33  13 1  o 143.3129 3.884916 194.7989  212.2 -12.98203      7.769833 0.98 
1 1 1 33  13 2  o 130.5113 4.291957 166.0499  269.7 -7.733521      8.583914 0.97 
1 1 1 33  13 3  o 37.59897 9.003200 72.88908  86.3  -19.24926      18.00640 0.72 
1 1 1 33  13 4  o 105.0342 5.170136 168.8029  359.6 12.47913       10.34027 0.97 
1 1 1 33  13 5  o 123.3680 4.491889 195.6452  332.9 5.792984       8.983778 0.98 
1 1 1 33  13 6  o 56.16618 8.705420 101.8225  202.6 -12.41549      17.41084 0.91 
1 1 1 33  13 7  o 45.11594 10.34344 29.96987  133.8 8.517246       20.68687 0.58 
1 1 1 33  13 8  o 28.62304 8.994892 15.13892  296.1 6.738731       17.98978 0.26 
1 1 1 33  13 9  o 35.50698 10.40746 59.22678  264.0 -3.345539      20.81492 0.78 
1 1 1 33  13 10 o 112.9030 5.166028 158.2595  296.6 17.47832       10.33206 0.98 
1 1 1 33  13 11 o 33.18152 8.797342 14.76361  302.3 -20.38817      17.59468 0.31 
1 1 1 33  13 12 o 38.07537 10.50732 27.93535  152.6 18.15706       21.01464 0.57 
1 1 1 33  13 13 f 35.59376 10.80313 57.07726  47.2  ?              ?        0.00 
1 1 1 33  15 0  o 67.45718 9.126081 96.91361  334.1 -13.81313      18.25216 0.94 
1 1 1 33  15 1  f 45.87450 10.69608 34.62543  302.4 0.1556587      21.39217 0.00 
1 1 1 33  15 2  o 33.90857 10.00515 31.02746  17.2  -8.277706      20.01029 0.57 
1 1 1 33  15 3  o 102.4025 5.875406 179.8078  105.5 18.39118       11.75081 0.98 
1 1 1 33  15 4  o 29.09646 9.175255 71.99639  137.0 -0.2297935     18.35051 0.81 
1 1 1 33  15 5  o 65.96628 8.757586 135.7531  286.4 3.512184       17.51517 0.96 
1 1 1 33  15 6  f 48.79306 10.10211 88.07674  187.6 ?              ?        0.00 
1 1 1 33  15 7  o 109.3637 5.343752 196.8122  136.3 ?              ?        0.99 
1 1 1 33  15 8  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 34  0  0  o 149.1513 4.301517 328.7210  180.0 0.000000       0.000000 0.93 
1 1 1 34  0  1  o 114.0367 4.697020 131.5368  180.0 0.000000       0.000000 0.37 
1 1 1 34  0  2  o 308.9336 4.752993 184.4734  180.0 0.000000       0.000000 0.99 
1 1 1 34  0  3  f 261.4344 4.459736 5.172097  180.0 0.000000       0.000000 0.00 
1 1 1 34  0  4  o 175.9428 4.810484 68.71763  180.0 0.000000       0.000000 0.65 
1 1 1 34  0  5  o 103.7272 4.130126 99.33879  180.0 0.000000       0.000000 0.48 
1 1 1 34  0  6  f 323.6847 4.013272 395.5135  180.0 0.000000       0.000000 0.00 
1 1 1 34  0  7  f 288.0855 3.860838 353.0936  180.0 0.000000       0.000000 0.00 
1 1 1 34  0  8  o 24.72583 12.64657 9.699120  0.0   0.000000       0.000000 0.02 
1 1 1 34  0  9  o 160.2884 3.332620 196.8743  0.0   0.000000       0.000000 1.00 
1 1 1 34  0  10 o 85.74608 5.864489 229.3510  180.0 0.000000       0.000000 0.99 
1 1 1 34  0  11 o 209.7041 4.543064 282.7380  0.0   0.000000       0.000000 1.00 
1 1 1 34  0  12 o 185.5321 4.704838 186.9114  0.0   0.000000       0.000000 1.00 
1 1 1 34  0  13 o 240.3141 4.667400 207.6887  180.0 0.000000       0.000000 1.00 
1 1 1 34  0  14 o 317.9969 5.065478 304.0145  180.0 0.000000       0.000000 1.00 
1 1 1 34  0  15 o 48.71808 12.03370 63.46865  0.0   0.000000       0.000000 0.67 
1 1 1 34  0  16 o 339.2032 5.457239 460.5005  180.0 0.000000       0.000000 1.00 
1 1 1 34  0  17 o 146.9279 5.159478 237.3299  180.0 0.000000       0.000000 1.00 
1 1 1 34  0  18 f 155.9545 5.145190 130.8270  0.0   0.000000       0.000000 0.00 
1 1 1 34  0  19 o 148.6577 6.064857 146.4883  0.0   0.000000       0.000000 1.00 
1 1 1 34  0  20 o 48.42935 18.03219 45.02453  0.0   0.000000       0.000000 0.58 
1 1 1 34  0  21 o 107.0066 13.83546 119.4402  0.0   0.000000       0.000000 1.00 
1 1 1 34  0  22 o 144.9718 6.780566 150.3492  0.0   0.000000       0.000000 1.00 
1 1 1 34  0  23 o 29.78069 17.23378 39.15537  0.0   0.000000       0.000000 0.51 
1 1 1 34  0  24 o 91.09530 11.73598 36.46160  180.0 0.000000       0.000000 0.96 
1 1 1 34  0  25 x ?        ?        26.64828  0.0   ?              ?        0.00 
1 1 1 34  2  0  o 98.99442 4.826876 121.9419  234.8 -32.00173      9.653752 0.37 
1 1 1 34  2  1  o 540.2004 4.598043 514.1439  227.2 -104.1819      9.196086 0.98 
1 1 1 34  2  2  o 203.9433 2.721356 96.04774  226.4 -31.01711      5.442712 0.61 
1 1 1 34  2  3  o 163.2461 2.629251 147.2939  351.5 -0.5275116     5.258503 0.77 
1 1 1 34  2  4  o 268.5022 2.837650 332.1131  353.0 63.03651       5.675301 0.95 
1 1 1 34  2  5  o 550.1760 4.217834 522.2477  33.4  46.02606       8.435667 0.99 
1 1 1 34  2  6  o 368.0212 3.198883 412.3976  33.7  7.068939       6.397765 0.98 
1 1 1 34  2  7  o 314.1870 3.013358 311.9360  293.7 -11.12103      6.026716 0.98 
1 1 1 34  2  8  o 201.9589 3.404774 217.2422  193.1 -24.58144      6.809547 0.96 
1 1 1 34  2  9  o 105.8422 3.418795 149.1945  184.6 21.45627       6.837590 0.88 
1 1 1 34  2  10 o 190.4233 3.021473 234.9891  309.8 15.26537       6.042946 0.96 
1 1 1 34  2  11 o 56.14450 5.947337 65.54360  344.4 18.05376       11.89467 0.50 
1 1 1 34  2  12 o 88.71150 4.768574 134.7939  309.5 -16.33266      9.537148 0.89 
1 1 1 34  2  13 o 190.6810 3.184015 206.3403  13.1  10.10141       6.368030 0.97 
1 1 1 34  2  14 o 40.34315 7.948264 118.1677  304.3 17.53154       15.89653 0.73 
1 1 1 34  2  15 o 214.1245 3.387621 258.4214  351.3 22.97723       6.775241 0.98 
1 1 1 34  2  16 o 42.37014 10.04776 13.26160  55.1  -3.526203      20.09552 0.19 
1 1 1 34  2  17 o 40.24806 9.521527 29.17036  294.0 6.067238       19.04305 0.30 
1 1 1 34  2  18 o 39.30640 9.168973 48.84602  164.6 28.26708       18.33795 0.43 
1 1 1 34  2  19 o 28.33373 9.018908 44.23537  193.7 -1.970005      18.03782 0.33 
1 1 1 34  2  20 o 77.72404 6.700029 124.4624  199.6 -5.821037      13.40006 0.92 
1 1 1 34  2  21 o 35.71988 9.312097 47.35908  119.8 19.15572       18.62419 0.59 
1 1 1 34  2  22 o 113.4222 5.511754 121.7845  25.0  -20.10981      11.02351 0.97 
1 1 1 34  2  23 o 25.72602 8.317256 21.84619  238.8 14.57528       16.63451 0.29 
1 1 1 34  2  24 o 62.57543 9.612247 91.70705  218.7 15.81278       19.22449 0.92 
1 1 1 34  2  25 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 34  4  0  o 163.6941 2.748268 166.3420  67.8  -7.062149      5.496535 0.83 
1 1 1 34  4  1  o 261.7127 2.825261 277.5977  32.5  3.345642       5.650522 0.94 
1 1 1 34  4  2  o 75.54597 5.291216 47.64898  148.5 -59.50756      10.58243 0.23 
1 1 1 34  4  3  o 122.8330 3.462879 212.1706  147.4 -19.72549      6.925758 0.86 
1 1 1 34  4  4  o 155.3378 2.529833 200.3397  6.3   -8.804550      5.059666 0.92 
1 1 1 34  4  5  o 181.8160 3.088208 341.1654  67.9  -6.905197      6.176416 0.96 
1 1 1 34  4  6  o 415.0771 3.728977 534.9283  95.9  -3.661621      7.457953 0.99 
1 1 1 34  4  7  f 128.5628 3.523870 97.10219  39.0  -11.88547      7.047739 0.00 
1 1 1 34  4  8  o 203.7357 3.122319 287.2592  0.0   -55.50418      6.244639 0.97 
1 1 1 34  4  9  o 138.0549 3.228212 262.1697  42.9  -25.02343      6.456424 0.95 
1 1 1 34  4  10 o 113.4945 3.701511 153.8458  172.5 -13.75346      7.403021 0.91 
1 1 1 34  4  11 o 133.7080 3.249062 207.5386  22.2  4.971771       6.498125 0.96 
1 1 1 34  4  12 o 165.2966 3.140503 243.6365  53.2  -45.68301      6.281006 0.97 
1 1 1 34  4  13 o 85.58881 4.910383 179.2302  116.7 1.180573       9.820765 0.93 
1 1 1 34  4  14 o 42.13184 9.457661 124.0795  112.2 9.759953       18.91532 0.81 
1 1 1 34  4  15 o 89.03358 5.150693 96.17828  86.1  -1.588722      10.30139 0.92 
1 1 1 34  4  16 o 108.9110 5.035594 198.6980  348.2 12.02541       10.07119 0.96 
1 1 1 34  4  17 o 237.7467 3.517440 284.8086  41.3  11.19418       7.034881 0.99 
1 1 1 34  4  18 o 101.3977 5.296582 124.8969  136.7 10.98485       10.59316 0.93 
1 1 1 34  4  19 o 45.93905 8.976533 78.19208  264.0 -23.98252      17.95307 0.76 
1 1 1 34  4  20 o 78.10133 7.450533 95.08536  292.0 -20.54101      14.90107 0.92 
1 1 1 34  4  21 o 31.62334 9.320605 64.62978  91.9  -5.485233      18.64121 0.73 
1 1 1 34  4  22 o 49.25738 10.39496 64.94161  358.7 -4.956425      20.78992 0.83 
1 1 1 34  4  23 o 44.45309 10.73938 19.98846  253.9 -9.550232      21.47877 0.44 
1 1 1 34  4  24 o 54.95496 11.00933 96.26059  210.0 ?              ?        0.92 
1 1 1 34  6  0  o 174.2278 2.905966 338.1499  124.8 41.41544       5.811933 0.95 
1 1 1 34  6  1  o 341.6633 3.286741 486.8892  341.0 2.329742       6.573482 0.99 
1 1 1 34  6  2  o 261.1639 3.483764 334.4307  221.8 -23.26541      6.967529 0.98 
1 1 1 34  6  3  o 293.1796 3.405801 447.0613  250.9 -20.05762      6.811602 0.99 
1 1 1 34  6  4  o 105.6108 3.684433 201.3643  351.6 -13.94973      7.368866 0.92 
1 1 1 34  6  5  o 149.0073 4.082960 292.7929  145.0 -31.10318      8.165920 0.96 
1 1 1 34  6  6  o 191.6115 3.011814 389.4650  57.6  -12.96190      6.023628 0.98 
1 1 1 34  6  7  o 200.1685 3.114028 310.9396  44.6  -21.70033      6.228055 0.98 
1 1 1 34  6  8  o 181.1118 3.317725 301.8332  190.5 -8.325806      6.635451 0.98 
1 1 1 34  6  9  o 125.4233 3.972721 190.2777  216.0 -27.96547      7.945442 0.95 
1 1 1 34  6  10 o 155.9324 3.294099 196.2180  48.2  28.96198       6.588198 0.97 
1 1 1 34  6  11 o 80.03182 5.755053 168.5318  264.9 -34.72844      11.51011 0.92 
1 1 1 34  6  12 o 105.3304 4.312524 96.59833  197.3 -9.681427      8.625048 0.92 
1 1 1 34  6  13 o 200.7820 3.273779 269.6778  164.0 4.977921       6.547557 0.99 
1 1 1 34  6  14 o 52.09053 7.852272 34.33679  325.1 -8.965782      15.70454 0.48 
1 1 1 34  6  15 o 93.31772 5.824660 138.3446  74.7  18.46767       11.64932 0.92 
1 1 1 34  6  16 o 42.45371 9.930408 9.092640  105.6 -9.787476      19.86082 0.10 
1 1 1 34  6  17 o 190.4876 4.084991 268.6273  347.0 -8.358109      8.169982 0.99 
1 1 1 34  6  18 o 60.66711 8.875154 118.7641  167.4 -19.21602      17.75031 0.91 
1 1 1 34  6  19 o 126.3675 5.120831 203.7047  164.3 12.05879       10.24166 0.98 
1 1 1 34  6  20 o 47.97157 10.95578 66.96120  139.5 -1.831551      21.91156 0.83 
1 1 1 34  6  21 o 68.92673 8.389735 70.55849  299.7 -1.920143      16.77947 0.90 
1 1 1 34  6  22 o 46.91475 10.96748 57.55455  41.5  -10.85157      21.93495 0.82 
1 1 1 34  6  23 x ?        ?        48.88532  96.4  ?              ?        0.00 
1 1 1 34  8  0  f 140.4554 3.482406 358.6829  227.0 -1.695282      6.964811 0.00 
1 1 1 34  8  1  o 212.8842 3.343518 440.0304  170.2 2.195633       6.687036 0.98 
1 1 1 34  8  2  o 113.5346 4.558357 233.9642  13.9  -26.82619      9.116714 0.94 
1 1 1 34  8  3  o 86.21340 5.181294 138.9115  94.7  1.065842       10.36259 0.87 
1 1 1 34  8  4  o 131.9927 3.677034 196.7031  207.4 26.43526       7.354067 0.95 
1 1 1 34  8  5  o 82.06693 5.439409 132.8723  217.6 34.05499       10.87882 0.90 
1 1 1 34  8  6  o 167.4229 3.252364 290.3933  91.9  -14.96989      6.504729 0.98 
1 1 1 34  8  7  o 168.1640 3.254686 292.0568  131.0 -35.17946      6.509373 0.98 
1 1 1 34  8  8  o 171.7449 3.213286 273.7515  184.5 26.15823       6.426572 0.98 
1 1 1 34  8  9  o 96.84631 4.757003 103.0404  197.4 19.37237       9.514007 0.92 
1 1 1 34  8  10 o 115.2400 4.701268 154.6826  22.2  -13.11645      9.402536 0.96 
1 1 1 34  8  11 o 81.56627 5.598613 139.7312  66.2  -6.217079      11.19723 0.94 
1 1 1 34  8  12 o 145.0192 3.905593 203.0611  191.6 2.021683       7.811187 0.97 
1 1 1 34  8  13 o 72.84273 7.956334 89.14244  205.0 -11.56832      15.91267 0.85 
1 1 1 34  8  14 o 130.1387 4.254040 167.3781  25.8  -2.708267      8.508080 0.96 
1 1 1 34  8  15 o 82.57031 6.676047 133.4388  351.3 -1.739883      13.35209 0.93 
1 1 1 34  8  16 o 152.0070 4.498271 258.4963  274.1 -8.440460      8.996543 0.99 
1 1 1 34  8  17 o 77.18529 8.290949 114.7917  332.8 1.016747       16.58190 0.94 
1 1 1 34  8  18 o 81.56051 7.614546 102.4688  65.8  2.345306       15.22909 0.95 
1 1 1 34  8  19 f 114.1688 6.029549 155.0194  175.9 -40.47962      12.05910 0.00 
1 1 1 34  8  20 o 42.54515 10.90398 43.85276  79.7  -7.268967      21.80795 0.72 
1 1 1 34  8  21 o 37.25199 10.63322 51.45504  325.9 ?              ?        0.77 
1 1 1 34  10 0  f 129.8921 4.012722 150.5121  176.8 15.47700       8.025445 0.00 
1 1 1 34  10 1  o 165.1772 3.808141 167.9977  66.0  3.837418       7.616282 0.97 
1 1 1 34  10 2  o 225.5380 4.624402 300.5642  44.9  -35.03676      9.248803 0.99 
1 1 1 34  10 3  o 156.9121 3.904143 191.6656  191.0 9.224564       7.808287 0.97 
1 1 1 34  10 4  o 184.2320 3.676765 290.5849  169.1 12.05377       7.353530 0.99 
1 1 1 34  10 5  o 181.0533 3.561279 292.7657  105.5 -22.62840      7.122559 0.99 
1 1 1 34  10 6  o 81.99487 6.970304 98.26057  177.7 -9.160255      13.94061 0.92 
1 1 1 34  10 7  o 129.4953 4.236363 246.3832  216.4 -1.097427      8.472726 0.98 
1 1 1 34  10 8  o 174.8864 4.063148 236.1026  100.0 -41.90514      8.126295 0.98 
1 1 1 34  10 9  o 67.57891 8.381993 163.7417  103.8 -38.42795      16.76399 0.92 
1 1 1 34  10 10 o 49.43800 9.091170 58.24969  164.0 23.64148       18.18234 0.65 
1 1 1 34  10 11 o 43.49148 10.27411 27.17816  106.6 7.671806       20.54821 0.36 
1 1 1 34  10 12 o 42.20622 9.718111 67.59923  170.2 -8.180050      19.43622 0.72 
1 1 1 34  10 13 o 89.55121 6.570658 110.5992  222.1 -27.98833      13.14132 0.95 
1 1 1 34  10 14 o 46.81935 10.59358 76.25600  331.0 2.129486       21.18716 0.85 
1 1 1 34  10 15 o 50.54921 10.65822 45.82799  36.9  2.044304       21.31643 0.78 
1 1 1 34  10 16 f 38.30426 9.797706 75.43169  227.3 -2.759464      19.59541 0.00 
1 1 1 34  10 17 o 37.49371 10.67423 20.94742  71.1  -11.33260      21.34846 0.42 
1 1 1 34  10 18 o 38.30506 10.78239 59.74168  339.4 ?              ?        0.80 
1 1 1 34  12 0  o 68.55595 6.966046 101.8248  77.5  10.31425       13.93209 0.89 
1 1 1 34  12 1  o 100.0791 4.604845 186.9602  307.0 -17.75880      9.209689 0.96 
1 1 1 34  12 2  o 151.8211 4.089075 255.8182  293.8 -21.03200      8.178150 0.98 
1 1 1 34  12 3  o 103.6306 5.250508 158.6322  176.2 2.984802       10.50102 0.95 
1 1 1 34  12 4  o 31.45003 9.099192 91.00597  125.1 -10.98532      18.19838 0.68 
1 1 1 34  12 5  o 56.43929 9.498713 123.6657  37.2  -4.867592      18.99743 0.89 
1 1 1 34  12 6  o 33.82052 9.568948 41.57444  47.7  2.257053       19.13790 0.46 
1 1 1 34  12 7  o 65.31049 8.769572 64.47061  296.9 26.51144       17.53914 0.84 
1 1 1 34  12 8  o 42.99450 10.13833 44.89294  218.8 3.236908       20.27665 0.65 
1 1 1 34  12 9  o 153.3256 4.676909 245.4180  100.4 13.06866       9.353819 0.99 
1 1 1 34  12 10 o 28.28325 8.648381 18.33390  203.5 -5.458937      17.29676 0.29 
1 1 1 34  12 11 o 97.86997 6.361691 174.9830  245.3 -8.650314      12.72338 0.98 
1 1 1 34  12 12 o 119.5350 5.906981 173.4046  244.3 -18.80920      11.81396 0.98 
1 1 1 34  12 13 f 33.05885 9.721375 27.20677  296.1 -8.840485      19.44275 0.00 
1 1 1 34  12 14 o 54.83184 9.513010 97.50120  154.9 41.23877       19.02602 0.93 
1 1 1 34  12 15 o 36.81221 10.59704 39.55979  233.5 ?              ?        0.70 
1 1 1 34  14 0  o 32.17400 9.579597 81.62533  328.6 -1.882099      19.15919 0.80 
1 1 1 34  14 1  o 48.70073 9.284084 67.24037  31.9  30.88036       18.56817 0.85 
1 1 1 34  14 2  o 66.07619 8.103266 99.84991  15.7  11.31404       16.20653 0.94 
1 1 1 34  14 3  o 25.40919 8.457549 34.23057  171.4 0.5438709      16.91510 0.50 
1 1 1 34  14 4  o 134.4474 4.351354 193.4857  177.1 3.175461       8.702708 0.99 
1 1 1 34  14 5  o 49.26187 9.534432 88.20794  188.1 -20.02835      19.06886 0.91 
1 1 1 34  14 6  o 57.42139 9.533862 46.49895  356.6 20.54357       19.06772 0.84 
1 1 1 34  14 7  o 112.6211 5.536361 173.3926  80.8  -21.72881      11.07272 0.98 
1 1 1 34  14 8  o 80.11392 7.324724 141.2265  141.0 24.03375       14.64945 0.97 
1 1 1 34  14 9  o 108.1241 5.493301 175.0458  184.5 12.04795       10.98660 0.98 
1 1 1 34  14 10 o 42.96641 10.08627 53.62779  194.3 ?              ?        0.84 
1 1 1 34  16 0  o 37.42062 10.41665 69.02678  65.5  ?              ?        0.86 
1 1 1 34  16 1  o 37.84955 10.46739 74.33156  36.4  ?              ?        0.88 
1 1 1 34  16 2  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 35  1  0  o 128.2411 3.505188 378.0000  328.3 -7.338905      7.010376 0.84 
1 1 1 35  1  1  o 490.2662 4.322414 550.1476  230.4 -23.26990      8.644829 0.98 
1 1 1 35  1  2  o 404.7253 3.714144 523.5173  154.9 60.13638       7.428288 0.98 
1 1 1 35  1  3  o 330.2538 3.325502 399.6273  353.4 -44.38092      6.651004 0.96 
1 1 1 35  1  4  o 418.8481 3.577769 354.8328  322.3 16.13089       7.155538 0.98 
1 1 1 35  1  5  o 298.0691 2.989019 298.3727  163.6 -7.519745      5.978039 0.96 
1 1 1 35  1  6  o 240.4144 2.875950 355.2262  168.2 15.04243       5.751899 0.97 
1 1 1 35  1  7  o 133.3333 2.642147 190.9878  309.1 55.91568       5.284293 0.92 
1 1 1 35  1  8  o 178.1517 2.487879 231.5286  115.9 -10.76208      4.975758 0.95 
1 1 1 35  1  9  o 88.43829 3.661611 136.1920  21.5  11.15092       7.323222 0.82 
1 1 1 35  1  10 o 440.7908 3.673435 664.5222  245.5 31.28937       7.346871 0.99 
1 1 1 35  1  11 o 158.9359 3.235891 253.2952  296.4 42.01498       6.471782 0.96 
1 1 1 35  1  12 o 256.5865 3.276254 320.1324  323.6 36.51378       6.552508 0.99 
1 1 1 35  1  13 o 165.1879 3.350023 244.0966  314.4 13.88852       6.700045 0.97 
1 1 1 35  1  14 o 155.5225 3.518342 156.5930  174.9 -4.043213      7.036685 0.96 
1 1 1 35  1  15 o 84.46503 5.040010 139.6164  94.9  26.74468       10.08002 0.93 
1 1 1 35  1  16 o 153.4619 3.811221 223.6995  230.1 -3.085037      7.622442 0.98 
1 1 1 35  1  17 o 186.2529 3.724182 184.9183  206.9 -15.56801      7.448364 0.97 
1 1 1 35  1  18 o 124.7541 4.960160 118.9919  227.9 -0.8983688     9.920321 0.93 
1 1 1 35  1  19 o 128.2579 4.331062 178.5646  276.2 -8.953003      8.662125 0.96 
1 1 1 35  1  20 o 37.14544 10.10280 21.25895  286.3 -4.055038      20.20559 0.28 
1 1 1 35  1  21 f 36.95985 9.879707 31.94045  262.2 -0.4174690     19.75941 0.00 
1 1 1 35  1  22 o 32.37015 9.696203 22.62338  244.1 12.90401       19.39241 0.35 
1 1 1 35  1  23 o 50.85442 10.64539 40.42719  246.3 -13.84066      21.29078 0.71 
1 1 1 35  1  24 o 76.23640 8.199883 62.58028  188.3 ?              ?        0.91 
1 1 1 35  3  0  o 284.1375 3.574412 291.1447  317.1 56.25793       7.148824 0.93 
1 1 1 35  3  1  o 305.8445 3.208837 429.5927  310.1 13.62387       6.417675 0.96 
1 1 1 35  3  2  o 473.3669 3.779325 804.0879  171.9 37.14630       7.558650 0.99 
1 1 1 35  3  3  o 168.9734 2.497740 285.0968  25.4  -2.979645      4.995480 0.92 
1 1 1 35  3  4  o 326.9807 2.978279 448.4340  342.5 10.72348       5.956558 0.98 
1 1 1 35  3  5  o 147.5208 2.626894 217.1088  256.8 20.98756       5.253788 0.92 
1 1 1 35  3  6  o 304.6390 2.887700 406.8282  100.0 -58.88278      5.775400 0.99 
1 1 1 35  3  7  o 344.4386 3.354643 425.1129  210.0 -49.81335      6.709286 0.99 
1 1 1 35  3  8  o 300.2893 3.301780 368.4768  270.0 6.640991       6.603560 0.98 
1 1 1 35  3  9  o 146.7557 3.251435 238.1266  338.2 0.4284668E-01  6.502870 0.95 
1 1 1 35  3  10 o 121.9738 3.641390 132.6824  69.0  -17.21174      7.282780 0.90 
1 1 1 35  3  11 o 250.3345 3.173234 347.5605  198.0 -28.76434      6.346469 0.99 
1 1 1 35  3  12 o 194.3945 3.092577 240.2551  192.4 10.49275       6.185153 0.98 
1 1 1 35  3  13 o 60.73103 9.199974 71.18755  299.4 3.768044       18.39995 0.70 
1 1 1 35  3  14 o 115.3459 4.085993 105.8636  181.3 25.32314       8.171986 0.93 
1 1 1 35  3  15 o 213.6473 3.446517 244.7252  52.9  -29.42033      6.893034 0.99 
1 1 1 35  3  16 o 131.9073 4.176381 169.1770  296.8 19.95396       8.352762 0.96 
1 1 1 35  3  17 o 194.5279 3.658584 257.0565  325.5 14.28479       7.317168 0.98 
1 1 1 35  3  18 o 38.62389 9.757916 39.47085  347.3 -7.962273      19.51583 0.39 
1 1 1 35  3  19 f 56.68562 8.747586 61.75168  332.4 -33.26281      17.49517 0.00 
1 1 1 35  3  20 o 59.11863 9.577523 71.54338  293.0 -23.54983      19.15505 0.84 
1 1 1 35  3  21 o 67.04696 8.753401 95.24744  328.3 -12.79988      17.50680 0.92 
1 1 1 35  3  22 o 44.45368 10.54732 43.87908  199.2 5.109669       21.09464 0.69 
1 1 1 35  3  23 o 78.13554 9.020209 100.3861  159.9 -26.60920      18.04042 0.94 
1 1 1 35  3  24 x ?        ?        27.81758  109.5 ?              ?        0.00 
1 1 1 35  5  0  o 240.4369 2.926932 387.8272  62.0  30.43239       5.853865 0.97 
1 1 1 35  5  1  o 178.9350 2.747663 155.9336  213.6 -23.64349      5.495327 0.88 
1 1 1 35  5  2  o 60.62494 5.327878 103.2103  100.8 -11.56711      10.65576 0.61 
1 1 1 35  5  3  o 409.5367 3.497967 653.6680  15.1  -4.070404      6.995934 0.99 
1 1 1 35  5  4  o 133.0155 3.326168 206.3562  75.8  -20.51332      6.652337 0.93 
1 1 1 35  5  5  o 156.5519 3.036211 264.8287  148.6 -34.81488      6.072421 0.96 
1 1 1 35  5  6  o 193.0308 2.885263 323.0462  327.4 -16.61624      5.770526 0.97 
1 1 1 35  5  7  o 144.2297 3.467838 306.4675  122.3 35.22961       6.935676 0.96 
1 1 1 35  5  8  o 225.6578 3.215952 399.4267  96.0  -9.279633      6.431903 0.98 
1 1 1 35  5  9  o 216.8459 3.010279 333.1336  352.2 29.04068       6.020559 0.98 
1 1 1 35  5  10 o 93.82489 4.054082 121.9918  31.3  13.00484       8.108165 0.90 
1 1 1 35  5  11 o 84.21481 4.993493 124.5510  221.9 -6.355087      9.986985 0.90 
1 1 1 35  5  12 o 166.1031 3.237520 234.3972  267.1 5.157852       6.475039 0.98 
1 1 1 35  5  13 o 158.9512 3.685801 211.0986  242.8 -10.16098      7.371602 0.98 
1 1 1 35  5  14 o 29.15492 8.567648 30.55588  320.8 6.934853       17.13530 0.28 
1 1 1 35  5  15 f 64.43803 8.315017 45.00190  285.3 17.18894       16.63003 0.00 
1 1 1 35  5  16 o 62.96066 7.340840 122.7093  67.5  2.406933       14.68168 0.87 
1 1 1 35  5  17 o 89.09940 6.240775 103.4490  53.2  22.05066       12.48155 0.90 
1 1 1 35  5  18 o 137.5107 4.414235 188.7439  150.7 3.664963       8.828470 0.97 
1 1 1 35  5  19 o 27.13854 8.858383 25.62514  198.8 5.264664       17.71677 0.30 
1 1 1 35  5  20 f 96.95914 5.659417 90.59627  34.0  -4.292328      11.31883 0.00 
1 1 1 35  5  21 o 65.25315 9.458422 119.1269  227.2 -11.14145      18.91684 0.94 
1 1 1 35  5  22 o 37.20091 10.68561 75.83139  207.6 -2.339584      21.37122 0.82 
1 1 1 35  5  23 f 35.04378 10.30784 9.552487  141.5 ?              ?        0.00 
1 1 1 35  7  0  o 36.16808 8.658817 116.4807  146.5 10.30450       17.31763 0.56 
1 1 1 35  7  1  o 118.1689 4.196499 128.3249  207.8 -13.98225      8.392998 0.89 
1 1 1 35  7  2  o 162.5118 4.329589 229.9373  273.6 -7.350601      8.659178 0.95 
1 1 1 35  7  3  o 180.5472 3.308221 272.9786  192.8 14.15121       6.616443 0.97 
1 1 1 35  7  4  o 28.31132 8.255968 139.7733  2.7   -0.8425922     16.51194 0.54 
1 1 1 35  7  5  o 209.6494 3.252019 369.4712  352.4 23.94749       6.504038 0.98 
1 1 1 35  7  6  o 81.45990 5.684465 111.9675  101.5 7.824883       11.36893 0.87 
1 1 1 35  7  7  o 244.1602 3.124909 324.2145  139.4 -7.934143      6.249817 0.99 
1 1 1 35  7  8  o 66.07533 7.192395 117.9362  237.4 -32.42852      14.38479 0.86 
1 1 1 35  7  9  o 82.57465 5.421942 73.08035  314.8 5.128357       10.84388 0.82 
1 1 1 35  7  10 o 136.2764 3.968234 194.2664  37.6  37.55036       7.936469 0.97 
1 1 1 35  7  11 o 109.1025 4.380990 158.5907  347.5 13.49332       8.761980 0.96 
1 1 1 35  7  12 o 122.0455 4.508904 137.1192  279.3 -29.42513      9.017808 0.96 
1 1 1 35  7  13 o 152.6635 3.913231 200.1739  235.5 -6.149551      7.826463 0.97 
1 1 1 35  7  14 o 117.6643 4.294585 157.0852  23.5  3.613464       8.589170 0.95 
1 1 1 35  7  15 o 66.23318 8.743556 153.5096  16.3  28.78233       17.48711 0.91 
1 1 1 35  7  16 o 68.92610 8.852534 46.40495  264.5 23.10722       17.70507 0.74 
1 1 1 35  7  17 o 42.88303 9.769872 91.15863  313.5 -24.37528      19.53974 0.83 
1 1 1 35  7  18 o 41.21659 10.59946 72.03646  112.2 4.551441       21.19891 0.81 
1 1 1 35  7  19 o 98.96962 6.956944 123.6038  138.4 -9.985985      13.91389 0.96 
1 1 1 35  7  20 o 135.2416 5.645957 148.3577  95.5  -14.09108      11.29191 0.98 
1 1 1 35  7  21 o 71.28989 9.331016 88.83598  32.1  ?              ?        0.94 
1 1 1 35  9  0  o 51.39759 8.765593 95.83691  235.1 19.70008       17.53119 0.74 
1 1 1 35  9  1  f 196.9611 3.645760 257.2069  208.9 1.917709       7.291520 0.00 
1 1 1 35  9  2  f 161.5179 3.476566 185.8133  100.1 -5.793594      6.953132 0.00 
1 1 1 35  9  3  o 53.38423 7.998041 77.87214  18.6  9.351311       15.99608 0.72 
1 1 1 35  9  4  o 141.6007 3.977732 228.4829  274.1 28.43945       7.955465 0.97 
1 1 1 35  9  5  o 149.4553 3.888062 243.1008  254.5 19.91489       7.776124 0.98 
1 1 1 35  9  6  o 32.40471 8.546550 61.30592  136.0 27.16590       17.09310 0.53 
1 1 1 35  9  7  o 109.8566 4.638580 202.5352  209.6 -0.1872559     9.277160 0.97 
1 1 1 35  9  8  o 84.07025 6.264510 120.1964  73.5  -26.94506      12.52902 0.93 
1 1 1 35  9  9  o 71.48613 7.619892 78.76745  191.3 -16.84656      15.23978 0.85 
1 1 1 35  9  10 o 107.2821 4.853288 161.3798  231.8 19.14043       9.706576 0.95 
1 1 1 35  9  11 f 140.8592 4.202496 153.3732  189.7 19.54770       8.404992 0.00 
1 1 1 35  9  12 o 156.7709 3.950803 206.6405  150.4 42.63924       7.901607 0.98 
1 1 1 35  9  13 o 35.95263 8.654012 50.34189  135.0 -21.75289      17.30802 0.54 
1 1 1 35  9  14 o 67.76656 6.999221 90.68913  15.2  10.10775       13.99844 0.90 
1 1 1 35  9  15 o 39.29286 10.25998 67.57207  89.6  -8.003143      20.51995 0.78 
1 1 1 35  9  16 o 53.50682 9.530087 93.37008  151.4 43.12049       19.06017 0.91 
1 1 1 35  9  17 o 47.79042 10.79086 28.29363  176.7 10.81359       21.58172 0.59 
1 1 1 35  9  18 o 37.67832 10.62131 22.92247  88.2  20.66298       21.24262 0.45 
1 1 1 35  9  19 o 54.02115 10.41290 82.38335  182.2 ?              ?        0.91 
1 1 1 35  11 0  o 120.8325 4.124303 203.1839  136.1 33.40739       8.248607 0.98 
1 1 1 35  11 1  f 87.81352 6.349226 157.1464  99.9  -2.825142      12.69845 0.00 
1 1 1 35  11 2  o 68.07352 9.205547 77.94481  318.3 -1.964798      18.41109 0.86 
1 1 1 35  11 3  o 37.77205 9.962537 66.51157  264.0 5.988159       19.92507 0.64 
1 1 1 35  11 4  o 115.3987 4.746965 182.6161  31.7  24.68771       9.493930 0.96 
1 1 1 35  11 5  o 164.2014 4.093497 277.1818  81.8  10.71400       8.186994 0.98 
1 1 1 35  11 6  o 100.3326 6.097542 121.3964  97.1  15.97237       12.19508 0.93 
1 1 1 35  11 7  o 39.29862 9.876749 35.47551  29.8  14.64798       19.75350 0.40 
1 1 1 35  11 8  o 45.35769 9.106977 111.4507  16.3  42.17669       18.21395 0.84 
1 1 1 35  11 9  o 32.97164 9.335243 63.60784  42.8  10.13807       18.67049 0.62 
1 1 1 35  11 10 o 43.90538 10.48722 77.67392  139.0 5.820782       20.97445 0.81 
1 1 1 35  11 11 o 47.79515 9.755826 76.54572  140.3 -20.77234      19.51165 0.85 
1 1 1 35  11 12 o 72.08873 8.896402 114.7665  319.0 -21.95193      17.79280 0.95 
1 1 1 35  11 13 o 141.7968 4.793445 199.3202  288.2 -8.407028      9.586890 0.99 
1 1 1 35  11 14 o 34.59712 9.015853 21.95958  76.1  33.78413       18.03171 0.42 
1 1 1 35  11 15 o 61.50756 10.16925 79.21412  110.1 -17.59501      20.33850 0.91 
1 1 1 35  11 16 o 75.06763 7.693326 130.9132  99.4  ?              ?        0.97 
1 1 1 35  13 0  o 101.9686 5.554496 154.2034  329.6 29.26985       11.10899 0.96 
1 1 1 35  13 1  o 65.68868 8.088401 93.13954  358.5 7.999119       16.17680 0.90 
1 1 1 35  13 2  o 114.5131 5.250189 149.8574  105.9 -5.911873      10.50038 0.97 
1 1 1 35  13 3  o 112.2798 5.125288 192.4379  151.5 -16.92867      10.25058 0.98 
1 1 1 35  13 4  o 72.25182 7.982830 129.8530  59.6  -7.610703      15.96566 0.95 
1 1 1 35  13 5  f 73.25916 7.924892 125.2177  297.6 10.64538       15.84978 0.00 
1 1 1 35  13 6  o 172.1026 4.655373 242.3442  276.7 -2.065872      9.310745 0.99 
1 1 1 35  13 7  o 42.73862 10.54024 69.62593  57.7  11.72919       21.08047 0.85 
1 1 1 35  13 8  o 101.4123 6.259482 179.9021  86.2  49.32866       12.51896 0.98 
1 1 1 35  13 9  f 72.12759 9.957811 83.86253  147.8 1.266655       19.91562 0.00 
1 1 1 35  13 10 o 32.66532 9.915372 56.13740  290.2 10.05970       19.83074 0.75 
1 1 1 35  13 11 o 29.62763 9.199477 32.93783  234.6 13.56755       18.39895 0.56 
1 1 1 35  13 12 o 34.44420 10.19476 24.47350  174.5 ?              ?        0.52 
1 1 1 35  15 0  o 42.81133 9.247798 57.38611  30.1  -29.71365      18.49560 0.83 
1 1 1 35  15 1  o 87.93755 6.989390 148.5866  302.6 29.91652       13.97878 0.97 
1 1 1 35  15 2  o 32.95847 9.808282 50.34374  315.1 9.367676       19.61656 0.74 
1 1 1 35  15 3  o 45.38518 9.107718 67.81483  155.8 33.21009       18.21544 0.88 
1 1 1 35  15 4  o 108.2610 5.954678 165.3667  108.8 3.134232       11.90936 0.98 
1 1 1 35  15 5  o 59.44294 9.314656 132.2821  32.9  ?              ?        0.96 
1 1 1 35  15 6  x ?        ?        137.4313  296.3 ?              ?        0.00 
1 1 1 36  0  0  o 397.8768 5.456854 602.0297  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  1  o 216.0251 4.038117 144.5949  180.0 0.000000       0.000000 0.96 
1 1 1 36  0  2  o 152.3153 4.916420 386.3721  180.0 0.000000       0.000000 0.99 
1 1 1 36  0  3  f 126.6132 4.437601 167.3250  0.0   0.000000       0.000000 0.00 
1 1 1 36  0  4  o 27.23196 13.78849 122.5699  0.0   0.000000       0.000000 0.21 
1 1 1 36  0  5  o 258.2238 4.480820 223.7135  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  6  o 126.0676 3.533777 119.2330  180.0 0.000000       0.000000 0.89 
1 1 1 36  0  7  o 191.5124 3.485811 214.6254  180.0 0.000000       0.000000 1.00 
1 1 1 36  0  8  o 205.8155 3.459429 174.4751  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  9  o 223.3953 3.625278 166.7403  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  10 o 259.8861 4.349214 323.9098  180.0 0.000000       0.000000 1.00 
1 1 1 36  0  11 o 137.7341 5.051820 275.2656  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  12 o 161.8583 4.624298 228.7407  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  13 o 121.4428 6.111778 123.2250  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  14 o 42.99390 14.75562 70.10751  0.0   0.000000       0.000000 0.66 
1 1 1 36  0  15 o 67.80347 10.55421 162.2858  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  16 o 81.03201 7.817560 165.9203  0.0   0.000000       0.000000 1.00 
1 1 1 36  0  17 o 37.06960 15.58691 83.28892  0.0   0.000000       0.000000 0.62 
1 1 1 36  0  18 o 137.1168 6.189508 144.4512  180.0 0.000000       0.000000 1.00 
1 1 1 36  0  19 o 122.5480 5.834594 128.1149  180.0 0.000000       0.000000 1.00 
1 1 1 36  0  20 o 30.71164 16.96048 47.80821  0.0   0.000000       0.000000 0.51 
1 1 1 36  0  21 o 33.53338 19.90972 21.21983  180.0 0.000000       0.000000 0.31 
1 1 1 36  0  22 o 51.75354 17.51577 22.92449  180.0 0.000000       0.000000 0.51 
1 1 1 36  0  23 o 39.94939 17.88721 22.33246  180.0 0.000000       0.000000 0.42 
1 1 1 36  0  24 o 42.25658 19.00940 15.67588  0.0   ?              ?        0.35 
1 1 1 36  2  0  o 317.1910 3.197320 305.2326  222.3 40.77646       6.394640 0.95 
1 1 1 36  2  1  o 83.25641 4.604692 129.3875  282.8 26.78812       9.209383 0.45 
1 1 1 36  2  2  o 86.17474 4.680492 114.6864  189.3 48.58063       9.360985 0.55 
1 1 1 36  2  3  o 74.80731 4.926142 168.1608  105.6 -19.34611      9.852284 0.67 
1 1 1 36  2  4  o 297.8908 2.995376 387.4949  257.3 18.25876       5.990752 0.97 
1 1 1 36  2  5  o 243.8062 2.764911 239.5770  177.5 26.13927       5.529822 0.96 
1 1 1 36  2  6  o 272.5035 2.710172 425.0278  109.7 -87.63861      5.420344 0.98 
1 1 1 36  2  7  o 111.6249 3.034401 176.2725  142.0 -38.82445      6.068803 0.90 
1 1 1 36  2  8  o 303.5671 3.315040 448.8928  249.6 19.98401       6.630081 0.99 
1 1 1 36  2  9  o 163.4977 2.953635 177.8408  284.9 28.95256       5.907269 0.94 
1 1 1 36  2  10 o 159.7404 2.972290 185.0091  336.7 -5.946121      5.944580 0.95 
1 1 1 36  2  11 o 183.0060 2.941132 151.3300  220.1 -11.47820      5.882265 0.96 
1 1 1 36  2  12 o 203.3305 3.139539 222.0172  217.9 1.830490       6.279077 0.98 
1 1 1 36  2  13 o 289.0270 3.502844 391.0674  196.1 11.85614       7.005688 0.99 
1 1 1 36  2  14 o 185.2554 3.464036 224.9775  176.0 13.95740       6.928073 0.98 
1 1 1 36  2  15 o 111.5220 4.800349 115.5304  346.4 -2.075790      9.600698 0.94 
1 1 1 36  2  16 o 87.11671 6.084174 84.13268  94.8  -13.05708      12.16835 0.86 
1 1 1 36  2  17 o 143.1897 4.325888 139.7150  120.0 -22.50180      8.651776 0.95 
1 1 1 36  2  18 o 64.40691 7.137088 109.4366  235.1 -1.498550      14.27418 0.86 
1 1 1 36  2  19 f 66.89554 7.756017 91.80202  288.2 -1.347412      15.51203 0.00 
1 1 1 36  2  20 o 47.55743 9.212009 84.59131  126.0 21.04171       18.42402 0.84 
1 1 1 36  2  21 o 44.12109 10.94203 54.33017  308.8 -5.039513      21.88405 0.76 
1 1 1 36  2  22 o 62.89248 8.980434 73.37167  218.5 37.06671       17.96087 0.89 
1 1 1 36  2  23 o 45.04075 10.31973 59.67285  151.1 -24.66720      20.63947 0.81 
1 1 1 36  2  24 x ?        ?        66.03364  186.3 ?              ?        0.00 
1 1 1 36  4  0  o 447.2659 3.936107 549.2725  333.3 21.87088       7.872215 0.99 
1 1 1 36  4  1  o 222.9503 2.764640 396.1215  267.4 -0.2739868     5.529281 0.96 
1 1 1 36  4  2  o 170.9807 2.633616 382.6194  228.8 -26.86903      5.267231 0.96 
1 1 1 36  4  3  o 320.6708 3.047687 428.2408  34.3  18.35385       6.095375 0.98 
1 1 1 36  4  4  o 275.1008 2.826561 354.5788  171.5 19.55154       5.653122 0.98 
1 1 1 36  4  5  o 353.5816 3.407563 509.6687  261.7 20.21912       6.815126 0.99 
1 1 1 36  4  6  o 77.20432 5.786210 54.27751  341.9 69.78400       11.57242 0.56 
1 1 1 36  4  7  o 311.5135 3.252734 350.5209  155.4 -10.77463      6.505469 0.98 
1 1 1 36  4  8  o 54.51831 7.414748 12.72413  154.0 -20.58654      14.82950 0.12 
1 1 1 36  4  9  o 118.3682 3.630278 182.7514  321.9 19.94239       7.260556 0.94 
1 1 1 36  4  10 o 156.0038 3.626744 227.4688  180.8 -8.531555      7.253488 0.97 
1 1 1 36  4  11 f 19.83072 6.681822 131.4267  242.0 6.520395       13.36364 0.00 
1 1 1 36  4  12 o 68.41624 6.623964 85.66758  308.2 -17.16090      13.24793 0.81 
1 1 1 36  4  13 o 80.14787 5.125901 155.5563  289.0 12.60921       10.25180 0.93 
1 1 1 36  4  14 o 135.4498 3.896653 141.8549  242.2 11.86107       7.793306 0.96 
1 1 1 36  4  15 o 69.23837 6.441734 23.81459  304.1 8.238953       12.88347 0.41 
1 1 1 36  4  16 o 45.53178 8.886884 74.90702  182.2 -12.31104      17.77377 0.65 
1 1 1 36  4  17 o 75.10716 6.696618 104.3269  275.9 5.936127       13.39324 0.88 
1 1 1 36  4  18 o 28.76291 8.734999 14.76522  114.9 12.59910       17.47000 0.14 
1 1 1 36  4  19 o 40.03357 10.55264 35.09111  224.7 2.800831       21.10527 0.50 
1 1 1 36  4  20 o 34.95133 9.062710 32.72515  52.5  -21.61731      18.12542 0.52 
1 1 1 36  4  21 o 41.09599 10.95265 45.21428  216.8 11.56413       21.90531 0.68 
1 1 1 36  4  22 o 121.3550 5.267460 153.6430  226.0 13.38681       10.53492 0.98 
1 1 1 36  4  23 o 28.67520 9.233867 35.28022  293.7 ?              ?        0.54 
1 1 1 36  6  0  o 159.3016 2.820077 253.7668  309.0 -16.77220      5.640154 0.96 
1 1 1 36  6  1  o 176.9406 2.557163 351.2581  33.1  -16.45706      5.114326 0.97 
1 1 1 36  6  2  o 362.1321 3.783982 559.1245  69.7  7.339539       7.567964 0.99 
1 1 1 36  6  3  o 128.6825 3.772056 219.5624  99.9  -4.210388      7.544113 0.93 
1 1 1 36  6  4  o 76.38167 4.844240 87.56686  232.2 11.98560       9.688480 0.62 
1 1 1 36  6  5  o 171.1161 3.128217 219.2733  254.8 -17.23155      6.256435 0.96 
1 1 1 36  6  6  o 245.1507 3.387745 326.4179  347.3 -8.906586      6.775490 0.98 
1 1 1 36  6  7  o 152.8283 3.228767 283.7711  90.6  12.68527       6.457533 0.97 
1 1 1 36  6  8  o 92.53870 4.720446 114.5743  175.3 -8.807381      9.440891 0.89 
1 1 1 36  6  9  o 94.93649 5.092762 18.07259  138.5 -27.99344      10.18552 0.39 
1 1 1 36  6  10 o 91.90399 4.786658 122.6061  71.6  7.769554       9.573317 0.91 
1 1 1 36  6  11 o 125.5687 4.031243 179.6637  322.7 -4.972260      8.062486 0.97 
1 1 1 36  6  12 o 157.3621 3.910018 243.2175  273.1 -8.033463      7.820036 0.98 
1 1 1 36  6  13 o 111.8104 4.560167 118.5573  227.5 -3.973434      9.120334 0.94 
1 1 1 36  6  14 o 45.39458 9.184148 31.07573  344.5 -10.50632      18.36830 0.34 
1 1 1 36  6  15 o 43.11447 8.998796 105.1858  20.7  -24.86712      17.99759 0.77 
1 1 1 36  6  16 o 153.6599 4.377481 205.8742  97.3  9.904449       8.754962 0.98 
1 1 1 36  6  17 o 122.4927 5.047175 143.8246  97.3  33.53711       10.09435 0.97 
1 1 1 36  6  18 o 58.46815 9.769189 69.05099  305.3 -26.99274      19.53838 0.86 
1 1 1 36  6  19 o 36.58041 10.39773 39.22544  19.0  -4.055870      20.79545 0.60 
1 1 1 36  6  20 o 161.9140 4.971596 228.7192  55.3  -9.211502      9.943192 0.99 
1 1 1 36  6  21 o 41.77080 10.19626 58.42559  323.0 34.10735       20.39252 0.80 
1 1 1 36  6  22 x ?        ?        33.11407  269.7 ?              ?        0.00 
1 1 1 36  8  0  o 105.3889 4.553398 168.9123  110.1 0.6618271      9.106795 0.92 
1 1 1 36  8  1  o 121.1559 4.414438 247.4034  206.2 -28.72964      8.828876 0.96 
1 1 1 36  8  2  o 77.50069 5.869990 80.50429  230.5 1.653969       11.73998 0.78 
1 1 1 36  8  3  o 121.7687 4.602806 139.2838  250.9 5.520813       9.205611 0.94 
1 1 1 36  8  4  o 62.39996 7.759735 44.82814  169.2 31.85837       15.51947 0.56 
1 1 1 36  8  5  o 166.9199 3.154600 233.4962  310.4 8.119461       6.309199 0.98 
1 1 1 36  8  6  o 376.5573 3.869045 474.6790  298.0 6.419067       7.738089 0.99 
1 1 1 36  8  7  o 201.0946 3.219643 292.8240  263.7 17.62430       6.439286 0.99 
1 1 1 36  8  8  o 29.25235 7.861019 44.60941  45.0  -12.29619      15.72204 0.40 
1 1 1 36  8  9  o 160.2204 3.517300 235.4055  159.5 -23.29665      7.034601 0.98 
1 1 1 36  8  10 o 76.27268 6.876110 117.1833  131.6 -28.16274      13.75222 0.91 
1 1 1 36  8  11 o 108.3706 4.738898 112.0710  358.8 19.92980       9.477796 0.92 
1 1 1 36  8  12 o 65.84966 7.028979 73.01233  356.1 7.888737       14.05796 0.79 
1 1 1 36  8  13 o 34.19199 9.933208 73.40875  226.3 14.15888       19.86642 0.60 
1 1 1 36  8  14 o 125.3824 4.776538 212.7013  188.5 10.95921       9.553076 0.97 
1 1 1 36  8  15 o 68.15061 7.661261 96.97758  169.4 15.46080       15.32252 0.91 
1 1 1 36  8  16 o 33.62469 10.31286 32.02529  308.4 0.6866798      20.62572 0.47 
1 1 1 36  8  17 o 42.98594 10.78652 112.3202  268.6 -17.99670      21.57304 0.90 
1 1 1 36  8  18 o 29.38484 9.208379 50.98917  150.9 -1.647812      18.41676 0.64 
1 1 1 36  8  19 o 60.79214 11.10245 115.8403  163.5 10.77651       22.20490 0.94 
1 1 1 36  8  20 o 73.81674 10.25910 141.6470  147.1 ?              ?        0.96 
1 1 1 36  10 0  o 196.5529 3.775765 271.5071  245.3 10.01239       7.551530 0.98 
1 1 1 36  10 1  o 102.3395 4.903347 157.2324  274.9 -16.90091      9.806694 0.95 
1 1 1 36  10 2  o 54.59444 9.514769 37.88342  226.8 -23.89392      19.02954 0.57 
1 1 1 36  10 3  o 228.1922 3.463608 341.6723  323.2 -11.52884      6.927217 0.99 
1 1 1 36  10 4  o 359.2007 3.880748 511.9589  317.1 8.416290       7.761497 1.00 
1 1 1 36  10 5  o 114.4390 5.433834 198.5483  348.7 -23.02047      10.86767 0.97 
1 1 1 36  10 6  o 77.56889 6.180964 155.0512  69.8  25.15643       12.36193 0.93 
1 1 1 36  10 7  o 35.15446 9.499326 36.66273  229.2 5.711052       18.99865 0.34 
1 1 1 36  10 8  o 125.1925 4.394093 189.4536  240.9 -0.6835556     8.788186 0.97 
1 1 1 36  10 9  o 140.2369 4.159399 166.2365  220.4 10.53531       8.318797 0.97 
1 1 1 36  10 10 o 61.90220 8.568652 90.49522  113.8 27.19807       17.13730 0.86 
1 1 1 36  10 11 o 45.64349 9.679391 32.10086  248.0 22.31187       19.35878 0.50 
1 1 1 36  10 12 o 50.66017 10.76592 111.2908  112.1 2.161869       21.53184 0.89 
1 1 1 36  10 13 o 152.1859 4.290935 219.9420  153.8 8.301788       8.581869 0.99 
1 1 1 36  10 14 o 71.98353 8.573753 104.6822  39.1  -14.98836      17.14751 0.94 
1 1 1 36  10 15 o 69.64095 8.291626 58.80204  339.3 -1.419724      16.58325 0.89 
1 1 1 36  10 16 o 90.82738 7.218992 114.9885  120.5 5.834579       14.43798 0.96 
1 1 1 36  10 17 o 25.52643 8.542355 63.07592  108.7 ?              ?        0.74 
1 1 1 36  12 0  o 59.66823 9.262779 76.00968  66.8  -3.401421      18.52556 0.80 
1 1 1 36  12 1  o 29.09548 9.066378 35.90794  79.9  -0.8186970     18.13276 0.32 
1 1 1 36  12 2  o 142.9865 4.463037 190.7986  75.5  -6.622101      8.926073 0.97 
1 1 1 36  12 3  o 98.45408 5.208144 152.4704  114.7 4.416412       10.41629 0.95 
1 1 1 36  12 4  o 34.53523 9.645470 56.54448  359.6 11.95170       19.29094 0.57 
1 1 1 36  12 5  o 64.42847 8.872695 50.26033  303.9 -14.26956      17.74539 0.78 
1 1 1 36  12 6  o 43.06629 10.45662 92.18237  13.7  9.137444       20.91324 0.84 
1 1 1 36  12 7  o 26.05231 8.432517 35.89299  178.1 7.398149       16.86503 0.43 
1 1 1 36  12 8  o 66.48189 7.156225 109.1913  6.3   1.522911       14.31245 0.94 
1 1 1 36  12 9  o 33.40963 10.09920 34.23597  127.3 -1.479721      20.19840 0.56 
1 1 1 36  12 10 o 52.68890 10.43417 70.37245  91.8  12.98475       20.86834 0.88 
1 1 1 36  12 11 o 37.37545 10.24738 97.71476  68.5  -5.262356      20.49477 0.88 
1 1 1 36  12 12 o 54.92199 10.82855 82.31342  354.9 10.99288       21.65709 0.90 
1 1 1 36  12 13 o 67.83531 9.108625 99.19048  236.7 4.058113       18.21725 0.95 
1 1 1 36  12 14 o 31.83298 9.697819 27.17777  293.7 ?              ?        0.54 
1 1 1 36  14 0  o 43.74391 10.17789 67.09554  259.0 7.261749       20.35577 0.85 
1 1 1 36  14 1  o 32.29939 9.625289 67.94828  239.3 -10.05388      19.25058 0.80 
1 1 1 36  14 2  o 71.77959 7.842402 143.3101  47.5  20.38796       15.68480 0.97 
1 1 1 36  14 3  o 53.18838 9.959858 61.55138  2.2   -7.306950      19.91972 0.87 
1 1 1 36  14 4  o 37.87329 10.29167 84.00143  143.9 2.886589       20.58333 0.86 
1 1 1 36  14 5  o 94.19208 6.414418 156.2727  209.5 -2.974411      12.82884 0.98 
1 1 1 36  14 6  o 93.40125 6.274586 123.8212  306.3 5.034500       12.54917 0.97 
1 1 1 36  14 7  o 103.0331 5.796607 169.1699  3.0   25.08500       11.59321 0.98 
1 1 1 36  14 8  o 52.15836 8.999659 94.56510  356.3 ?              ?        0.93 
1 1 1 36  14 9  x ?        ?        5.264799  66.9  ?              ?        0.00 
1 1 1 37  1  0  o 346.8637 3.454164 382.9250  22.4  9.529205       6.908329 0.96 
1 1 1 37  1  1  o 598.8748 4.870437 791.7287  267.2 38.62268       9.740873 0.99 
1 1 1 37  1  2  o 261.2114 3.089111 250.7259  252.6 35.55655       6.178222 0.94 
1 1 1 37  1  3  o 383.9892 3.807779 446.1889  113.3 -14.27460      7.615558 0.98 
1 1 1 37  1  4  o 191.7570 3.585813 331.8253  277.1 -37.00912      7.171627 0.96 
1 1 1 37  1  5  o 218.4868 2.775255 266.7361  15.1  -18.83914      5.550510 0.96 
1 1 1 37  1  6  o 227.2913 2.737807 280.0912  305.6 -51.41901      5.475614 0.97 
1 1 1 37  1  7  o 225.3174 2.924756 251.2719  226.3 9.662415       5.849513 0.97 
1 1 1 37  1  8  o 117.7200 3.045604 126.9531  322.6 8.895866       6.091208 0.86 
1 1 1 37  1  9  o 159.4154 3.672723 252.2374  217.5 -2.046951      7.345447 0.96 
1 1 1 37  1  10 o 67.91541 5.120455 91.22066  187.1 -26.51083      10.24091 0.75 
1 1 1 37  1  11 o 46.28690 8.182778 100.8829  230.4 -16.39237      16.36556 0.70 
1 1 1 37  1  12 o 115.5098 3.946102 164.7451  231.9 6.333450       7.892204 0.94 
1 1 1 37  1  13 o 54.58949 7.703273 57.92088  240.1 -19.14259      15.40655 0.63 
1 1 1 37  1  14 o 99.32504 4.393453 119.3309  46.4  14.03244       8.786906 0.93 
1 1 1 37  1  15 o 83.51724 6.028933 146.6843  355.0 0.9187622      12.05787 0.93 
1 1 1 37  1  16 o 236.8991 3.238213 279.9081  2.2   -28.08696      6.476426 0.98 
1 1 1 37  1  17 o 51.26877 8.426936 87.20947  38.5  -3.835655      16.85387 0.74 
1 1 1 37  1  18 o 70.70415 11.44549 108.4556  211.6 14.41069       22.89098 0.88 
1 1 1 37  1  19 f 53.08168 10.13975 76.24265  105.8 4.699432       20.27950 0.00 
1 1 1 37  1  20 o 48.97023 9.616037 75.85322  69.1  7.853378       19.23207 0.84 
1 1 1 37  1  21 o 34.91913 10.30578 16.09158  142.1 1.526505       20.61157 0.27 
1 1 1 37  1  22 o 129.6139 4.852962 144.7438  210.3 2.712692       9.705923 0.98 
1 1 1 37  1  23 o 34.48642 10.34147 25.77855  192.9 ?              ?        0.45 
1 1 1 37  3  0  o 336.6487 3.702640 404.5052  311.9 -40.92432      7.405280 0.97 
1 1 1 37  3  1  o 535.4108 4.381393 840.2089  92.3  8.632629       8.762787 0.99 
1 1 1 37  3  2  o 249.8639 2.950105 307.7682  209.9 -36.90018      5.900209 0.96 
1 1 1 37  3  3  o 91.25066 4.055158 97.33881  144.3 13.68509       8.110316 0.69 
1 1 1 37  3  4  o 243.9232 2.692230 316.5989  86.1  28.29044       5.384460 0.97 
1 1 1 37  3  5  o 157.5099 2.812688 218.7407  47.6  -25.59282      5.625376 0.94 
1 1 1 37  3  6  o 187.6657 2.767095 175.6656  330.8 -8.420441      5.534189 0.94 
1 1 1 37  3  7  f 67.78432 5.767239 19.75341  321.8 -0.4680252     11.53448 0.00 
1 1 1 37  3  8  o 250.0435 3.053968 335.0856  271.0 -32.51627      6.107937 0.98 
1 1 1 37  3  9  o 41.02451 7.174977 70.32825  309.7 -25.37196      14.34995 0.46 
1 1 1 37  3  10 o 215.2624 3.048246 228.4562  58.8  -17.11879      6.096492 0.98 
1 1 1 37  3  11 o 160.6276 3.452266 206.4185  353.4 -27.95810      6.904533 0.97 
1 1 1 37  3  12 o 62.37299 5.687754 86.31941  190.0 1.346889       11.37551 0.79 
1 1 1 37  3  13 o 138.3673 4.560317 172.7689  167.9 -16.72592      9.120634 0.97 
1 1 1 37  3  14 o 75.49005 6.748199 101.8473  309.4 1.375366       13.49640 0.90 
1 1 1 37  3  15 o 31.98335 9.047535 11.15618  222.2 4.849430       18.09507 0.09 
1 1 1 37  3  16 o 198.5480 3.987060 287.0811  122.6 -20.45068      7.974120 0.98 
1 1 1 37  3  17 o 159.9637 4.061182 200.5352  161.0 -31.38243      8.122364 0.97 
1 1 1 37  3  18 o 131.1816 4.420523 150.1765  270.8 21.62992       8.841046 0.96 
1 1 1 37  3  19 o 58.87650 9.834238 17.96631  105.7 -19.17634      19.66848 0.40 
1 1 1 37  3  20 o 38.59710 10.38915 53.64380  84.9  -0.1734619     20.77830 0.72 
1 1 1 37  3  21 o 121.5213 5.966982 128.0394  72.0  -44.05206      11.93396 0.97 
1 1 1 37  3  22 o 45.67947 10.61409 71.33067  226.8 22.89590       21.22817 0.84 
1 1 1 37  3  23 o 55.31431 10.41105 86.28540  278.7 ?              ?        0.91 
1 1 1 37  5  0  o 158.3564 3.057591 318.3849  262.0 63.17336       6.115181 0.96 
1 1 1 37  5  1  o 89.65666 4.394570 116.2594  269.3 31.80850       8.789140 0.80 
1 1 1 37  5  2  o 300.3389 3.193615 367.0883  129.4 -2.165649      6.387229 0.98 
1 1 1 37  5  3  o 262.8704 2.786955 389.8158  194.4 -15.18585      5.573910 0.98 
1 1 1 37  5  4  o 179.6265 3.104786 220.0906  115.9 -43.63834      6.209573 0.96 
1 1 1 37  5  5  o 25.91200 7.497155 108.7761  112.4 -10.46849      14.99431 0.33 
1 1 1 37  5  6  o 111.2412 3.971283 134.7731  298.1 23.44077       7.942566 0.89 
1 1 1 37  5  7  o 88.00494 4.898728 117.3666  227.1 12.85146       9.797456 0.86 
1 1 1 37  5  8  o 77.34793 5.153622 160.7302  96.5  14.89992       10.30724 0.90 
1 1 1 37  5  9  o 37.64517 8.635549 38.48244  134.5 18.42362       17.27110 0.31 
1 1 1 37  5  10 o 117.3698 4.163761 146.8857  186.2 21.75094       8.327522 0.94 
1 1 1 37  5  11 o 136.8155 4.202702 175.0255  152.3 13.76373       8.405403 0.96 
1 1 1 37  5  12 o 95.92909 4.622134 147.7296  89.7  31.29762       9.244267 0.95 
1 1 1 37  5  13 o 67.22237 6.706317 115.5479  5.4   4.596054       13.41263 0.89 
1 1 1 37  5  14 o 64.43396 8.025873 54.79914  335.2 -56.01838      16.05175 0.66 
1 1 1 37  5  15 f 94.62885 6.166802 135.0294  325.7 -41.02442      12.33360 0.00 
1 1 1 37  5  16 o 65.70146 9.322642 71.10709  296.9 -0.5845566     18.64528 0.79 
1 1 1 37  5  17 o 61.25227 8.340307 75.34335  36.0  14.68298       16.68061 0.83 
1 1 1 37  5  18 o 71.37843 8.397461 72.79418  136.2 20.79679       16.79492 0.89 
1 1 1 37  5  19 o 77.20830 6.895719 69.03621  358.4 2.095428       13.79144 0.91 
1 1 1 37  5  20 o 123.5075 5.336542 189.5239  1.3   -0.4624176     10.67308 0.98 
1 1 1 37  5  21 o 46.18425 10.10688 17.72752  9.1   -22.82096      20.21377 0.42 
1 1 1 37  5  22 o 70.44992 9.237309 81.85448  243.8 ?              ?        0.93 
1 1 1 37  7  0  o 28.82299 8.002149 44.39021  75.7  -5.407822      16.00430 0.19 
1 1 1 37  7  1  o 48.08473 7.792630 85.88152  257.2 -26.97437      15.58526 0.56 
1 1 1 37  7  2  o 167.2823 3.606674 230.0038  348.9 3.491562       7.213347 0.96 
1 1 1 37  7  3  o 30.10794 8.542389 88.88345  333.5 6.486315       17.08478 0.44 
1 1 1 37  7  4  o 149.5169 4.027126 246.0870  101.8 -13.71794      8.054252 0.97 
1 1 1 37  7  5  o 124.9904 3.764583 248.1635  284.6 8.699440       7.529165 0.97 
1 1 1 37  7  6  o 172.6251 3.178701 244.5617  280.1 8.196075       6.357403 0.98 
1 1 1 37  7  7  o 69.16941 5.631131 67.69452  217.2 8.499100       11.26226 0.75 
1 1 1 37  7  8  o 83.24040 5.353383 115.0553  328.8 11.53410       10.70677 0.90 
1 1 1 37  7  9  o 81.02768 5.404258 69.78223  178.8 46.16376       10.80852 0.86 
1 1 1 37  7  10 o 241.4468 3.215577 390.4846  220.0 -0.9562683     6.431153 0.99 
1 1 1 37  7  11 o 159.3727 3.799700 237.4780  306.2 9.997803       7.599401 0.98 
1 1 1 37  7  12 o 23.39634 7.823590 87.97752  352.5 13.30595       15.64718 0.47 
1 1 1 37  7  13 o 38.88756 9.709701 27.99941  115.1 6.663132       19.41940 0.29 
1 1 1 37  7  14 o 130.4548 4.345900 168.0224  179.2 15.50684       8.691799 0.96 
1 1 1 37  7  15 o 117.8097 4.651860 166.0314  95.9  -9.786652      9.303720 0.97 
1 1 1 37  7  16 o 42.84840 10.36355 33.39462  273.7 25.23297       20.72711 0.52 
1 1 1 37  7  17 o 62.20789 9.417786 74.38895  264.5 15.47152       18.83557 0.89 
1 1 1 37  7  18 o 79.07102 8.815672 111.3745  337.0 -6.720123      17.63134 0.95 
1 1 1 37  7  19 o 71.79636 9.144942 81.36765  235.2 -5.171066      18.28988 0.92 
1 1 1 37  7  20 o 28.50846 9.335599 14.26744  221.5 ?              ?        0.25 
1 1 1 37  9  0  o 173.3554 3.906333 277.7864  95.1  -4.832733      7.812665 0.98 
1 1 1 37  9  1  o 111.7570 4.592283 204.9933  140.1 12.83503       9.184566 0.96 
1 1 1 37  9  2  o 105.7864 5.477387 137.3507  185.5 -29.14137      10.95477 0.94 
1 1 1 37  9  3  o 117.6266 4.355917 186.7033  347.2 4.580093       8.711833 0.96 
1 1 1 37  9  4  o 92.28368 4.977082 64.27982  289.8 0.9958420      9.954165 0.86 
1 1 1 37  9  5  o 144.7494 4.420655 275.3727  15.8  9.168503       8.841310 0.98 
1 1 1 37  9  6  o 231.3246 3.476509 333.0935  21.5  8.986084       6.953018 0.99 
1 1 1 37  9  7  o 97.75012 5.049754 118.5043  4.1   -9.343010      10.09951 0.94 
1 1 1 37  9  8  o 57.54362 8.732158 101.8070  257.1 2.122990       17.46432 0.84 
1 1 1 37  9  9  o 43.99587 8.827963 29.62891  347.4 34.69411       17.65593 0.34 
1 1 1 37  9  10 o 27.38211 8.795285 16.80271  64.9  10.95428       17.59057 0.14 
1 1 1 37  9  11 o 76.94321 7.084636 103.3059  288.3 7.641243       14.16927 0.90 
1 1 1 37  9  12 o 98.44378 5.804583 143.5818  16.5  -5.784195      11.60917 0.95 
1 1 1 37  9  13 o 85.52367 8.060630 119.3824  114.3 5.973450       16.12126 0.94 
1 1 1 37  9  14 o 54.57348 10.28922 103.2589  277.9 14.85941       20.57844 0.91 
1 1 1 37  9  15 o 54.41583 9.907207 75.87640  307.7 -5.949726      19.81441 0.89 
1 1 1 37  9  16 o 75.70815 9.292253 76.14407  71.7  23.61776       18.58451 0.92 
1 1 1 37  9  17 o 30.12409 9.510774 35.05080  299.4 -9.688707      19.02155 0.54 
1 1 1 37  9  18 o 62.61063 10.06309 105.1988  359.6 ?              ?        0.94 
1 1 1 37  11 0  o 131.7718 4.724714 189.0990  238.5 8.294121       9.449429 0.97 
1 1 1 37  11 1  o 46.58279 9.505715 32.89231  341.8 -16.15987      19.01143 0.45 
1 1 1 37  11 2  o 31.44749 9.403955 30.16920  345.0 9.994741       18.80791 0.28 
1 1 1 37  11 3  o 66.77930 8.828666 91.82143  259.1 -16.58739      17.65733 0.85 
1 1 1 37  11 4  o 165.1898 3.963387 218.4952  274.1 11.46982       7.926774 0.98 
1 1 1 37  11 5  o 115.4477 4.951017 171.0528  286.3 16.92528       9.902034 0.96 
1 1 1 37  11 6  o 72.84387 8.023499 77.30109  351.9 -0.4713974     16.04700 0.86 
1 1 1 37  11 7  o 163.1704 4.153086 187.8823  147.0 24.21802       8.306172 0.98 
1 1 1 37  11 8  o 59.64648 8.922431 102.1582  42.4  -22.34998      17.84486 0.90 
1 1 1 37  11 9  o 49.95493 10.12710 99.48707  191.2 30.50760       20.25419 0.88 
1 1 1 37  11 10 o 150.1470 4.484684 202.1260  180.0 7.369568       8.969367 0.99 
1 1 1 37  11 11 f 40.01398 10.23516 115.5836  88.6  19.12784       20.47032 0.00 
1 1 1 37  11 12 o 100.1675 6.002515 150.1322  73.6  -2.110657      12.00503 0.97 
1 1 1 37  11 13 o 30.07240 9.353131 27.11295  227.2 24.22488       18.70626 0.44 
1 1 1 37  11 14 o 78.92415 7.704383 110.6934  33.2  1.678459       15.40877 0.96 
1 1 1 37  11 15 o 29.07168 8.791986 18.28545  22.2  ?              ?        0.36 
1 1 1 37  13 0  o 83.00481 7.080951 103.4410  237.8 10.64598       14.16190 0.94 
1 1 1 37  13 1  o 42.96155 9.435053 87.98752  334.4 -21.29703      18.87011 0.85 
1 1 1 37  13 2  o 45.72605 10.16120 61.28518  65.9  -3.068970      20.32240 0.79 
1 1 1 37  13 3  o 83.41649 6.587621 138.0751  174.3 31.58060       13.17524 0.96 
1 1 1 37  13 4  o 112.9993 5.607626 174.8156  120.8 -8.829727      11.21525 0.98 
1 1 1 37  13 5  o 56.20117 9.830762 80.73262  129.3 -1.890366      19.66152 0.91 
1 1 1 37  13 6  o 98.73540 5.831247 139.4358  312.4 34.90894       11.66249 0.97 
1 1 1 37  13 7  o 63.58527 9.805052 109.8497  306.4 16.10058       19.61010 0.94 
1 1 1 37  13 8  o 41.39740 10.79471 80.37872  155.5 12.64667       21.58943 0.86 
1 1 1 37  13 9  o 46.26523 10.87425 50.31298  264.5 -19.42461      21.74851 0.80 
1 1 1 37  13 10 o 80.04477 7.465809 130.2729  325.3 ?              ?        0.97 
1 1 1 37  13 11 o 51.87348 10.61433 88.68787  357.6 ?              ?        0.92 
1 1 1 37  15 0  o 51.40034 9.609931 125.5672  81.7  27.67316       19.21986 0.94 
1 1 1 37  15 1  o 38.46481 10.29754 64.90205  323.2 -0.9004364     20.59508 0.84 
1 1 1 37  15 2  o 117.1341 6.112327 200.7073  263.7 ?              ?        0.99 
1 1 1 37  15 3  o 74.01509 8.735001 140.6975  232.3 ?              ?        0.97 
1 1 1 37  15 4  o 50.93198 10.50825 91.37584  141.7 ?              ?        0.93 
1 1 1 38  0  0  o 226.9238 4.157858 275.5936  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  1  o 150.5921 4.973198 216.9407  180.0 0.000000       0.000000 0.97 
1 1 1 38  0  2  o 231.5935 4.150755 87.45676  0.0   0.000000       0.000000 0.80 
1 1 1 38  0  3  o 649.3297 7.453843 1015.220  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  4  o 624.3983 7.167254 892.7869  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  5  o 299.4003 4.755882 341.3393  0.0   0.000000       0.000000 1.00 
1 1 1 38  0  6  o 126.7112 4.504896 132.6752  0.0   0.000000       0.000000 0.97 
1 1 1 38  0  7  o 91.79166 4.676862 109.1294  0.0   0.000000       0.000000 0.87 
1 1 1 38  0  8  f 367.7334 4.258223 572.3049  0.0   0.000000       0.000000 0.00 
1 1 1 38  0  9  o 317.8939 4.198528 378.7187  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  10 o 158.6892 3.422556 148.0983  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  11 o 338.8189 5.594934 467.9464  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  12 o 18.31747 11.86721 22.04555  0.0   0.000000       0.000000 0.09 
1 1 1 38  0  13 o 233.7491 4.684489 325.7356  0.0   0.000000       0.000000 1.00 
1 1 1 38  0  14 o 30.06428 15.37237 0.2314529 0.0   0.000000       0.000000 0.00 
1 1 1 38  0  15 o 165.5303 5.494040 145.8948  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  16 o 124.6860 6.674451 228.2492  0.0   0.000000       0.000000 1.00 
1 1 1 38  0  17 o 150.2313 5.462615 266.2883  0.0   0.000000       0.000000 1.00 
1 1 1 38  0  18 o 70.60046 9.462543 121.3897  0.0   0.000000       0.000000 0.99 
1 1 1 38  0  19 o 34.46910 18.05043 41.95597  0.0   0.000000       0.000000 0.50 
1 1 1 38  0  20 o 92.07427 11.18989 92.18191  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  21 o 79.28609 9.780116 53.35685  0.0   0.000000       0.000000 0.98 
1 1 1 38  0  22 o 80.36953 11.88487 106.1124  180.0 0.000000       0.000000 1.00 
1 1 1 38  0  23 o 41.88839 20.77564 51.67662  180.0 ?              ?        0.81 
1 1 1 38  2  0  o 81.99327 4.811172 210.4474  277.0 -45.53606      9.622344 0.73 
1 1 1 38  2  1  o 133.5743 3.202389 191.9861  312.4 -26.70174      6.404778 0.88 
1 1 1 38  2  2  o 183.9143 2.990916 229.0690  341.8 12.40022       5.981833 0.93 
1 1 1 38  2  3  o 289.9142 2.754586 421.4628  42.1  8.328033       5.509171 0.98 
1 1 1 38  2  4  o 288.1841 3.012663 330.7986  312.3 -46.89087      6.025325 0.98 
1 1 1 38  2  5  o 163.0900 2.869837 264.5294  198.7 34.12943       5.739675 0.96 
1 1 1 38  2  6  o 159.2352 2.925827 276.9168  43.6  -25.36877      5.851655 0.96 
1 1 1 38  2  7  o 182.4728 2.714623 148.0563  71.9  32.45479       5.429246 0.93 
1 1 1 38  2  8  o 107.1943 3.565913 152.9317  196.2 -36.61974      7.131825 0.90 
1 1 1 38  2  9  o 58.03368 6.397194 10.85232  6.6   -63.55193      12.79439 0.12 
1 1 1 38  2  10 o 88.28751 4.407286 106.2562  111.3 47.97170       8.814571 0.87 
1 1 1 38  2  11 o 105.8850 3.973757 174.8530  36.0  12.93803       7.947514 0.94 
1 1 1 38  2  12 f 178.5145 3.398085 238.1072  58.1  15.15186       6.796170 0.00 
1 1 1 38  2  13 o 133.7673 3.808460 127.8620  48.4  0.6416016      7.616920 0.95 
1 1 1 38  2  14 o 147.1669 3.909107 185.9191  279.3 7.390808       7.818213 0.97 
1 1 1 38  2  15 o 166.5859 3.962787 239.9165  291.8 11.91158       7.925574 0.98 
1 1 1 38  2  16 f 197.3807 3.483457 257.7126  329.8 -15.16685      6.966914 0.00 
1 1 1 38  2  17 o 109.0268 4.460293 118.6461  199.9 15.39219       8.920586 0.93 
1 1 1 38  2  18 o 32.31463 9.595968 30.94223  72.0  5.580490       19.19194 0.33 
1 1 1 38  2  19 o 58.46385 9.319443 83.34502  150.0 -19.25547      18.63889 0.87 
1 1 1 38  2  20 o 92.47713 6.919331 100.1011  243.1 -17.42754      13.83866 0.95 
1 1 1 38  2  21 o 32.87740 9.619943 42.66779  214.4 4.886368       19.23989 0.58 
1 1 1 38  2  22 o 96.36520 6.406188 99.53513  234.0 25.42180       12.81238 0.96 
1 1 1 38  2  23 x ?        ?        26.04679  295.4 ?              ?        0.00 
1 1 1 38  4  0  o 185.3463 3.148542 192.5637  130.2 -0.1300659     6.297084 0.93 
1 1 1 38  4  1  o 103.7606 3.736475 218.4159  119.4 37.17191       7.472951 0.91 
1 1 1 38  4  2  o 292.8502 2.882767 382.3206  324.5 19.83289       5.765534 0.98 
1 1 1 38  4  3  o 120.9660 3.233598 197.5570  130.2 11.02926       6.467196 0.92 
1 1 1 38  4  4  o 464.4664 3.669666 648.8895  101.1 -9.498199      7.339331 0.99 
1 1 1 38  4  5  o 146.7320 3.153056 229.0328  187.2 47.95284       6.306113 0.95 
1 1 1 38  4  6  o 252.7861 3.029682 420.4756  318.9 -10.41537      6.059363 0.98 
1 1 1 38  4  7  o 181.7871 3.230070 242.3613  327.6 -25.92812      6.460140 0.97 
1 1 1 38  4  8  o 199.0173 3.101871 276.2277  285.6 -28.08887      6.203743 0.98 
1 1 1 38  4  9  o 233.6183 3.352506 302.0274  222.4 43.39153       6.705011 0.98 
1 1 1 38  4  10 o 125.7795 4.990409 146.8459  120.6 -10.27953      9.980818 0.94 
1 1 1 38  4  11 o 86.55029 4.769251 101.9122  187.6 38.55130       9.538502 0.89 
1 1 1 38  4  12 o 125.1529 3.584309 129.1372  212.8 17.62949       7.168618 0.95 
1 1 1 38  4  13 o 118.3102 4.374794 165.2223  99.1  -26.03647      8.749589 0.96 
1 1 1 38  4  14 o 156.3041 4.383327 172.0710  359.2 10.83624       8.766655 0.96 
1 1 1 38  4  15 o 47.13041 8.906054 18.67040  347.8 -12.54708      17.81211 0.22 
1 1 1 38  4  16 f 144.3091 4.221838 194.2254  128.9 -23.28372      8.443676 0.00 
1 1 1 38  4  17 o 63.54930 7.883739 45.45455  272.8 8.010368       15.76748 0.71 
1 1 1 38  4  18 o 81.75294 7.800667 141.3501  337.3 24.39294       15.60133 0.95 
1 1 1 38  4  19 o 47.80457 9.794715 60.77059  30.4  27.38489       19.58943 0.81 
1 1 1 38  4  20 o 63.72269 9.869366 67.80202  341.7 9.530693       19.73873 0.88 
1 1 1 38  4  21 o 55.42300 10.36625 117.2777  73.8  -1.978172      20.73251 0.93 
1 1 1 38  4  22 o 30.95834 9.633278 31.88256  19.0  ?              ?        0.53 
1 1 1 38  6  0  o 291.9107 3.221163 489.1970  205.7 -14.62079      6.442326 0.99 
1 1 1 38  6  1  o 209.2134 3.054140 389.9683  147.2 -24.52774      6.108279 0.98 
1 1 1 38  6  2  o 162.7205 2.842387 174.7264  167.6 -14.57170      5.684774 0.94 
1 1 1 38  6  3  o 59.34908 7.570962 102.6855  317.0 6.421127       15.14192 0.69 
1 1 1 38  6  4  o 148.3029 4.075251 268.1814  144.8 -34.63588      8.150502 0.96 
1 1 1 38  6  5  o 305.8496 3.315233 437.1201  238.3 38.29105       6.630465 0.99 
1 1 1 38  6  6  o 75.22252 5.319982 97.23410  214.8 -16.09039      10.63996 0.83 
1 1 1 38  6  7  o 87.84999 5.144226 131.6377  21.7  3.541557       10.28845 0.91 
1 1 1 38  6  8  o 91.72881 5.318226 187.0495  49.9  3.528862       10.63645 0.94 
1 1 1 38  6  9  o 65.93579 6.184831 72.02801  164.3 2.791885       12.36966 0.79 
1 1 1 38  6  10 o 165.9784 3.566780 227.4410  238.2 -14.33017      7.133559 0.98 
1 1 1 38  6  11 o 90.21089 5.491418 67.37686  346.4 8.213326       10.98284 0.87 
1 1 1 38  6  12 f 123.7498 4.308354 162.3037  49.9  -4.759491      8.616709 0.00 
1 1 1 38  6  13 o 113.3496 4.649992 177.5703  295.1 3.219742       9.299983 0.95 
1 1 1 38  6  14 o 46.59937 8.896870 9.778933  51.6  -17.97219      17.79374 0.13 
1 1 1 38  6  15 o 195.6382 4.179419 261.2361  47.7  9.824173       8.358838 0.99 
1 1 1 38  6  16 o 31.29708 9.418529 27.68361  274.1 6.281557       18.83706 0.33 
1 1 1 38  6  17 o 90.55482 7.289997 111.8940  229.2 -26.79247      14.57999 0.95 
1 1 1 38  6  18 o 59.56322 9.782368 118.1249  256.1 4.386845       19.56474 0.93 
1 1 1 38  6  19 o 62.46935 10.24246 108.0153  72.2  28.72871       20.48493 0.93 
1 1 1 38  6  20 o 46.80804 11.50069 29.86169  35.1  -5.168530      23.00138 0.61 
1 1 1 38  6  21 x ?        ?        75.90215  240.9 ?              ?        0.00 
1 1 1 38  8  0  o 86.77997 5.821603 172.8174  37.0  -22.81709      11.64321 0.93 
1 1 1 38  8  1  o 131.3804 3.858477 164.1374  55.1  -8.259254      7.716953 0.95 
1 1 1 38  8  2  o 84.24887 6.014889 102.5717  11.0  -16.93735      12.02978 0.87 
1 1 1 38  8  3  o 168.3601 3.844847 290.6295  21.7  20.38277       7.689694 0.98 
1 1 1 38  8  4  o 106.6653 4.918787 145.9637  108.7 29.39460       9.837573 0.94 
1 1 1 38  8  5  o 114.6667 4.541278 225.9220  30.9  -15.53790      9.082556 0.97 
1 1 1 38  8  6  o 70.16914 7.160634 84.71169  349.4 -11.91042      14.32127 0.86 
1 1 1 38  8  7  o 87.93017 5.626117 134.9714  147.5 31.90089       11.25223 0.94 
1 1 1 38  8  8  o 29.30505 8.992539 62.49271  261.4 5.666229       17.98508 0.53 
1 1 1 38  8  9  o 35.65346 9.670117 58.18306  274.9 3.643761       19.34023 0.51 
1 1 1 38  8  10 o 138.9474 4.043123 167.4257  203.8 10.49959       8.086246 0.96 
1 1 1 38  8  11 o 69.77928 7.133907 83.03832  349.3 -12.70263      14.26781 0.84 
1 1 1 38  8  12 o 110.6807 5.010824 153.8616  354.8 19.51688       10.02165 0.95 
1 1 1 38  8  13 o 127.2161 4.620909 195.8067  26.3  0.6829529      9.241817 0.97 
1 1 1 38  8  14 f 75.21407 7.949434 114.9489  336.7 -3.609978      15.89887 0.00 
1 1 1 38  8  15 f 62.95571 8.722979 101.5809  82.4  11.04442       17.44596 0.00 
1 1 1 38  8  16 o 36.77037 10.19204 9.602938  260.0 -7.484352      20.38407 0.19 
1 1 1 38  8  17 o 50.96085 10.63229 96.69747  255.7 -16.80910      21.26457 0.90 
1 1 1 38  8  18 o 74.01617 9.364592 46.75962  7.5   24.54013       18.72918 0.87 
1 1 1 38  8  19 o 33.54723 10.22129 47.38273  303.7 ?              ?        0.72 
1 1 1 38  10 0  o 241.4930 3.498298 309.1054  133.0 -22.83597      6.996596 0.99 
1 1 1 38  10 1  o 48.13243 9.731862 79.63844  192.1 27.47101       19.46372 0.81 
1 1 1 38  10 2  o 37.49223 11.02317 95.78846  115.2 16.91555       22.04634 0.79 
1 1 1 38  10 3  o 186.6186 3.879025 272.7505  108.1 13.94385       7.758049 0.99 
1 1 1 38  10 4  o 84.92335 7.134254 108.8827  176.8 -37.59650      14.26851 0.91 
1 1 1 38  10 5  o 135.0875 4.726995 199.0933  290.1 15.10105       9.453990 0.97 
1 1 1 38  10 6  o 46.10375 9.226796 25.72749  109.8 -22.79929      18.45359 0.32 
1 1 1 38  10 7  f 171.4169 3.801160 272.7700  85.6  9.977234       7.602321 0.00 
1 1 1 38  10 8  o 262.6838 3.913432 308.9351  340.9 22.29356       7.826865 0.99 
1 1 1 38  10 9  o 120.5690 5.093445 183.7237  327.6 13.28549       10.18689 0.97 
1 1 1 38  10 10 o 99.70364 6.454011 120.9875  191.3 -25.64883      12.90802 0.95 
1 1 1 38  10 11 o 164.1078 4.133040 187.1833  348.3 22.26639       8.266081 0.98 
1 1 1 38  10 12 o 90.87575 8.190424 127.7043  21.8  -30.74912      16.38085 0.96 
1 1 1 38  10 13 o 40.65279 10.55186 66.40871  270.3 17.67726       21.10371 0.81 
1 1 1 38  10 14 o 29.28285 9.248393 35.51086  34.5  -0.1470528     18.49679 0.52 
1 1 1 38  10 15 o 33.72686 9.856133 63.86081  307.3 0.4064865      19.71227 0.78 
1 1 1 38  10 16 o 35.08657 10.20829 83.94089  297.4 ?              ?        0.86 
1 1 1 38  12 0  f 48.79141 9.423423 42.66891  310.9 24.45753       18.84685 0.00 
1 1 1 38  12 1  o 174.7609 4.156240 287.2224  317.0 19.06633       8.312479 0.99 
1 1 1 38  12 2  o 159.8695 4.312644 230.1900  289.0 8.165619       8.625288 0.98 
1 1 1 38  12 3  o 36.15156 10.29443 101.8372  296.4 9.463308       20.58885 0.80 
1 1 1 38  12 4  o 50.59842 9.871133 45.96241  213.0 -18.91367      19.74227 0.70 
1 1 1 38  12 5  o 116.9546 5.476306 203.1063  175.9 7.637062       10.95261 0.98 
1 1 1 38  12 6  o 26.80529 8.822005 45.44139  136.9 1.109299       17.64401 0.54 
1 1 1 38  12 7  o 51.66664 10.44540 95.33846  303.6 -6.298687      20.89080 0.90 
1 1 1 38  12 8  o 36.73643 10.51376 44.52000  111.3 14.00506       21.02752 0.69 
1 1 1 38  12 9  o 62.44332 10.82638 96.12399  261.4 25.75079       21.65277 0.93 
1 1 1 38  12 10 o 42.14532 10.26381 78.98666  305.7 -2.612606      20.52763 0.86 
1 1 1 38  12 11 o 96.39372 5.868035 163.6481  73.3  32.75205       11.73607 0.98 
1 1 1 38  12 12 o 71.37079 8.851852 103.1342  69.7  ?              ?        0.95 
1 1 1 38  12 13 x ?        ?        61.19501  302.9 ?              ?        0.00 
1 1 1 38  14 0  o 45.74575 10.49032 60.14906  96.6  10.04522       20.98064 0.84 
1 1 1 38  14 1  o 51.66846 10.43486 112.0893  75.8  -0.1215019     20.86972 0.93 
1 1 1 38  14 2  o 67.73972 9.087588 39.75060  209.7 45.24316       18.17518 0.85 
1 1 1 38  14 3  o 56.33090 9.357942 83.19143  22.6  -3.369576      18.71588 0.92 
1 1 1 38  14 4  o 91.47871 6.326319 131.3700  8.9   6.818153       12.65264 0.97 
1 1 1 38  14 5  o 28.47799 9.169285 42.35908  16.4  6.221123       18.33857 0.65 
1 1 1 38  14 6  o 47.01289 10.63571 91.76470  146.1 ?              ?        0.91 
1 1 1 38  14 7  o 51.01609 10.76565 45.35194  345.9 ?              ?        0.83 
1 1 1 39  1  0  o 164.4054 3.062746 167.3632  134.8 13.40596       6.125491 0.86 
1 1 1 39  1  1  o 167.1285 2.935189 263.9717  266.4 -2.495255      5.870379 0.93 
1 1 1 39  1  2  o 44.39134 8.085964 57.63189  131.7 3.930244       16.17193 0.28 
1 1 1 39  1  3  o 155.7225 2.942924 209.3650  184.4 19.42719       5.885848 0.93 
1 1 1 39  1  4  o 256.2152 2.999089 413.8642  142.8 -21.78709      5.998179 0.98 
1 1 1 39  1  5  o 333.6206 3.132039 403.7158  67.6  4.270050       6.264078 0.99 
1 1 1 39  1  6  o 163.0551 2.761774 220.9713  10.1  -29.73366      5.523548 0.95 
1 1 1 39  1  7  o 165.5891 2.903089 282.9880  96.0  -13.74200      5.806177 0.96 
1 1 1 39  1  8  o 134.4779 2.807478 181.5755  83.0  -28.11607      5.614956 0.94 
1 1 1 39  1  9  o 54.10153 6.301591 92.12179  175.8 23.79250       12.60318 0.71 
1 1 1 39  1  10 o 43.51210 7.336679 94.44402  97.7  -20.39244      14.67336 0.66 
1 1 1 39  1  11 o 211.8885 3.116067 240.1607  160.0 -13.62601      6.232134 0.98 
1 1 1 39  1  12 o 76.86714 6.178185 146.0138  65.1  13.12417       12.35637 0.92 
1 1 1 39  1  13 o 149.0221 3.820545 199.5835  44.2  0.5401917      7.641090 0.98 
1 1 1 39  1  14 o 140.9675 3.864681 174.5499  242.1 28.15034       7.729362 0.97 
1 1 1 39  1  15 o 39.56833 9.336565 55.28152  237.8 17.00846       18.67313 0.46 
1 1 1 39  1  16 o 129.2728 4.622570 173.0909  25.4  9.176620       9.245140 0.96 
1 1 1 39  1  17 o 46.10836 9.550204 19.45973  225.7 -25.55663      19.10041 0.26 
1 1 1 39  1  18 o 86.66272 7.674256 100.7080  309.7 -10.93124      15.34851 0.92 
1 1 1 39  1  19 o 32.01244 9.104538 69.34276  183.7 -9.825798      18.20908 0.71 
1 1 1 39  1  20 o 37.14842 10.23531 9.808264  288.1 15.02917       20.47062 0.18 
1 1 1 39  1  21 o 36.37685 10.78726 47.06252  33.9  -0.7021904     21.57452 0.65 
1 1 1 39  1  22 o 36.72359 10.53950 30.23404  231.0 ?              ?        0.53 
1 1 1 39  3  0  o 194.1816 2.993483 184.8039  305.7 -14.79131      5.986966 0.92 
1 1 1 39  3  1  o 108.3610 3.512255 222.1948  19.8  1.563301       7.024511 0.90 
1 1 1 39  3  2  o 74.86748 4.498181 76.98615  70.1  -11.37127      8.996363 0.69 
1 1 1 39  3  3  o 83.98409 3.960875 160.5400  5.8   -14.02717      7.921750 0.85 
1 1 1 39  3  4  o 125.4283 3.262752 174.1289  9.4   20.48883       6.525503 0.91 
1 1 1 39  3  5  o 185.4298 2.512637 293.5755  189.0 -8.000931      5.025274 0.97 
1 1 1 39  3  6  o 55.07111 5.776358 33.41745  86.2  0.3711128      11.55272 0.25 
1 1 1 39  3  7  o 114.6351 3.817536 177.7749  18.2  19.38383       7.635071 0.93 
1 1 1 39  3  8  o 138.3257 3.451996 218.9805  187.0 -13.51251      6.903992 0.96 
1 1 1 39  3  9  o 199.2273 3.110576 216.2308  219.0 -18.73274      6.221152 0.97 
1 1 1 39  3  10 o 166.7532 3.180244 212.8799  339.2 -0.6810760     6.360488 0.97 
1 1 1 39  3  11 o 32.09477 8.918598 42.01019  309.6 2.736731       17.83720 0.33 
1 1 1 39  3  12 o 79.33118 5.527612 56.61973  91.8  18.46272       11.05522 0.81 
1 1 1 39  3  13 o 141.9586 3.700349 175.4030  346.9 -29.16454      7.400697 0.97 
1 1 1 39  3  14 o 190.3304 3.947855 214.8286  287.0 -9.087189      7.895709 0.98 
1 1 1 39  3  15 o 116.0892 4.862442 152.0697  323.8 -18.53197      9.724885 0.94 
1 1 1 39  3  16 o 122.1657 4.853125 183.9119  52.9  1.136131       9.706250 0.96 
1 1 1 39  3  17 o 154.3402 4.359735 134.7092  216.5 42.43892       8.719470 0.97 
1 1 1 39  3  18 o 81.37854 7.005480 78.99599  35.8  -1.526169      14.01096 0.91 
1 1 1 39  3  19 o 84.01822 7.714849 110.0378  313.6 -33.25756      15.42970 0.95 
1 1 1 39  3  20 o 101.7057 6.862441 139.1531  279.7 -34.91563      13.72488 0.97 
1 1 1 39  3  21 o 30.92709 9.248832 41.45662  205.7 -9.788618      18.49766 0.58 
1 1 1 39  3  22 o 58.13010 10.02557 67.87727  135.4 ?              ?        0.89 
1 1 1 39  5  0  o 96.17963 4.358040 178.3403  84.9  -19.63494      8.716081 0.89 
1 1 1 39  5  1  o 252.8716 3.049897 377.2290  24.9  7.544968       6.099794 0.98 
1 1 1 39  5  2  o 75.73850 4.591078 77.92249  144.5 29.09517       9.182157 0.64 
1 1 1 39  5  3  o 106.2036 3.462606 104.1915  154.9 0.7469864      6.925213 0.82 
1 1 1 39  5  4  o 36.17380 8.083198 63.74482  316.3 -14.52565      16.16640 0.36 
1 1 1 39  5  5  o 267.4052 3.379884 347.7656  295.3 1.558777       6.759767 0.99 
1 1 1 39  5  6  o 63.54471 7.078966 167.1232  181.1 -10.29318      14.15793 0.88 
1 1 1 39  5  7  o 75.48836 6.907443 98.78849  167.3 10.69930       13.81489 0.84 
1 1 1 39  5  8  o 224.5037 3.304984 314.3819  319.0 17.41109       6.609969 0.99 
1 1 1 39  5  9  o 177.9533 3.203765 199.1239  348.5 33.61412       6.407530 0.97 
1 1 1 39  5  10 o 49.36306 7.033970 76.12318  281.9 46.94627       14.06794 0.75 
1 1 1 39  5  11 o 66.14674 8.231529 44.60961  200.4 26.53410       16.46306 0.72 
1 1 1 39  5  12 o 29.97695 9.084904 44.02002  208.6 11.78003       18.16981 0.36 
1 1 1 39  5  13 o 130.9096 3.991668 162.5302  223.8 -10.97373      7.983335 0.95 
1 1 1 39  5  14 o 106.6213 4.725942 142.6505  24.3  -6.090851      9.451883 0.94 
1 1 1 39  5  15 f 209.9939 3.818221 192.3886  50.7  -6.409927      7.636442 0.00 
1 1 1 39  5  16 o 37.90768 9.789145 49.94716  169.7 -11.59232      19.57829 0.57 
1 1 1 39  5  17 o 147.4612 4.800627 176.7819  237.8 29.69617       9.601254 0.98 
1 1 1 39  5  18 o 96.01051 6.211928 117.5890  240.3 5.284798       12.42386 0.96 
1 1 1 39  5  19 o 83.58241 8.622759 89.12074  52.5  -18.28667      17.24552 0.94 
1 1 1 39  5  20 o 39.67056 10.73670 16.22383  211.6 -2.197163      21.47341 0.33 
1 1 1 39  5  21 o 41.50464 10.80784 30.50492  288.2 ?              ?        0.61 
1 1 1 39  7  0  o 75.15290 5.221241 128.4459  124.9 12.33577       10.44248 0.84 
1 1 1 39  7  1  o 297.0639 3.471253 411.7549  180.6 54.27338       6.942505 0.99 
1 1 1 39  7  2  o 183.0006 3.809176 242.7683  194.4 42.37950       7.618352 0.98 
1 1 1 39  7  3  o 175.0270 4.005924 265.9793  42.3  -18.01093      8.011847 0.98 
1 1 1 39  7  4  o 148.5643 3.704721 205.8329  157.0 12.74686       7.409442 0.97 
1 1 1 39  7  5  o 132.8012 4.267316 178.8018  186.8 0.9145355      8.534632 0.96 
1 1 1 39  7  6  o 109.0452 5.259344 113.3923  10.6  -51.24322      10.51869 0.92 
1 1 1 39  7  7  o 58.19447 8.239237 145.2051  88.4  33.64190       16.47847 0.90 
1 1 1 39  7  8  o 92.24167 5.388381 153.5283  86.0  1.591042       10.77676 0.95 
1 1 1 39  7  9  o 113.0041 4.572025 138.4745  103.8 21.98471       9.144050 0.95 
1 1 1 39  7  10 o 153.0723 4.165186 156.4664  0.2   -2.532822      8.330372 0.96 
1 1 1 39  7  11 o 165.9186 3.976933 247.8730  304.6 3.398987       7.953866 0.98 
1 1 1 39  7  12 o 86.30950 5.425855 104.5761  331.7 10.26521       10.85171 0.90 
1 1 1 39  7  13 o 37.43548 9.800356 46.38350  237.1 -9.504265      19.60071 0.48 
1 1 1 39  7  14 o 68.46635 7.390620 81.66187  156.7 44.14331       14.78124 0.88 
1 1 1 39  7  15 o 112.4596 5.019431 132.7976  78.4  10.76862       10.03886 0.97 
1 1 1 39  7  16 o 63.12345 9.286618 53.46874  215.1 -11.01252      18.57324 0.85 
1 1 1 39  7  17 o 39.96729 10.99454 60.31728  151.8 12.77520       21.98908 0.77 
1 1 1 39  7  18 o 58.96918 10.26453 79.70922  81.4  -9.340862      20.52906 0.90 
1 1 1 39  7  19 o 46.51295 11.19519 74.42574  94.6  ?              ?        0.87 
1 1 1 39  9  0  o 60.96284 7.353745 101.5752  284.8 0.1252518      14.70749 0.84 
1 1 1 39  9  1  o 236.7127 3.753578 269.5623  209.6 12.30406       7.507156 0.99 
1 1 1 39  9  2  o 73.98422 7.776870 78.90131  247.2 -27.99986      15.55374 0.86 
1 1 1 39  9  3  o 60.64240 9.494510 99.12386  41.1  -12.86441      18.98902 0.87 
1 1 1 39  9  4  o 124.6936 4.720782 154.3621  213.8 23.92033       9.441565 0.97 
1 1 1 39  9  5  o 104.5049 5.675195 142.2064  131.2 1.302139       11.35039 0.95 
1 1 1 39  9  6  o 147.7333 4.006554 240.8703  160.1 1.225586       8.013108 0.98 
1 1 1 39  9  7  o 136.9808 4.533002 209.7562  207.1 -1.452713      9.066005 0.97 
1 1 1 39  9  8  o 106.8666 5.323127 145.2442  303.2 -22.55171      10.64625 0.94 
1 1 1 39  9  9  o 159.3076 3.825715 248.0332  15.0  14.17278       7.651431 0.98 
1 1 1 39  9  10 o 222.4918 4.224885 273.4510  103.5 -0.9490967     8.449770 0.99 
1 1 1 39  9  11 o 53.82363 9.386571 83.93758  34.7  -10.38475      18.77314 0.84 
1 1 1 39  9  12 o 54.74693 9.723063 39.61634  317.1 1.015095       19.44613 0.70 
1 1 1 39  9  13 o 97.16686 6.065910 140.9458  315.6 33.02019       12.13182 0.97 
1 1 1 39  9  14 o 44.03368 9.345098 89.37856  0.3   -20.42414      18.69020 0.88 
1 1 1 39  9  15 o 32.93690 9.234896 47.70292  320.4 -9.829674      18.46979 0.66 
1 1 1 39  9  16 o 79.13989 7.276962 95.43909  269.2 18.98522       14.55392 0.95 
1 1 1 39  9  17 f 80.24628 7.920803 102.8274  213.8 ?              ?        0.00 
1 1 1 39  11 0  o 134.3377 4.493773 213.9061  78.2  -20.42498      8.987547 0.97 
1 1 1 39  11 1  f 113.7980 6.076757 142.8874  14.7  33.93900       12.15351 0.00 
1 1 1 39  11 2  o 117.1820 5.885229 119.9041  16.8  5.616791       11.77046 0.94 
1 1 1 39  11 3  o 121.0609 5.019008 202.6492  18.9  -5.058426      10.03802 0.97 
1 1 1 39  11 4  o 110.8924 5.751881 150.1966  11.8  10.20033       11.50376 0.96 
1 1 1 39  11 5  o 42.51184 10.95758 86.25391  3.2   3.791641       21.91517 0.77 
1 1 1 39  11 6  o 64.82637 8.516570 97.30080  212.2 -0.2882385     17.03314 0.90 
1 1 1 39  11 7  o 135.4203 4.643266 183.5965  243.9 -7.081116      9.286532 0.98 
1 1 1 39  11 8  o 158.7449 4.310890 207.2081  359.6 10.99535       8.621779 0.99 
1 1 1 39  11 9  o 64.06097 9.581923 106.9931  35.8  -10.84034      19.16385 0.93 
1 1 1 39  11 10 o 54.33580 9.835396 47.28191  330.1 31.57227       19.67079 0.82 
1 1 1 39  11 11 o 63.85101 9.436893 107.6679  349.7 22.23005       18.87379 0.94 
1 1 1 39  11 12 o 103.3738 6.009073 154.0175  245.7 -1.724854      12.01815 0.98 
1 1 1 39  11 13 o 96.25842 7.135009 134.3414  269.3 -9.851143      14.27002 0.97 
1 1 1 39  11 14 o 22.74496 7.982456 31.16433  44.1  ?              ?        0.48 
1 1 1 39  13 0  o 33.92286 9.787485 38.16858  149.1 -2.381306      19.57497 0.56 
1 1 1 39  13 1  o 98.60872 5.813598 148.3439  288.5 16.49415       11.62720 0.97 
1 1 1 39  13 2  o 86.66917 7.465210 173.3341  230.9 -11.62104      14.93042 0.97 
1 1 1 39  13 3  o 70.38295 8.958760 127.0714  83.4  -0.9550476E-01 17.91752 0.96 
1 1 1 39  13 4  o 37.06670 9.228760 10.63046  180.2 -22.75803      18.45752 0.25 
1 1 1 39  13 5  o 84.05809 7.248650 158.8576  173.0 -6.298103      14.49730 0.97 
1 1 1 39  13 6  o 119.4064 5.727903 196.5623  95.1  49.76283       11.45581 0.99 
1 1 1 39  13 7  o 70.35138 8.788301 115.8534  357.4 -12.88215      17.57660 0.95 
1 1 1 39  13 8  o 43.35915 10.75802 42.04605  179.8 10.49904       21.51603 0.75 
1 1 1 39  13 9  o 44.60401 11.74620 73.52940  91.8  ?              ?        0.87 
1 1 1 39  13 10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 39  15 0  o 72.93638 9.294720 113.3759  125.3 ?              ?        0.96 
1 1 1 39  15 1  o 59.22790 9.824193 99.28970  32.2  ?              ?        0.94 
1 1 1 39  15 2  x ?        ?        153.5256  322.3 ?              ?        0.00 
1 1 1 40  0  0  o 344.9197 4.979206 263.0896  180.0 0.000000       0.000000 1.00 
1 1 1 40  0  1  o 62.14696 8.242973 19.57306  180.0 0.000000       0.000000 0.17 
1 1 1 40  0  2  o 377.4929 5.138616 579.3229  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  3  o 295.7848 4.482826 342.3915  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  4  o 14.43374 10.08267 93.18813  0.0   0.000000       0.000000 0.16 
1 1 1 40  0  5  o 35.96161 14.80982 12.04757  180.0 0.000000       0.000000 0.00 
1 1 1 40  0  6  o 110.1981 5.026655 206.3438  180.0 0.000000       0.000000 1.00 
1 1 1 40  0  7  o 83.22240 5.390090 40.05507  180.0 0.000000       0.000000 0.49 
1 1 1 40  0  8  o 103.5776 4.744321 67.03947  180.0 0.000000       0.000000 0.87 
1 1 1 40  0  9  o 282.7970 4.122126 380.1606  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  10 o 360.3425 4.642181 485.2213  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  11 o 90.67050 6.441651 76.18032  180.0 0.000000       0.000000 0.95 
1 1 1 40  0  12 o 28.39308 15.06204 17.84182  180.0 0.000000       0.000000 0.15 
1 1 1 40  0  13 o 244.9613 5.488869 272.9836  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  14 o 129.5799 6.765790 115.9419  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  15 o 53.59003 15.86156 74.85145  180.0 0.000000       0.000000 0.75 
1 1 1 40  0  16 o 57.87877 13.82635 42.43649  180.0 0.000000       0.000000 0.58 
1 1 1 40  0  17 o 177.6176 5.620922 226.9320  180.0 0.000000       0.000000 1.00 
1 1 1 40  0  18 o 92.29224 9.733294 100.6194  0.0   0.000000       0.000000 1.00 
1 1 1 40  0  19 o 19.89596 13.64929 36.31351  0.0   0.000000       0.000000 0.36 
1 1 1 40  0  20 o 30.70511 17.49322 27.91545  0.0   0.000000       0.000000 0.39 
1 1 1 40  0  21 o 13.08276 9.708770 85.06212  180.0 0.000000       0.000000 0.57 
1 1 1 40  0  22 o 26.12402 15.87074 3.968072  180.0 ?              ?        0.06 
1 1 1 40  2  0  o 79.70651 4.504220 140.7688  337.5 16.05427       9.008441 0.76 
1 1 1 40  2  1  o 120.4358 3.746452 155.4895  20.5  -41.52800      7.492904 0.88 
1 1 1 40  2  2  o 220.3419 3.009012 338.7301  153.7 19.54216       6.018023 0.98 
1 1 1 40  2  3  o 114.1724 3.735426 203.5037  17.2  16.11169       7.470851 0.91 
1 1 1 40  2  4  o 124.6712 3.223548 88.87212  59.8  -36.21234      6.447096 0.82 
1 1 1 40  2  5  o 105.5214 3.926009 150.7209  186.6 52.34429       7.852019 0.89 
1 1 1 40  2  6  o 70.81647 5.910174 79.09906  227.3 49.82619       11.82035 0.67 
1 1 1 40  2  7  f 190.0019 2.915178 263.1746  97.3  -12.01788      5.830356 0.00 
1 1 1 40  2  8  o 294.7754 3.075669 388.3988  147.4 -6.446411      6.151339 0.99 
1 1 1 40  2  9  o 66.58804 5.588141 156.8199  235.1 1.724678       11.17628 0.89 
1 1 1 40  2  10 f 70.22333 5.188999 67.61752  359.7 6.596977       10.37800 0.00 
1 1 1 40  2  11 o 213.4539 3.441095 221.3483  144.3 12.94415       6.882189 0.98 
1 1 1 40  2  12 o 143.7344 3.282815 137.4684  112.4 12.11784       6.565630 0.96 
1 1 1 40  2  13 o 101.8026 4.526441 154.2047  54.6  -1.799522      9.052882 0.95 
1 1 1 40  2  14 o 109.9328 4.703109 108.7118  89.8  -10.71707      9.406219 0.91 
1 1 1 40  2  15 o 149.2074 5.613742 177.6764  77.2  20.70802       11.22748 0.96 
1 1 1 40  2  16 o 147.1951 4.345326 151.3336  50.3  -9.169724      8.690652 0.96 
1 1 1 40  2  17 o 85.58702 6.444908 132.0251  332.2 -35.73550      12.88982 0.94 
1 1 1 40  2  18 o 68.28140 9.173871 87.15300  22.2  -30.21352      18.34774 0.90 
1 1 1 40  2  19 o 49.53463 9.504698 38.58310  197.6 -21.00092      19.00940 0.70 
1 1 1 40  2  20 o 42.57324 10.81217 89.43781  354.3 -9.518723      21.62434 0.85 
1 1 1 40  2  21 o 41.93501 11.16576 55.46572  303.0 10.09745       22.33152 0.77 
1 1 1 40  2  22 x ?        ?        75.12228  53.0  ?              ?        0.00 
1 1 1 40  4  0  f 42.24230 8.267165 96.03438  283.4 -5.248245      16.53433 0.00 
1 1 1 40  4  1  o 140.6460 2.956382 129.0879  156.8 -33.58678      5.912763 0.90 
1 1 1 40  4  2  o 203.9041 2.709546 244.6133  263.7 -24.33224      5.419091 0.96 
1 1 1 40  4  3  o 315.1078 3.044867 478.4148  354.6 52.74948       6.089733 0.99 
1 1 1 40  4  4  o 32.14977 7.892661 17.14402  17.9  -19.18204      15.78532 0.08 
1 1 1 40  4  5  o 119.7967 3.270798 135.5046  329.3 34.74154       6.541596 0.91 
1 1 1 40  4  6  o 123.3727 3.832711 190.1590  238.5 -22.83696      7.665421 0.95 
1 1 1 40  4  7  o 129.0071 3.763296 104.6858  64.1  23.65742       7.526591 0.91 
1 1 1 40  4  8  o 51.23310 7.728491 117.9054  150.5 -0.1816101     15.45698 0.79 
1 1 1 40  4  9  o 175.4263 3.135511 211.1414  16.0  57.12599       6.271021 0.97 
1 1 1 40  4  10 o 124.7862 4.190654 154.1679  333.0 24.21627       8.381308 0.96 
1 1 1 40  4  11 o 152.3988 3.874126 213.0619  259.6 -18.85741      7.748252 0.98 
1 1 1 40  4  12 o 61.84064 8.081574 80.82327  225.6 -12.39275      16.16315 0.81 
1 1 1 40  4  13 o 107.7760 4.884401 76.06097  221.5 -24.12312      9.768802 0.87 
1 1 1 40  4  14 o 197.7018 4.166406 223.2061  288.0 -10.95049      8.332811 0.98 
1 1 1 40  4  15 o 94.28886 6.396229 102.7777  314.0 -8.666283      12.79246 0.91 
1 1 1 40  4  16 o 131.4274 4.669275 171.2502  125.4 4.526901       9.338551 0.97 
1 1 1 40  4  17 f 110.9548 5.632963 145.4259  178.0 -14.23677      11.26593 0.00 
1 1 1 40  4  18 o 39.94579 10.22543 51.98029  106.7 -2.290634      20.45086 0.72 
1 1 1 40  4  19 o 63.29171 9.711156 77.01749  43.4  -8.851616      19.42231 0.89 
1 1 1 40  4  20 o 87.50462 7.214103 135.2986  176.9 9.881203       14.42821 0.96 
1 1 1 40  4  21 o 80.54566 9.158573 85.03782  216.1 ?              ?        0.94 
1 1 1 40  6  0  o 202.7899 2.823455 237.4671  5.7   -29.02306      5.646910 0.97 
1 1 1 40  6  1  o 161.1438 3.222193 240.0699  243.6 -5.942795      6.444386 0.96 
1 1 1 40  6  2  o 66.58038 6.812195 93.52270  137.4 55.51550       13.62439 0.74 
1 1 1 40  6  3  o 161.9329 3.261913 211.1217  29.3  -33.97209      6.523826 0.97 
1 1 1 40  6  4  o 59.04890 8.976264 87.51091  41.8  -16.78479      17.95253 0.74 
1 1 1 40  6  5  o 83.07184 4.985722 114.4689  69.4  20.22472       9.971444 0.88 
1 1 1 40  6  6  o 147.0920 3.674772 177.6971  262.1 2.980347       7.349544 0.96 
1 1 1 40  6  7  o 40.72694 9.352626 107.8034  143.3 2.595684       18.70525 0.74 
1 1 1 40  6  8  o 40.54774 9.619783 59.90683  73.1  -6.564087      19.23957 0.59 
1 1 1 40  6  9  o 105.6380 4.911333 109.5978  13.8  -17.91826      9.822666 0.94 
1 1 1 40  6  10 o 108.7566 4.934879 98.03561  321.5 -13.33367      9.869759 0.92 
1 1 1 40  6  11 o 60.93912 8.226810 87.68349  186.0 8.996105       16.45362 0.79 
1 1 1 40  6  12 o 113.4853 5.090328 190.8567  41.2  -31.65310      10.18066 0.96 
1 1 1 40  6  13 o 66.56583 8.813350 76.70815  176.2 -26.70557      17.62670 0.81 
1 1 1 40  6  14 o 88.42120 6.227778 101.8695  162.0 27.94557       12.45556 0.92 
1 1 1 40  6  15 o 84.33719 6.907588 76.64216  212.7 26.41025       13.81518 0.91 
1 1 1 40  6  16 o 54.13484 11.12204 115.4623  271.2 -10.06784      22.24409 0.91 
1 1 1 40  6  17 o 98.79704 6.360988 122.4277  292.4 -6.138313      12.72198 0.96 
1 1 1 40  6  18 o 53.17384 11.58376 99.89804  274.8 16.10320       23.16752 0.90 
1 1 1 40  6  19 o 28.93459 9.256418 54.27129  206.6 -1.607853      18.51284 0.68 
1 1 1 40  6  20 x ?        ?        92.84197  148.7 ?              ?        0.00 
1 1 1 40  8  0  o 174.9239 3.776461 296.4862  307.7 -1.831390      7.552922 0.98 
1 1 1 40  8  1  o 121.3077 4.790710 197.2379  210.5 15.23318       9.581420 0.96 
1 1 1 40  8  2  o 139.4543 4.500903 217.4585  215.6 21.45543       9.001806 0.97 
1 1 1 40  8  3  o 95.98831 5.476985 87.23820  189.7 3.774773       10.95397 0.89 
1 1 1 40  8  4  o 135.3973 4.544370 131.6027  182.2 -3.701797      9.088740 0.96 
1 1 1 40  8  5  o 160.9052 3.496575 209.2224  34.1  13.00966       6.993149 0.98 
1 1 1 40  8  6  o 163.6545 3.860731 189.2447  35.5  -12.96834      7.721462 0.98 
1 1 1 40  8  7  o 130.5244 4.272550 153.4575  268.5 -4.791260      8.545100 0.96 
1 1 1 40  8  8  o 151.2233 3.944917 164.3506  297.2 3.590927       7.889835 0.96 
1 1 1 40  8  9  o 141.3010 4.114229 187.9241  28.6  -3.498413      8.228457 0.97 
1 1 1 40  8  10 o 199.7364 3.794228 278.4327  67.4  15.02545       7.588455 0.99 
1 1 1 40  8  11 o 53.87930 9.380925 67.46035  277.4 -20.90118      18.76185 0.75 
1 1 1 40  8  12 o 102.5128 5.521577 121.2307  191.0 10.38970       11.04315 0.95 
1 1 1 40  8  13 o 165.6311 4.027410 188.9790  242.9 30.32236       8.054820 0.98 
1 1 1 40  8  14 o 36.04022 9.897831 61.80391  287.5 -10.58284      19.79566 0.75 
1 1 1 40  8  15 o 61.59570 8.967053 100.4585  37.5  1.378716       17.93411 0.93 
1 1 1 40  8  16 o 30.22743 9.818377 61.95615  94.7  6.648722       19.63675 0.71 
1 1 1 40  8  17 o 127.6127 5.797646 144.1510  98.0  5.712311       11.59529 0.98 
1 1 1 40  8  18 x ?        ?        59.31146  73.8  ?              ?        0.00 
1 1 1 40  10 0  o 56.90487 8.843315 119.8847  29.7  20.84197       17.68663 0.89 
1 1 1 40  10 1  o 84.43916 6.102373 134.3045  309.3 7.281036       12.20475 0.94 
1 1 1 40  10 2  o 161.4993 5.204876 227.4144  305.7 8.032318       10.40975 0.98 
1 1 1 40  10 3  f 96.68724 5.830902 214.1476  315.3 38.74653       11.66180 0.00 
1 1 1 40  10 4  o 84.13792 7.413657 27.37303  293.7 -2.010902      14.82731 0.56 
1 1 1 40  10 5  o 80.97404 6.804048 64.55370  179.8 -10.06135      13.60810 0.83 
1 1 1 40  10 6  o 85.12979 6.112004 80.77423  140.4 26.81628       12.22401 0.88 
1 1 1 40  10 7  o 180.6395 4.046779 214.6338  178.5 -5.605072      8.093557 0.98 
1 1 1 40  10 8  o 85.21484 6.511965 134.1600  65.5  44.71399       13.02393 0.95 
1 1 1 40  10 9  o 103.8864 5.717163 138.2382  12.6  12.30719       11.43433 0.96 
1 1 1 40  10 10 o 77.35686 8.808289 123.2808  298.4 -11.29144      17.61658 0.95 
1 1 1 40  10 11 o 80.19899 7.585491 85.82204  342.1 -19.28480      15.17098 0.94 
1 1 1 40  10 12 o 30.59789 9.591313 22.54908  330.6 11.71163       19.18263 0.37 
1 1 1 40  10 13 o 56.05443 9.683051 62.15736  356.2 28.24136       19.36610 0.87 
1 1 1 40  10 14 o 36.30855 10.11073 74.37878  211.8 -9.223703      20.22146 0.83 
1 1 1 40  10 15 o 51.15088 10.61108 70.28866  310.3 ?              ?        0.89 
1 1 1 40  12 0  o 149.9904 4.290436 195.4293  110.6 20.45326       8.580873 0.98 
1 1 1 40  12 1  o 90.76912 6.445961 143.8932  85.9  -32.36783      12.89192 0.96 
1 1 1 40  12 2  o 86.97504 6.232112 154.3853  88.3  15.78135       12.46422 0.96 
1 1 1 40  12 3  o 82.00026 7.158753 125.2876  19.7  -8.754478      14.31751 0.95 
1 1 1 40  12 4  o 78.06491 7.293055 99.49643  334.9 5.706879       14.58611 0.94 
1 1 1 40  12 5  o 86.91035 7.435417 111.5498  139.7 24.18958       14.87083 0.96 
1 1 1 40  12 6  o 27.40497 9.100137 58.75385  160.8 13.39293       18.20027 0.71 
1 1 1 40  12 7  o 50.06935 10.49255 102.2395  261.1 6.325184       20.98510 0.91 
1 1 1 40  12 8  o 50.18239 8.873849 72.39337  91.2  -26.05199      17.74770 0.88 
1 1 1 40  12 9  o 49.27031 11.86820 64.72161  173.6 3.094299       23.73640 0.85 
1 1 1 40  12 10 o 50.29834 11.25136 68.37257  231.7 -14.82441      22.50271 0.87 
1 1 1 40  12 11 o 32.18983 9.721442 13.16906  209.4 ?              ?        0.29 
1 1 1 40  14 0  o 75.37256 7.633353 149.7013  225.9 -3.244453      15.26671 0.97 
1 1 1 40  14 1  o 57.94711 10.43145 71.07761  208.7 -9.183475      20.86290 0.90 
1 1 1 40  14 2  o 43.71507 10.39413 46.49726  168.1 -4.320400      20.78826 0.78 
1 1 1 40  14 3  o 59.45655 9.761534 99.32812  126.6 -14.50931      19.52307 0.94 
1 1 1 40  14 4  f 34.92446 10.38527 47.91182  292.6 ?              ?        0.00 
1 1 1 40  14 5  o 86.91869 7.661310 116.2171  40.8  ?              ?        0.97 
1 1 1 40  14 6  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 41  1  0  o 115.6722 3.727633 166.2729  35.7  17.07034       7.455265 0.86 
1 1 1 41  1  1  o 250.0012 3.144175 432.4392  75.4  8.896332       6.288349 0.98 
1 1 1 41  1  2  o 163.5584 3.097809 238.2200  60.7  -11.68069      6.195619 0.95 
1 1 1 41  1  3  o 105.4687 3.722499 114.0539  16.3  35.54582       7.444999 0.85 
1 1 1 41  1  4  o 40.69471 8.536683 41.93977  260.5 -4.548424      17.07337 0.18 
1 1 1 41  1  5  o 28.39793 7.765188 98.33643  279.8 15.28895       15.53038 0.37 
1 1 1 41  1  6  o 117.1217 3.315256 235.5034  26.3  -0.1639175     6.630513 0.94 
1 1 1 41  1  7  o 216.2750 2.849298 255.0049  31.4  -15.59142      5.698596 0.98 
1 1 1 41  1  8  o 204.8985 3.049654 250.7246  157.2 47.11589       6.099309 0.98 
1 1 1 41  1  9  o 77.48113 5.158431 95.58189  18.4  -6.166519      10.31686 0.84 
1 1 1 41  1  10 o 138.8496 3.877832 227.2816  50.9  -28.35020      7.755664 0.97 
1 1 1 41  1  11 o 146.6040 3.455798 168.7893  12.0  -21.76059      6.911595 0.97 
1 1 1 41  1  12 o 68.18330 6.736589 44.36872  218.6 22.83869       13.47318 0.71 
1 1 1 41  1  13 o 98.00242 5.346126 127.7404  117.5 36.93498       10.69225 0.92 
1 1 1 41  1  14 o 65.70399 6.877652 118.4600  78.1  13.34661       13.75530 0.86 
1 1 1 41  1  15 o 159.9505 4.402499 157.0385  225.4 23.83913       8.804998 0.96 
1 1 1 41  1  16 o 50.81860 10.48786 82.88543  183.1 1.998878       20.97573 0.77 
1 1 1 41  1  17 o 123.8194 5.593875 148.2204  80.7  4.816147       11.18775 0.97 
1 1 1 41  1  18 o 67.99072 8.404713 119.5923  65.2  11.67910       16.80943 0.93 
1 1 1 41  1  19 o 56.30788 10.76389 28.16314  210.2 -7.951977      21.52777 0.62 
1 1 1 41  1  20 o 29.29036 8.980644 41.88560  70.8  -10.23347      17.96129 0.54 
1 1 1 41  1  21 o 36.75691 10.29609 51.72000  121.7 ?              ?        0.73 
1 1 1 41  3  0  o 151.1306 3.167328 122.9542  143.0 -6.834213      6.334655 0.89 
1 1 1 41  3  1  o 115.0675 3.655879 223.5916  107.8 -39.19938      7.311757 0.93 
1 1 1 41  3  2  f 206.1580 2.836604 186.6605  239.2 8.334152       5.673208 0.00 
1 1 1 41  3  3  o 116.4651 3.754011 207.5048  89.2  32.02253       7.508021 0.92 
1 1 1 41  3  4  o 59.62284 6.256046 56.63433  39.2  -25.93670      12.51209 0.48 
1 1 1 41  3  5  o 222.1076 2.761617 266.0778  299.1 35.64767       5.523234 0.98 
1 1 1 41  3  6  o 124.0856 3.421816 165.3764  200.1 -2.114517      6.843633 0.94 
1 1 1 41  3  7  o 122.6547 3.594756 251.8505  120.2 -3.438286      7.189513 0.96 
1 1 1 41  3  8  o 258.8802 3.539607 354.4310  165.8 -3.827026      7.079215 0.99 
1 1 1 41  3  9  o 97.63239 4.117088 180.2619  10.2  13.72867       8.234176 0.94 
1 1 1 41  3  10 o 36.66600 8.919142 60.87143  43.8  12.41200       17.83828 0.53 
1 1 1 41  3  11 o 61.04836 7.475558 94.90261  159.1 -45.45385      14.95112 0.87 
1 1 1 41  3  12 o 63.54837 7.122796 122.3918  35.7  17.15759       14.24559 0.88 
1 1 1 41  3  13 o 124.9013 4.153954 102.3927  114.9 2.941406       8.307907 0.92 
1 1 1 41  3  14 o 54.64809 9.054410 45.00679  219.6 6.405453       18.10882 0.54 
1 1 1 41  3  15 o 38.80743 9.677978 18.22029  258.0 11.91616       19.35596 0.20 
1 1 1 41  3  16 o 56.27391 8.309237 83.41528  335.4 42.34350       16.61847 0.84 
1 1 1 41  3  17 o 95.79320 6.537381 92.74702  14.0  29.20676       13.07476 0.94 
1 1 1 41  3  18 o 33.60968 9.871224 45.19832  219.7 -4.574747      19.74245 0.61 
1 1 1 41  3  19 o 43.69051 10.70156 69.82040  157.6 -16.13273      21.40313 0.81 
1 1 1 41  3  20 o 41.94378 10.42874 26.52209  207.4 2.491150       20.85748 0.52 
1 1 1 41  3  21 o 120.4776 6.005797 146.7820  281.4 ?              ?        0.98 
1 1 1 41  5  0  o 128.3563 3.603902 172.4127  27.1  4.371353       7.207803 0.92 
1 1 1 41  5  1  o 162.6058 3.151147 228.8482  276.4 -15.21431      6.302293 0.95 
1 1 1 41  5  2  o 234.2658 2.767212 334.6424  270.6 -4.497757      5.534425 0.98 
1 1 1 41  5  3  o 74.18105 5.080611 77.74683  302.3 -7.440758      10.16122 0.72 
1 1 1 41  5  4  o 147.7737 2.941556 250.6792  97.5  4.539597       5.883112 0.97 
1 1 1 41  5  5  o 214.3792 3.200226 310.3084  21.5  53.53282       6.400451 0.98 
1 1 1 41  5  6  f 164.0172 3.598878 189.0534  310.9 -24.34685      7.197756 0.00 
1 1 1 41  5  7  o 43.86515 8.688058 41.00592  108.4 -10.34595      17.37612 0.40 
1 1 1 41  5  8  o 73.69865 6.872659 93.45631  193.1 33.10399       13.74532 0.86 
1 1 1 41  5  9  f 39.47015 8.955610 93.57440  100.1 23.02325       17.91122 0.00 
1 1 1 41  5  10 o 44.47185 9.906232 65.41887  187.1 1.246216       19.81246 0.67 
1 1 1 41  5  11 o 47.51267 9.016915 102.0866  304.7 -8.511181      18.03383 0.77 
1 1 1 41  5  12 o 177.1223 4.037884 223.2523  308.0 -25.24380      8.075768 0.98 
1 1 1 41  5  13 o 86.71802 6.502651 81.62605  268.6 -15.56037      13.00530 0.86 
1 1 1 41  5  14 o 86.74399 6.549353 142.0668  356.6 4.301575       13.09871 0.94 
1 1 1 41  5  15 o 34.25832 9.080310 22.31165  287.6 -17.07483      18.16062 0.29 
1 1 1 41  5  16 o 68.33556 9.636802 94.29951  165.0 0.3058319      19.27360 0.91 
1 1 1 41  5  17 o 27.88819 8.857866 18.47632  135.6 -8.162928      17.71573 0.27 
1 1 1 41  5  18 o 39.32454 10.49246 39.86264  281.2 -15.50787      20.98491 0.62 
1 1 1 41  5  19 f 29.46967 9.322730 74.35123  140.1 11.46340       18.64546 0.00 
1 1 1 41  5  20 o 72.63887 8.927527 120.3177  87.0  ?              ?        0.96 
1 1 1 41  7  0  f 351.0449 3.593791 461.8417  339.9 8.865234       7.187583 0.00 
1 1 1 41  7  1  o 210.4157 4.561724 250.3712  294.9 7.042068       9.123448 0.98 
1 1 1 41  7  2  o 97.94561 4.901538 167.2648  260.0 9.131027       9.803077 0.94 
1 1 1 41  7  3  o 240.5891 4.041017 336.5300  202.4 20.62538       8.082034 0.99 
1 1 1 41  7  4  o 190.2383 3.454246 285.7228  170.9 -1.929153      6.908493 0.98 
1 1 1 41  7  5  o 127.5806 4.549386 203.8204  38.9  -26.17612      9.098772 0.97 
1 1 1 41  7  6  o 135.5250 4.327166 193.0733  50.1  -3.683823      8.654332 0.97 
1 1 1 41  7  7  o 29.04354 8.580949 56.91693  72.5  3.820942       17.16190 0.51 
1 1 1 41  7  8  o 109.0797 4.732086 159.7786  234.3 36.20992       9.464172 0.95 
1 1 1 41  7  9  o 116.6370 4.768527 117.3907  48.1  -25.93054      9.537054 0.93 
1 1 1 41  7  10 o 125.4208 4.442080 200.7466  82.2  -16.44281      8.884159 0.96 
1 1 1 41  7  11 o 62.40760 8.775774 128.2719  168.4 -20.11767      17.55155 0.89 
1 1 1 41  7  12 o 70.62298 8.735433 108.1916  51.4  -16.73125      17.47087 0.90 
1 1 1 41  7  13 o 41.39589 9.866117 74.31763  146.1 9.036118       19.73223 0.76 
1 1 1 41  7  14 o 156.5921 4.559004 192.2782  149.5 11.39093       9.118009 0.98 
1 1 1 41  7  15 o 75.07802 7.202982 87.06108  231.1 31.11974       14.40596 0.93 
1 1 1 41  7  16 o 68.91481 10.03866 76.15514  283.6 -15.22265      20.07731 0.91 
1 1 1 41  7  17 o 59.41538 10.34999 63.58286  66.7  -9.213985      20.69998 0.87 
1 1 1 41  7  18 o 36.36489 10.93200 26.72642  279.9 ?              ?        0.51 
1 1 1 41  9  0  o 216.4373 3.900548 331.3498  6.9   -11.88748      7.801096 0.99 
1 1 1 41  9  1  o 58.42193 9.064676 87.50175  16.8  -12.97727      18.12935 0.86 
1 1 1 41  9  2  o 47.22353 9.559798 141.1498  294.7 36.50390       19.11960 0.90 
1 1 1 41  9  3  o 70.91712 7.396873 108.4485  297.6 38.44724       14.79375 0.90 
1 1 1 41  9  4  o 143.2392 4.628706 194.1682  340.7 -7.796387      9.257411 0.97 
1 1 1 41  9  5  o 53.28961 9.820185 129.9506  0.1   -4.474087      19.64037 0.85 
1 1 1 41  9  6  o 251.0895 3.819727 310.6794  7.3   -0.4737854     7.639454 0.99 
1 1 1 41  9  7  o 49.57493 10.23230 35.84937  34.7  3.221554       20.46459 0.46 
1 1 1 41  9  8  o 215.8791 4.193036 280.1595  221.3 -7.230911      8.386072 0.99 
1 1 1 41  9  9  o 171.2330 4.322518 199.4066  250.6 26.46216       8.645037 0.98 
1 1 1 41  9  10 o 52.69242 10.13717 106.7692  314.6 8.404732       20.27433 0.89 
1 1 1 41  9  11 o 33.74027 9.981238 33.87732  317.7 7.307432       19.96248 0.48 
1 1 1 41  9  12 o 48.59679 9.646836 72.49671  130.6 2.382156       19.29367 0.86 
1 1 1 41  9  13 o 26.84488 8.887514 11.80474  76.7  10.07615       17.77503 0.18 
1 1 1 41  9  14 o 46.49438 11.01555 63.72195  164.0 0.3726578E-01  22.03111 0.82 
1 1 1 41  9  15 o 48.86261 10.40806 61.13234  281.3 -6.668179      20.81613 0.85 
1 1 1 41  9  16 o 42.95922 11.17319 45.79149  344.6 ?              ?        0.77 
1 1 1 41  11 0  o 37.80560 9.144537 70.17651  73.7  32.35291       18.28907 0.64 
1 1 1 41  11 1  o 59.70406 10.30315 42.94518  213.0 11.03842       20.60630 0.63 
1 1 1 41  11 2  o 78.77522 9.135975 129.1621  178.4 -37.80440      18.27195 0.92 
1 1 1 41  11 3  o 65.27553 9.618829 100.8194  201.4 -40.36670      19.23766 0.89 
1 1 1 41  11 4  o 150.0251 4.247151 157.1162  191.6 5.703201       8.494302 0.98 
1 1 1 41  11 5  o 34.57779 10.04465 12.61111  285.6 10.38955       20.08931 0.19 
1 1 1 41  11 6  o 66.18162 8.266994 112.0821  106.5 5.889332       16.53399 0.93 
1 1 1 41  11 7  o 113.9880 5.162570 132.2062  168.0 14.31602       10.32514 0.97 
1 1 1 41  11 8  o 39.85298 10.66751 20.66193  93.6  -2.829586      21.33501 0.43 
1 1 1 41  11 9  o 109.3220 5.459955 151.2706  278.7 9.161461       10.91991 0.98 
1 1 1 41  11 10 o 46.37911 10.65180 69.89620  190.3 -10.71938      21.30361 0.85 
1 1 1 41  11 11 o 45.18669 10.33135 57.00351  95.6  -6.277275      20.66270 0.82 
1 1 1 41  11 12 o 47.40420 10.80369 75.12901  14.3  ?              ?        0.88 
1 1 1 41  11 13 x ?        ?        43.92981  170.9 ?              ?        0.00 
1 1 1 41  13 0  o 63.75721 9.375576 144.5344  34.5  -36.31588      18.75115 0.96 
1 1 1 41  13 1  o 49.54089 10.52011 138.4563  40.0  17.26695       21.04021 0.94 
1 1 1 41  13 2  o 47.50976 10.50059 54.97166  250.9 23.06145       21.00117 0.83 
1 1 1 41  13 3  o 40.60936 9.750455 65.17916  319.2 15.13090       19.50091 0.83 
1 1 1 41  13 4  o 81.84771 8.167204 110.6849  296.8 39.91191       16.33441 0.96 
1 1 1 41  13 5  o 48.30695 10.49049 57.26974  292.9 26.43307       20.98098 0.84 
1 1 1 41  13 6  o 47.73206 10.01964 102.0312  279.9 -11.19556      20.03928 0.92 
1 1 1 41  13 7  o 65.98542 9.675329 95.68993  222.3 ?              ?        0.94 
1 1 1 41  13 8  o 31.40967 10.08277 59.82164  221.6 ?              ?        0.79 
1 1 1 42  0  0  o 139.3467 4.542493 143.6392  360.0 0.000000       0.000000 0.99 
1 1 1 42  0  1  o 334.0811 4.554526 319.2463  180.0 0.000000       0.000000 1.00 
1 1 1 42  0  2  o 15.92867 10.88735 34.81841  0.0   0.000000       0.000000 0.04 
1 1 1 42  0  3  o 36.31835 14.93100 49.04461  0.0   0.000000       0.000000 0.34 
1 1 1 42  0  4  o 45.04073 13.81250 59.74595  180.0 0.000000       0.000000 0.36 
1 1 1 42  0  5  o 31.77832 15.31880 156.4866  180.0 0.000000       0.000000 0.65 
1 1 1 42  0  6  o 39.96332 14.88567 115.9548  0.0   0.000000       0.000000 0.66 
1 1 1 42  0  7  f 111.8682 5.756890 110.2605  0.0   0.000000       0.000000 0.00 
1 1 1 42  0  8  o 18.34264 11.65635 24.49885  0.0   0.000000       0.000000 0.10 
1 1 1 42  0  9  o 53.80227 11.02982 150.0654  180.0 0.000000       0.000000 0.96 
1 1 1 42  0  10 o 179.0933 4.027287 183.7946  180.0 0.000000       0.000000 1.00 
1 1 1 42  0  11 o 33.94019 17.44820 40.83566  0.0   0.000000       0.000000 0.41 
1 1 1 42  0  12 o 70.01947 9.938682 90.39949  180.0 0.000000       0.000000 0.96 
1 1 1 42  0  13 o 82.79480 9.222287 118.7217  180.0 0.000000       0.000000 0.98 
1 1 1 42  0  14 o 82.54924 9.937228 110.0403  0.0   0.000000       0.000000 0.98 
1 1 1 42  0  15 o 107.5715 7.260738 172.1953  180.0 0.000000       0.000000 1.00 
1 1 1 42  0  16 o 137.1797 5.924061 165.0135  180.0 0.000000       0.000000 1.00 
1 1 1 42  0  17 o 80.85709 9.926845 121.5736  0.0   0.000000       0.000000 1.00 
1 1 1 42  0  18 o 21.42474 14.25349 33.59165  180.0 0.000000       0.000000 0.35 
1 1 1 42  0  19 o 52.03337 16.39310 86.14386  180.0 0.000000       0.000000 0.97 
1 1 1 42  0  20 o 26.20397 17.42248 22.22318  0.0   0.000000       0.000000 0.29 
1 1 1 42  0  21 o 59.16273 14.97272 19.87914  0.0   ?              ?        0.61 
1 1 1 42  2  0  f 320.8716 3.274412 434.1950  45.3  27.64432       6.548825 0.00 
1 1 1 42  2  1  o 54.12770 7.449557 64.38231  234.2 25.42260       14.89911 0.40 
1 1 1 42  2  2  o 77.71809 5.612119 100.2888  146.3 -25.18659      11.22424 0.73 
1 1 1 42  2  3  o 160.0787 3.200664 214.8199  43.6  36.99913       6.401329 0.95 
1 1 1 42  2  4  o 194.4853 2.942490 317.7248  8.2   16.14917       5.884979 0.97 
1 1 1 42  2  5  f 162.9165 2.940315 170.6904  83.3  9.619217       5.880630 0.00 
1 1 1 42  2  6  o 75.23308 4.551231 45.24923  256.7 -20.09824      9.102463 0.57 
1 1 1 42  2  7  f 181.1173 3.058416 199.8409  314.1 -2.684982      6.116833 0.00 
1 1 1 42  2  8  o 116.2018 3.625070 203.0982  252.7 -12.26286      7.250139 0.95 
1 1 1 42  2  9  o 201.2710 3.511142 281.9512  315.0 -27.67245      7.022285 0.98 
1 1 1 42  2  10 o 30.91271 8.827916 55.13679  119.7 0.8714085      17.65583 0.45 
1 1 1 42  2  11 o 80.25319 5.492486 130.4189  49.4  -0.5369949     10.98497 0.93 
1 1 1 42  2  12 o 159.7738 3.496923 188.0263  278.0 5.026718       6.993846 0.97 
1 1 1 42  2  13 o 135.6011 4.160120 219.0946  181.3 -8.316040      8.320239 0.97 
1 1 1 42  2  14 o 54.09703 9.396758 44.71024  86.6  8.395851       18.79352 0.53 
1 1 1 42  2  15 o 155.7768 5.296944 206.4601  230.5 -13.50929      10.59389 0.98 
1 1 1 42  2  16 o 130.8319 4.786158 160.0389  249.2 -14.57124      9.572315 0.97 
1 1 1 42  2  17 o 70.94810 8.413515 81.66259  29.5  -12.96672      16.82703 0.90 
1 1 1 42  2  18 o 60.13133 9.880580 93.15254  260.4 8.768421       19.76116 0.91 
1 1 1 42  2  19 o 53.60739 9.781478 73.35635  76.0  29.07251       19.56296 0.86 
1 1 1 42  2  20 o 33.02174 9.798270 33.30127  145.9 12.84159       19.59654 0.52 
1 1 1 42  2  21 x ?        ?        50.66121  257.0 ?              ?        0.00 
1 1 1 42  4  0  o 224.6394 3.368073 315.5087  72.1  -38.20845      6.736145 0.98 
1 1 1 42  4  1  o 212.5219 2.796819 265.2318  140.3 -8.273239      5.593638 0.97 
1 1 1 42  4  2  o 148.1413 3.364924 149.7326  221.9 41.06750       6.729847 0.92 
1 1 1 42  4  3  o 144.8490 3.231698 252.6772  204.5 61.91380       6.463397 0.96 
1 1 1 42  4  4  o 84.62305 4.691097 99.48084  48.1  -50.82932      9.382195 0.83 
1 1 1 42  4  5  o 45.59898 7.674551 33.66665  4.8   -7.163235      15.34910 0.32 
1 1 1 42  4  6  f 129.7659 3.846948 81.99808  153.8 2.113159       7.693895 0.00 
1 1 1 42  4  7  o 128.6574 3.893963 156.4097  125.1 0.8039093      7.787926 0.95 
1 1 1 42  4  8  o 116.7823 4.087829 182.8741  222.5 16.75817       8.175658 0.96 
1 1 1 42  4  9  o 126.0604 4.971145 158.6018  122.6 8.705971       9.942290 0.96 
1 1 1 42  4  10 o 158.9011 3.702777 209.2763  109.4 3.745438       7.405554 0.98 
1 1 1 42  4  11 o 90.69950 5.161862 126.7092  332.9 -2.639786      10.32372 0.92 
1 1 1 42  4  12 o 91.33609 5.517329 83.42987  270.7 2.965363       11.03466 0.86 
1 1 1 42  4  13 o 75.63005 7.941248 94.24447  167.9 3.599998       15.88250 0.86 
1 1 1 42  4  14 o 123.7332 5.078807 135.1283  66.7  -11.58285      10.15761 0.95 
1 1 1 42  4  15 o 58.50402 8.517715 68.31012  211.4 -7.827507      17.03543 0.81 
1 1 1 42  4  16 o 99.12646 6.597756 128.4459  277.3 3.237892       13.19551 0.96 
1 1 1 42  4  17 o 33.92514 10.09850 38.30308  262.6 5.669767       20.19699 0.56 
1 1 1 42  4  18 o 32.26385 9.840192 37.20097  301.0 -0.1983833     19.68038 0.52 
1 1 1 42  4  19 o 31.07235 9.583027 33.70664  342.3 -5.056000      19.16605 0.51 
1 1 1 42  4  20 o 68.82481 9.663908 96.20005  336.3 ?              ?        0.94 
1 1 1 42  6  0  o 127.8047 3.390191 192.9685  117.3 -27.84551      6.780382 0.95 
1 1 1 42  6  1  o 82.65553 6.042255 154.0427  249.7 -53.76265      12.08451 0.91 
1 1 1 42  6  2  o 155.9793 3.080979 237.0085  225.7 -43.40564      6.161958 0.97 
1 1 1 42  6  3  o 209.7549 3.419785 281.1548  174.9 4.279053       6.839571 0.98 
1 1 1 42  6  4  f 85.45798 6.515584 154.9558  88.2  -7.246933      13.03117 0.00 
1 1 1 42  6  5  o 65.84364 6.153933 114.6008  22.5  6.586014       12.30787 0.87 
1 1 1 42  6  6  o 128.5848 4.114914 158.5234  32.4  43.04987       8.229829 0.96 
1 1 1 42  6  7  o 71.22750 6.433968 141.6858  18.5  24.16862       12.86794 0.93 
1 1 1 42  6  8  o 87.68097 5.961976 66.44063  109.5 -23.72895      11.92395 0.86 
1 1 1 42  6  9  o 71.41782 6.634464 84.56662  66.7  10.07633       13.26893 0.84 
1 1 1 42  6  10 o 87.86722 5.406838 122.2860  252.5 1.190590       10.81368 0.91 
1 1 1 42  6  11 o 29.94406 8.767462 27.91022  240.9 -5.122667      17.53492 0.22 
1 1 1 42  6  12 o 111.2624 5.153823 133.9088  342.9 18.81464       10.30765 0.95 
1 1 1 42  6  13 o 127.5347 4.495851 140.9658  26.4  22.30372       8.991701 0.96 
1 1 1 42  6  14 o 154.7878 4.458383 190.5890  78.1  -2.004669      8.916766 0.98 
1 1 1 42  6  15 o 90.39601 6.527647 88.25479  215.1 -4.766472      13.05529 0.94 
1 1 1 42  6  16 o 81.74634 7.424614 84.67953  197.9 -13.32449      14.84923 0.93 
1 1 1 42  6  17 o 126.6381 5.760894 168.3952  71.5  5.883377       11.52179 0.98 
1 1 1 42  6  18 o 59.97538 10.86201 85.58317  6.0   -3.730255      21.72402 0.91 
1 1 1 42  6  19 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 42  8  0  o 138.5845 3.985824 273.8454  4.7   21.91247       7.971648 0.98 
1 1 1 42  8  1  o 81.79854 8.381555 93.77312  328.6 -40.56687      16.76311 0.88 
1 1 1 42  8  2  o 144.0567 4.722838 224.4014  316.3 -0.6399841     9.445676 0.98 
1 1 1 42  8  3  o 41.71296 9.467860 99.97747  183.1 -16.27267      18.93572 0.81 
1 1 1 42  8  4  f 230.1130 3.579773 254.4330  156.9 -25.64874      7.159546 0.00 
1 1 1 42  8  5  f 251.7686 3.513723 297.6093  160.4 35.81784       7.027445 0.00 
1 1 1 42  8  6  o 46.17227 9.409001 23.20322  337.3 -14.37107      18.81800 0.28 
1 1 1 42  8  7  o 50.43063 10.03024 99.60699  104.8 1.135674       20.06048 0.78 
1 1 1 42  8  8  o 144.7100 4.463851 180.4100  158.4 -1.737335      8.927703 0.97 
1 1 1 42  8  9  o 67.63239 8.602800 104.4009  22.7  -12.58612      17.20560 0.88 
1 1 1 42  8  10 o 92.61677 6.033906 168.3352  46.7  4.483276       12.06781 0.96 
1 1 1 42  8  11 o 115.1249 4.949116 162.1028  104.5 21.85828       9.898232 0.97 
1 1 1 42  8  12 o 102.5687 5.760920 125.5412  81.2  40.81446       11.52184 0.96 
1 1 1 42  8  13 o 41.17437 10.17711 52.61011  203.2 19.32700       20.35423 0.75 
1 1 1 42  8  14 o 102.6766 5.919595 149.4677  192.0 2.767479       11.83919 0.97 
1 1 1 42  8  15 o 86.29759 7.618496 105.1715  239.0 11.27026       15.23699 0.95 
1 1 1 42  8  16 o 79.06116 7.894661 68.65601  224.9 -3.028160      15.78932 0.93 
1 1 1 42  8  17 x ?        ?        46.43433  257.4 ?              ?        0.00 
1 1 1 42  10 0  o 114.9032 5.395714 152.6934  48.6  -3.669632      10.79143 0.95 
1 1 1 42  10 1  f 160.1555 4.370180 160.6382  157.0 42.56076       8.740359 0.00 
1 1 1 42  10 2  o 95.55432 7.976123 168.0464  153.1 18.69686       15.95225 0.95 
1 1 1 42  10 3  o 154.3000 4.924984 197.4045  0.4   20.68166       9.849969 0.97 
1 1 1 42  10 4  o 59.19160 10.18831 35.07818  267.9 18.40887       20.37662 0.54 
1 1 1 42  10 5  o 130.1881 5.412699 160.2818  222.9 35.80169       10.82540 0.97 
1 1 1 42  10 6  f 28.95560 9.207005 112.2336  167.8 2.059574       18.41401 0.00 
1 1 1 42  10 7  o 40.30811 10.63144 79.83491  199.4 1.754250       21.26287 0.79 
1 1 1 42  10 8  o 113.4940 6.008162 150.6335  201.7 7.394867       12.01632 0.97 
1 1 1 42  10 9  o 86.38870 6.398427 105.3360  278.6 43.25002       12.79685 0.95 
1 1 1 42  10 10 f 68.82243 7.817976 79.95242  211.9 -1.856384      15.63595 0.00 
1 1 1 42  10 11 o 57.86762 10.66451 132.8501  196.9 -6.198002      21.32901 0.94 
1 1 1 42  10 12 o 61.39300 8.965686 85.02587  99.7  -25.91464      17.93137 0.92 
1 1 1 42  10 13 o 87.40300 7.590640 136.7465  99.4  -7.631996      15.18128 0.97 
1 1 1 42  10 14 x ?        ?        49.43684  329.9 ?              ?        0.00 
1 1 1 42  12 0  o 62.71422 9.004249 68.48188  204.9 28.01203       18.00850 0.87 
1 1 1 42  12 1  o 32.60941 9.793354 27.74996  185.6 17.56669       19.58671 0.41 
1 1 1 42  12 2  o 44.68130 10.70308 84.93254  89.1  20.29496       21.40617 0.86 
1 1 1 42  12 3  o 33.14764 10.09820 75.79512  230.0 10.53353       20.19641 0.80 
1 1 1 42  12 4  o 162.9904 4.418540 223.5131  218.8 5.774887       8.837081 0.99 
1 1 1 42  12 5  o 93.49187 7.086047 162.0905  327.0 -16.85105      14.17209 0.98 
1 1 1 42  12 6  o 65.50640 8.927753 105.4292  321.9 -3.596546      17.85551 0.94 
1 1 1 42  12 7  o 71.52494 8.976936 124.0844  200.6 30.09282       17.95387 0.95 
1 1 1 42  12 8  o 31.58447 9.799315 26.10087  239.1 14.67335       19.59863 0.47 
1 1 1 42  12 9  o 31.47599 10.55589 77.74258  358.7 ?              ?        0.83 
1 1 1 42  12 10 x ?        ?        16.03232  160.5 ?              ?        0.00 
1 1 1 42  14 0  o 47.77525 10.20350 70.65269  272.6 27.37607       20.40701 0.88 
1 1 1 42  14 1  o 73.83685 8.831378 112.8801  251.5 31.97348       17.66276 0.96 
1 1 1 42  14 2  o 51.47564 9.284289 53.55479  121.6 ?              ?        0.87 
1 1 1 42  14 3  o 36.22510 10.58011 22.47723  102.6 ?              ?        0.51 
1 1 1 42  14 4  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 43  1  0  o 100.4083 4.190490 194.3249  330.7 -27.50385      8.380980 0.90 
1 1 1 43  1  1  o 131.2091 3.312641 119.4240  222.1 -1.726135      6.625281 0.88 
1 1 1 43  1  2  o 241.0309 2.880274 339.4263  25.5  22.42084       5.760549 0.98 
1 1 1 43  1  3  o 150.3681 3.201655 234.7530  285.2 -1.560211      6.403309 0.95 
1 1 1 43  1  4  f 160.0598 3.021359 159.9562  218.6 -35.45070      6.042719 0.00 
1 1 1 43  1  5  o 77.18188 5.018322 105.0063  73.2  5.521416       10.03664 0.81 
1 1 1 43  1  6  o 140.3941 3.640144 147.6010  36.9  30.61014       7.280289 0.94 
1 1 1 43  1  7  o 215.1375 3.029609 224.7264  81.5  -36.95749      6.059217 0.98 
1 1 1 43  1  8  o 70.55609 5.403622 164.4961  79.4  12.95341       10.80724 0.90 
1 1 1 43  1  9  o 104.8959 4.045719 146.9301  194.6 -20.96375      8.091437 0.94 
1 1 1 43  1  10 o 60.47046 7.635932 66.59206  188.8 -29.66167      15.27186 0.78 
1 1 1 43  1  11 o 86.89622 5.251099 131.3920  86.3  -16.57478      10.50220 0.93 
1 1 1 43  1  12 o 66.90334 6.445264 106.3298  5.2   5.387047       12.89053 0.85 
1 1 1 43  1  13 o 65.18825 7.141591 44.52659  234.2 0.1680298      14.28318 0.59 
1 1 1 43  1  14 o 91.67027 5.094691 158.9098  36.5  8.829407       10.18938 0.94 
1 1 1 43  1  15 o 55.31996 10.25808 38.69620  238.5 11.48967       20.51617 0.56 
1 1 1 43  1  16 o 149.0405 4.147859 190.2743  238.8 -13.30818      8.295718 0.98 
1 1 1 43  1  17 o 35.94798 10.15017 14.83447  198.0 6.971210       20.30033 0.25 
1 1 1 43  1  18 o 35.34624 10.17209 53.67649  290.0 -1.267521      20.34417 0.68 
1 1 1 43  1  19 o 37.15100 9.916639 101.8191  319.6 19.87251       19.83328 0.86 
1 1 1 43  1  20 o 31.10593 9.726825 11.09917  188.5 ?              ?        0.20 
1 1 1 43  3  0  o 183.3972 2.967139 248.5862  27.4  -13.02164      5.934277 0.96 
1 1 1 43  3  1  o 147.9530 3.251673 143.6993  127.4 -27.56250      6.503345 0.92 
1 1 1 43  3  2  o 150.2057 3.172671 120.5697  100.2 -3.957031      6.345343 0.92 
1 1 1 43  3  3  o 73.16095 4.952855 95.41879  97.5  -6.191498      9.905710 0.75 
1 1 1 43  3  4  o 97.14403 3.750305 108.1458  272.3 -10.23600      7.500611 0.87 
1 1 1 43  3  5  o 130.1145 3.274429 211.6404  158.1 22.28487       6.548859 0.96 
1 1 1 43  3  6  o 191.8036 3.081349 217.1147  358.1 3.994431       6.162698 0.97 
1 1 1 43  3  7  o 48.27853 7.099595 19.92571  105.3 14.69643       14.19919 0.22 
1 1 1 43  3  8  o 159.9886 3.473633 191.2738  247.3 19.17342       6.947266 0.97 
1 1 1 43  3  9  o 111.4990 4.287165 133.2516  317.1 -19.07563      8.574329 0.95 
1 1 1 43  3  10 o 29.36066 8.462736 29.43137  68.1  9.325499       16.92547 0.27 
1 1 1 43  3  11 o 108.4219 4.432955 132.9065  105.7 11.06181       8.865911 0.93 
1 1 1 43  3  12 o 57.32463 9.062171 107.8553  148.3 12.83263       18.12434 0.81 
1 1 1 43  3  13 o 150.7156 4.179822 191.7212  188.8 -9.065918      8.359644 0.97 
1 1 1 43  3  14 o 105.6320 5.374711 126.7421  75.5  23.81121       10.74942 0.94 
1 1 1 43  3  15 o 116.7571 5.287444 126.6447  212.4 14.62944       10.57489 0.96 
1 1 1 43  3  16 o 36.68237 10.47470 7.572328  115.6 -1.004879      20.94940 0.12 
1 1 1 43  3  17 o 55.55495 9.499726 62.89830  26.7  29.31149       18.99945 0.85 
1 1 1 43  3  18 o 81.80665 8.316197 93.14085  288.2 -17.62540      16.63239 0.94 
1 1 1 43  3  19 o 51.71323 10.28340 51.37532  131.4 -11.98590      20.56680 0.80 
1 1 1 43  3  20 x ?        ?        53.37019  73.9  ?              ?        0.00 
1 1 1 43  5  0  o 110.9442 4.078306 138.7803  135.3 12.58691       8.156611 0.91 
1 1 1 43  5  1  o 378.6472 3.826272 515.8952  129.8 26.42743       7.652544 0.99 
1 1 1 43  5  2  o 71.16806 5.708153 101.8510  284.5 6.946243       11.41631 0.83 
1 1 1 43  5  3  o 299.7736 3.260755 315.8838  255.8 28.97708       6.521511 0.99 
1 1 1 43  5  4  f 76.32922 5.872154 149.5001  138.9 9.500031       11.74431 0.00 
1 1 1 43  5  5  o 186.9395 3.304043 222.8018  109.6 -19.33470      6.608086 0.98 
1 1 1 43  5  6  o 33.70236 8.758812 97.77872  323.1 -1.864075      17.51762 0.66 
1 1 1 43  5  7  o 92.76778 5.188375 82.55749  357.2 4.672676       10.37675 0.90 
1 1 1 43  5  8  o 120.9923 4.241388 147.1124  85.0  -28.46393      8.482777 0.96 
1 1 1 43  5  9  o 112.4150 4.663990 152.5357  223.8 21.32598       9.327979 0.95 
1 1 1 43  5  10 o 93.79964 5.306049 108.7128  225.1 -14.00909      10.61210 0.90 
1 1 1 43  5  11 o 108.9716 5.052118 85.54858  74.4  -42.74758      10.10424 0.90 
1 1 1 43  5  12 o 88.03819 6.784287 90.63974  146.6 -21.79187      13.56857 0.89 
1 1 1 43  5  13 o 85.81699 6.382903 47.27333  203.6 4.114372       12.76581 0.80 
1 1 1 43  5  14 o 119.5776 4.900158 114.0876  92.5  3.004074       9.800317 0.96 
1 1 1 43  5  15 o 52.78305 10.23633 89.53063  226.0 37.99969       20.47266 0.88 
1 1 1 43  5  16 o 31.19510 9.763617 36.52015  233.8 6.872154       19.52723 0.51 
1 1 1 43  5  17 o 37.45027 10.68845 39.82253  119.8 17.17673       21.37691 0.60 
1 1 1 43  5  18 o 39.33691 10.51094 28.24429  224.6 -0.5574036E-01 21.02188 0.53 
1 1 1 43  5  19 x ?        ?        60.03217  250.5 ?              ?        0.00 
1 1 1 43  7  0  o 64.81238 7.060521 86.26129  72.1  -28.11489      14.12104 0.80 
1 1 1 43  7  1  o 228.1822 3.440797 349.9130  34.9  23.45496       6.881593 0.99 
1 1 1 43  7  2  o 242.4948 3.711890 277.7971  345.7 38.87471       7.423779 0.99 
1 1 1 43  7  3  o 44.74474 9.421505 36.80439  116.2 23.56009       18.84301 0.44 
1 1 1 43  7  4  o 120.2084 5.052006 118.8347  109.8 -46.39603      10.10401 0.95 
1 1 1 43  7  5  o 286.0622 3.385321 377.1801  183.5 -19.69040      6.770642 0.99 
1 1 1 43  7  6  o 87.36720 5.863407 129.5311  154.7 2.227264       11.72681 0.93 
1 1 1 43  7  7  o 66.76478 8.763117 65.55515  268.4 -28.45854      17.52623 0.75 
1 1 1 43  7  8  o 79.38161 7.693383 100.4664  236.9 -37.59793      15.38677 0.87 
1 1 1 43  7  9  o 116.6888 4.939195 167.8232  346.0 0.2478943      9.878389 0.96 
1 1 1 43  7  10 o 66.89389 7.706774 62.40024  1.5   28.85298       15.41355 0.78 
1 1 1 43  7  11 o 71.71541 7.428243 114.5615  112.4 1.765999       14.85649 0.91 
1 1 1 43  7  12 o 92.14707 6.162620 98.55517  310.9 3.561417       12.32524 0.94 
1 1 1 43  7  13 o 87.75243 8.393025 136.2078  312.3 -50.58858      16.78605 0.96 
1 1 1 43  7  14 o 38.76428 10.29347 18.71246  173.2 12.24753       20.58695 0.36 
1 1 1 43  7  15 o 60.89609 9.075452 89.02522  20.5  37.63192       18.15090 0.91 
1 1 1 43  7  16 o 32.24080 10.06814 50.94992  62.6  -4.677557      20.13628 0.68 
1 1 1 43  7  17 o 35.71629 10.57852 13.49865  218.9 ?              ?        0.29 
1 1 1 43  9  0  o 52.43443 9.962864 136.7774  26.9  -17.52939      19.92573 0.89 
1 1 1 43  9  1  o 242.0424 4.129697 310.3138  242.5 0.4707336      8.259394 0.99 
1 1 1 43  9  2  o 276.2262 4.534238 302.1418  159.7 19.08093       9.068477 0.99 
1 1 1 43  9  3  o 59.02617 9.561580 99.88988  85.2  19.97021       19.12316 0.82 
1 1 1 43  9  4  o 123.9975 6.159150 230.2598  170.4 -19.54511      12.31830 0.97 
1 1 1 43  9  5  f 74.75724 7.245951 182.3620  179.3 3.446274       14.49190 0.00 
1 1 1 43  9  6  o 41.09507 10.35313 75.29848  22.5  3.820362       20.70626 0.68 
1 1 1 43  9  7  o 117.6640 5.238788 136.3064  67.8  23.65722       10.47758 0.96 
1 1 1 43  9  8  o 68.18627 8.739341 132.1384  113.2 16.94719       17.47868 0.93 
1 1 1 43  9  9  o 69.38781 9.013722 85.76139  274.2 -1.002274      18.02744 0.90 
1 1 1 43  9  10 o 34.27690 10.27637 42.47167  155.6 6.793076       20.55273 0.59 
1 1 1 43  9  11 o 136.9840 5.064577 190.7565  78.0  9.586349       10.12915 0.99 
1 1 1 43  9  12 o 64.77307 9.470470 77.62476  81.8  -18.30995      18.94094 0.91 
1 1 1 43  9  13 o 88.21292 7.388701 113.6109  171.3 -5.870338      14.77740 0.96 
1 1 1 43  9  14 o 94.21284 6.470056 107.5322  224.0 16.32965       12.94011 0.96 
1 1 1 43  9  15 x ?        ?        41.60690  129.4 ?              ?        0.00 
1 1 1 43  11 0  o 78.52637 7.899008 169.4293  155.4 13.77345       15.79802 0.95 
1 1 1 43  11 1  o 38.34780 10.09151 55.44642  91.8  -7.856419      20.18303 0.62 
1 1 1 43  11 2  o 171.8610 5.314133 226.5262  359.1 -21.06534      10.62827 0.99 
1 1 1 43  11 3  o 89.02808 7.642368 132.4241  18.1  2.061569       15.28474 0.95 
1 1 1 43  11 4  o 112.9945 5.932596 246.0574  143.9 2.447807       11.86519 0.98 
1 1 1 43  11 5  o 81.63927 9.079778 95.42505  211.8 -5.655273      18.15956 0.94 
1 1 1 43  11 6  o 57.43679 10.59592 24.11952  295.1 -9.820305      21.19183 0.62 
1 1 1 43  11 7  o 51.16534 10.19893 90.75937  122.2 -12.67802      20.39786 0.90 
1 1 1 43  11 8  o 57.59632 10.65451 101.9569  139.6 5.170071       21.30902 0.92 
1 1 1 43  11 9  o 106.8652 5.766385 140.7357  6.0   32.59415       11.53277 0.98 
1 1 1 43  11 10 o 45.05661 11.01586 64.13184  261.6 7.237247       22.03172 0.84 
1 1 1 43  11 11 o 28.40368 9.408245 50.60662  181.1 ?              ?        0.70 
1 1 1 43  13 0  o 40.77575 10.84133 74.10593  334.2 12.93987       21.68266 0.85 
1 1 1 43  13 1  o 37.21934 10.49807 50.18541  287.2 -1.924889      20.99615 0.74 
1 1 1 43  13 2  o 97.33074 6.793139 150.9216  108.9 4.060638       13.58628 0.98 
1 1 1 43  13 3  o 45.95746 10.62771 104.0313  169.1 -16.59929      21.25541 0.91 
1 1 1 43  13 4  o 37.82611 10.80400 49.67518  283.3 -1.964767      21.60800 0.76 
1 1 1 43  13 5  o 35.65929 10.34677 25.93496  325.7 ?              ?        0.53 
1 1 1 43  13 6  o 29.85478 9.717563 31.47797  213.5 ?              ?        0.57 
1 1 1 44  0  0  o 354.2966 4.998018 528.1937  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  1  o 355.5151 5.356666 481.1124  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  2  o 121.3560 6.041797 120.8860  180.0 0.000000       0.000000 0.96 
1 1 1 44  0  3  o 98.31198 6.110290 117.0604  0.0   0.000000       0.000000 0.94 
1 1 1 44  0  4  o 156.8669 4.544457 241.6772  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  5  o 215.2430 4.425701 323.4215  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  6  o 134.9546 5.290207 117.0819  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  7  o 76.56155 7.692111 108.5892  0.0   0.000000       0.000000 0.96 
1 1 1 44  0  8  o 102.6858 6.019718 152.1912  180.0 0.000000       0.000000 1.00 
1 1 1 44  0  9  o 95.47776 6.106496 121.7283  180.0 0.000000       0.000000 1.00 
1 1 1 44  0  10 o 29.88961 14.76490 43.27630  0.0   0.000000       0.000000 0.39 
1 1 1 44  0  11 o 113.2248 6.967412 108.0510  180.0 0.000000       0.000000 1.00 
1 1 1 44  0  12 o 63.47265 12.98994 80.78834  0.0   0.000000       0.000000 0.84 
1 1 1 44  0  13 o 38.34589 18.05441 8.267151  0.0   0.000000       0.000000 0.08 
1 1 1 44  0  14 o 188.7437 6.045551 237.8267  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  15 o 41.78682 16.19179 129.7094  0.0   0.000000       0.000000 0.96 
1 1 1 44  0  16 o 28.40316 16.50760 81.74581  180.0 0.000000       0.000000 0.75 
1 1 1 44  0  17 o 23.29819 15.30054 37.67142  0.0   0.000000       0.000000 0.41 
1 1 1 44  0  18 o 86.88258 8.868214 118.0130  0.0   0.000000       0.000000 1.00 
1 1 1 44  0  19 o 19.64770 13.52665 4.228952  0.0   0.000000       0.000000 0.05 
1 1 1 44  0  20 x ?        ?        55.03516  180.0 ?              ?        0.00 
1 1 1 44  2  0  o 106.3031 4.531160 133.4948  341.7 15.49646       9.062320 0.87 
1 1 1 44  2  1  o 227.3022 3.085130 316.7367  110.3 -10.14890      6.170259 0.98 
1 1 1 44  2  2  o 256.2778 3.130491 255.2306  105.2 -16.49275      6.260983 0.98 
1 1 1 44  2  3  o 269.7042 3.188738 405.2733  227.6 44.34587       6.377476 0.99 
1 1 1 44  2  4  o 200.5730 3.074123 305.5301  255.8 12.39006       6.148245 0.98 
1 1 1 44  2  5  o 113.3263 3.638358 170.2589  54.3  -24.30908      7.276716 0.94 
1 1 1 44  2  6  o 96.53639 3.953154 105.5727  223.1 29.79484       7.906308 0.89 
1 1 1 44  2  7  o 121.5259 3.418126 156.5602  150.0 -34.32618      6.836252 0.95 
1 1 1 44  2  8  o 171.9418 3.088549 199.9369  46.7  -13.28586      6.177099 0.97 
1 1 1 44  2  9  o 101.3777 5.330137 155.6365  155.1 -15.26720      10.66027 0.95 
1 1 1 44  2  10 o 117.0341 4.328312 92.43084  22.7  -6.742203      8.656625 0.92 
1 1 1 44  2  11 o 138.5703 3.980098 183.1273  41.6  -3.251389      7.960196 0.96 
1 1 1 44  2  12 o 92.80350 5.605349 92.78593  18.1  -9.271629      11.21070 0.88 
1 1 1 44  2  13 o 65.25340 8.090520 84.40907  224.8 5.062202       16.18104 0.81 
1 1 1 44  2  14 o 102.8647 5.713555 106.0613  88.8  -12.61338      11.42711 0.93 
1 1 1 44  2  15 o 35.06283 9.967115 26.43791  248.2 1.713505       19.93423 0.34 
1 1 1 44  2  16 o 38.12733 9.598409 20.08307  130.3 -19.28665      19.19682 0.34 
1 1 1 44  2  17 o 121.2704 5.213769 162.4993  144.7 12.28662       10.42754 0.98 
1 1 1 44  2  18 o 105.3959 6.209023 133.0829  137.7 -0.2451630     12.41805 0.97 
1 1 1 44  2  19 o 34.24304 9.737138 24.91636  321.2 -4.731421      19.47428 0.44 
1 1 1 44  2  20 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 44  4  0  o 169.9098 3.449465 257.3002  152.9 6.893463       6.898930 0.97 
1 1 1 44  4  1  o 246.5666 3.188651 304.7110  63.5  5.819809       6.377303 0.98 
1 1 1 44  4  2  o 261.1380 3.296286 332.2559  291.5 23.22830       6.592571 0.99 
1 1 1 44  4  3  o 154.9821 3.220329 182.3311  190.1 -24.62036      6.440657 0.96 
1 1 1 44  4  4  o 24.50733 7.471059 118.0615  48.3  6.953295       14.94212 0.55 
1 1 1 44  4  5  o 93.91399 4.637283 135.4542  40.5  1.142136       9.274567 0.92 
1 1 1 44  4  6  o 172.3638 3.527511 198.5772  131.5 -19.28555      7.055023 0.97 
1 1 1 44  4  7  o 124.6261 3.770677 163.5355  26.9  -8.753578      7.541353 0.96 
1 1 1 44  4  8  o 273.2983 3.432181 300.1116  3.4   -0.6242981     6.864361 0.99 
1 1 1 44  4  9  o 75.03023 7.814878 67.00143  344.0 -0.1003265E-01 15.62976 0.81 
1 1 1 44  4  10 o 61.09646 7.874867 85.48980  46.2  -6.501759      15.74973 0.78 
1 1 1 44  4  11 o 125.6671 4.701699 106.3723  80.5  -28.76792      9.403398 0.93 
1 1 1 44  4  12 o 42.22565 10.25802 95.08212  102.3 4.885674       20.51603 0.73 
1 1 1 44  4  13 o 55.33891 10.25359 33.73081  291.3 -1.514553      20.50718 0.51 
1 1 1 44  4  14 o 152.4114 4.910596 158.6603  104.5 0.4668732      9.821192 0.98 
1 1 1 44  4  15 o 42.61733 11.05590 60.19410  124.6 2.627708       22.11180 0.75 
1 1 1 44  4  16 o 46.73943 10.79742 61.64756  93.7  14.29083       21.59483 0.80 
1 1 1 44  4  17 o 47.75788 10.61003 68.72495  14.5  -7.741455      21.22006 0.83 
1 1 1 44  4  18 o 63.85714 10.56069 72.59141  305.1 21.94910       21.12138 0.90 
1 1 1 44  4  19 x ?        ?        59.03870  300.1 ?              ?        0.00 
1 1 1 44  6  0  o 63.15950 6.745793 104.7094  290.4 -13.32305      13.49159 0.82 
1 1 1 44  6  1  o 63.27641 6.758701 131.7409  56.8  -14.08418      13.51740 0.87 
1 1 1 44  6  2  o 100.9939 4.420641 132.2570  10.2  29.66008       8.841282 0.92 
1 1 1 44  6  3  o 50.15395 8.506971 47.82191  32.7  -21.22477      17.01394 0.54 
1 1 1 44  6  4  f 54.60012 8.894495 39.89522  7.9   -19.09379      17.78899 0.00 
1 1 1 44  6  5  o 151.9122 3.727987 178.5766  153.8 -0.6823730     7.455975 0.97 
1 1 1 44  6  6  f 112.5554 4.480920 168.9637  324.0 -11.98782      8.961841 0.00 
1 1 1 44  6  7  o 220.3663 3.819350 296.7052  239.9 -15.84018      7.638700 0.99 
1 1 1 44  6  8  o 143.2794 4.329192 195.7081  175.0 -15.53136      8.658383 0.97 
1 1 1 44  6  9  o 97.27402 5.597628 137.6214  50.5  -15.32440      11.19526 0.93 
1 1 1 44  6  10 o 43.29682 10.11122 65.67747  102.3 9.650242       20.22244 0.62 
1 1 1 44  6  11 f 68.69646 8.849935 40.73641  193.7 2.630806       17.69987 0.00 
1 1 1 44  6  12 o 31.38585 9.456054 39.72632  308.7 9.885958       18.91211 0.44 
1 1 1 44  6  13 o 40.89086 9.899109 42.66809  38.0  -1.659935      19.79822 0.61 
1 1 1 44  6  14 o 24.75635 8.327242 46.11121  230.0 0.8790531      16.65448 0.54 
1 1 1 44  6  15 o 96.02753 6.212569 129.0747  298.0 11.75230       12.42514 0.96 
1 1 1 44  6  16 o 32.79717 10.26362 27.03039  249.1 15.81394       20.52723 0.43 
1 1 1 44  6  17 o 44.28916 10.08027 40.96255  196.2 ?              ?        0.73 
1 1 1 44  8  0  o 106.3687 5.948636 102.3127  67.6  -33.42494      11.89727 0.94 
1 1 1 44  8  1  o 138.6037 5.012142 207.4410  210.7 -13.33566      10.02428 0.98 
1 1 1 44  8  2  o 56.37667 9.548783 72.88329  207.7 -3.523907      19.09757 0.80 
1 1 1 44  8  3  o 296.1152 3.872245 372.9697  289.8 9.347565       7.744490 0.99 
1 1 1 44  8  4  o 58.55633 8.409269 94.22250  191.3 -29.62502      16.81854 0.82 
1 1 1 44  8  5  o 63.28475 8.245912 75.38500  180.0 -8.475182      16.49182 0.78 
1 1 1 44  8  6  o 166.7446 3.907147 223.0074  235.4 12.50322       7.814294 0.98 
1 1 1 44  8  7  o 94.15016 5.685157 105.8268  281.8 -17.57154      11.37031 0.92 
1 1 1 44  8  8  o 31.52340 9.091393 29.70213  309.0 -8.078556      18.18279 0.30 
1 1 1 44  8  9  o 64.73267 8.224716 116.1204  244.5 -4.487816      16.44943 0.91 
1 1 1 44  8  10 o 124.2675 4.717413 146.3120  283.5 37.00335       9.434827 0.97 
1 1 1 44  8  11 o 36.01387 10.18956 76.92247  42.3  3.072590       20.37912 0.80 
1 1 1 44  8  12 o 63.95087 9.326337 59.88136  115.9 10.43096       18.65267 0.87 
1 1 1 44  8  13 o 60.45637 9.229369 52.97957  132.7 -11.23839      18.45874 0.85 
1 1 1 44  8  14 o 67.15459 8.974461 66.71272  234.0 46.17769       17.94892 0.90 
1 1 1 44  8  15 o 52.27925 10.46533 79.77816  38.1  ?              ?        0.90 
1 1 1 44  10 0  o 174.5244 4.185571 231.9882  348.0 9.572098       8.371142 0.98 
1 1 1 44  10 1  o 168.4318 4.750413 273.3995  337.0 -12.19565      9.500827 0.98 
1 1 1 44  10 2  o 37.52371 10.56518 27.48236  225.6 -5.409805      21.13036 0.31 
1 1 1 44  10 3  o 96.22263 6.479495 173.4686  112.2 17.79327       12.95899 0.96 
1 1 1 44  10 4  o 121.3205 5.366734 171.5701  69.9  23.30063       10.73347 0.97 
1 1 1 44  10 5  o 36.69966 10.12034 42.91088  35.6  -6.746700      20.24068 0.55 
1 1 1 44  10 6  o 58.55811 9.413915 54.09581  41.2  -7.814552      18.82783 0.81 
1 1 1 44  10 7  o 74.92328 7.614788 24.99195  204.4 31.16132       15.22958 0.71 
1 1 1 44  10 8  o 49.92165 10.37906 38.07499  53.8  0.7428780      20.75812 0.73 
1 1 1 44  10 9  o 113.5018 5.902923 150.5390  51.0  -5.675507      11.80585 0.98 
1 1 1 44  10 10 o 42.33653 11.13982 85.21490  147.0 10.59361       22.27964 0.86 
1 1 1 44  10 11 o 37.43489 10.24482 63.15451  37.1  16.86205       20.48965 0.80 
1 1 1 44  10 12 o 31.52528 9.929173 21.92166  129.2 ?              ?        0.41 
1 1 1 44  10 13 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 44  12 0  o 35.52360 9.982043 14.62536  348.3 -8.911722      19.96409 0.28 
1 1 1 44  12 1  o 40.27124 10.99259 41.40668  5.3   7.745876       21.98518 0.68 
1 1 1 44  12 2  o 123.5119 5.988513 188.6905  47.4  26.07234       11.97703 0.98 
1 1 1 44  12 3  o 77.96707 9.454787 138.1034  78.8  -9.364876      18.90957 0.96 
1 1 1 44  12 4  o 76.22201 9.580868 112.6478  167.8 48.91624       19.16174 0.95 
1 1 1 44  12 5  o 55.04529 11.06571 105.2837  214.0 -2.526611      22.13143 0.92 
1 1 1 44  12 6  o 57.91335 10.36553 83.10715  75.5  29.20086       20.73105 0.91 
1 1 1 44  12 7  o 27.60802 8.852531 46.17439  357.8 -9.562424      17.70506 0.66 
1 1 1 44  12 8  o 35.44449 10.35060 69.42275  191.0 ?              ?        0.84 
1 1 1 44  14 0  o 33.84028 10.09308 43.50371  305.5 ?              ?        0.73 
1 1 1 44  14 1  o 46.22173 11.23893 125.7515  272.9 ?              ?        0.94 
1 1 1 45  1  0  o 171.6118 3.242975 268.5696  177.7 5.830566       6.485951 0.96 
1 1 1 45  1  1  o 182.9374 3.136365 312.5603  11.0  14.92638       6.272730 0.97 
1 1 1 45  1  2  o 124.5294 3.731369 94.27020  294.2 33.67981       7.462737 0.87 
1 1 1 45  1  3  o 55.13210 7.352078 128.5906  120.4 -7.246861      14.70416 0.79 
1 1 1 45  1  4  o 57.60651 7.521441 91.74786  303.3 35.50606       15.04288 0.74 
1 1 1 45  1  5  o 200.3663 3.279291 237.0323  237.1 -9.465775      6.558582 0.98 
1 1 1 45  1  6  o 187.9382 3.279492 240.2924  211.9 -2.541428      6.558984 0.98 
1 1 1 45  1  7  o 236.4703 3.310959 293.7320  347.4 -19.76651      6.621917 0.99 
1 1 1 45  1  8  o 129.4317 3.551743 147.5363  180.3 -0.5321045     7.103486 0.96 
1 1 1 45  1  9  f 164.0411 3.137103 245.9043  180.1 19.19292       6.274206 0.00 
1 1 1 45  1  10 o 227.3430 3.692421 312.0073  312.2 -24.39043      7.384842 0.99 
1 1 1 45  1  11 o 30.12474 8.392799 74.79327  314.2 -5.170002      16.78560 0.47 
1 1 1 45  1  12 o 49.14725 8.629512 63.92704  200.2 21.86043       17.25902 0.63 
1 1 1 45  1  13 o 64.23256 8.859765 87.23914  344.8 -32.90173      17.71953 0.83 
1 1 1 45  1  14 o 45.95134 10.31575 73.52130  148.4 14.00323       20.63150 0.74 
1 1 1 45  1  15 o 36.51008 10.38301 49.89789  82.3  -8.527653      20.76602 0.60 
1 1 1 45  1  16 o 71.05923 8.680805 104.1638  110.9 -34.04746      17.36161 0.93 
1 1 1 45  1  17 o 42.58717 11.59030 34.07931  160.5 16.86691       23.18061 0.57 
1 1 1 45  1  18 o 50.74874 10.77640 71.15184  170.6 -22.45116      21.55280 0.85 
1 1 1 45  1  19 o 102.1714 6.530254 116.0891  254.8 ?              ?        0.97 
1 1 1 45  3  0  o 41.59548 9.147480 163.3882  81.0  5.249889       18.29496 0.74 
1 1 1 45  3  1  o 58.95855 7.146614 80.74136  228.8 -15.55372      14.29323 0.65 
1 1 1 45  3  2  o 263.1229 3.155859 347.8054  212.0 3.968597       6.311718 0.99 
1 1 1 45  3  3  o 85.83852 4.799329 190.3448  202.1 -28.12822      9.598659 0.93 
1 1 1 45  3  4  o 143.6641 3.495514 184.3491  277.8 5.577499       6.991029 0.96 
1 1 1 45  3  5  o 169.5722 3.171232 194.4492  288.7 -9.809326      6.342465 0.97 
1 1 1 45  3  6  o 53.62202 7.237606 62.91557  133.2 -32.43167      14.47521 0.66 
1 1 1 45  3  7  o 124.5753 3.503753 137.4196  32.0  -16.64063      7.007506 0.95 
1 1 1 45  3  8  o 128.2725 4.036724 210.8871  76.9  -3.859612      8.073448 0.98 
1 1 1 45  3  9  o 54.89145 7.825370 146.6504  144.9 -42.00397      15.65074 0.89 
1 1 1 45  3  10 o 96.28580 5.129921 102.4227  37.2  -1.527016      10.25984 0.89 
1 1 1 45  3  11 f 98.44733 5.131381 66.12674  43.6  -11.43051      10.26276 0.00 
1 1 1 45  3  12 o 30.48883 9.649056 39.16343  33.1  -5.710054      19.29811 0.31 
1 1 1 45  3  13 o 33.85636 9.411430 33.31934  17.6  7.467743       18.82286 0.35 
1 1 1 45  3  14 o 45.96180 8.814839 56.22946  257.3 -33.65984      17.62968 0.71 
1 1 1 45  3  15 o 92.42277 9.830358 122.3574  347.9 -5.052826      19.66072 0.95 
1 1 1 45  3  16 o 55.38057 8.948737 52.30175  123.6 -33.92426      17.89747 0.81 
1 1 1 45  3  17 o 55.02008 9.861585 78.36244  165.0 28.12969       19.72317 0.88 
1 1 1 45  3  18 o 67.46860 10.01667 86.33865  204.7 -2.461769      20.03335 0.92 
1 1 1 45  3  19 x ?        ?        63.12274  290.2 ?              ?        0.00 
1 1 1 45  5  0  o 129.3132 4.134163 221.7363  303.7 2.905647       8.268326 0.96 
1 1 1 45  5  1  o 337.4457 3.834282 499.1636  12.1  24.66592       7.668563 0.99 
1 1 1 45  5  2  o 240.0660 2.964265 283.3043  29.8  14.15308       5.928530 0.99 
1 1 1 45  5  3  o 127.3801 3.605266 221.2427  203.7 -33.96759      7.210532 0.96 
1 1 1 45  5  4  o 116.4109 3.988462 138.7190  267.5 -20.74631      7.976923 0.94 
1 1 1 45  5  5  o 35.00082 9.071557 67.85928  55.4  22.10474       18.14311 0.59 
1 1 1 45  5  6  o 56.08371 8.982268 55.18427  237.9 -31.30164      17.96454 0.74 
1 1 1 45  5  7  o 91.13956 5.529682 128.0081  65.1  -12.95222      11.05936 0.93 
1 1 1 45  5  8  o 161.2342 3.834037 209.5806  35.1  0.7391357      7.668074 0.97 
1 1 1 45  5  9  o 211.4941 3.638876 323.6576  342.2 -23.37128      7.277751 0.99 
1 1 1 45  5  10 o 147.5348 4.654450 138.0882  352.3 -19.88417      9.308900 0.96 
1 1 1 45  5  11 o 77.77962 7.672904 107.8113  7.3   -23.77748      15.34581 0.90 
1 1 1 45  5  12 o 56.54338 9.492976 80.95219  83.6  -3.407768      18.98595 0.83 
1 1 1 45  5  13 o 43.25330 8.959417 84.19282  101.1 41.28512       17.91883 0.82 
1 1 1 45  5  14 o 127.6528 4.823493 170.4878  214.6 -14.22047      9.646985 0.98 
1 1 1 45  5  15 o 41.28543 11.03174 97.01766  254.4 8.585331       22.06349 0.87 
1 1 1 45  5  16 o 36.77510 10.41388 43.81167  34.4  -5.434040      20.82776 0.64 
1 1 1 45  5  17 o 100.8156 6.733588 112.8566  53.7  6.918655       13.46718 0.96 
1 1 1 45  5  18 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 45  7  0  o 200.1263 3.284550 274.2013  256.4 -1.377426      6.569099 0.99 
1 1 1 45  7  1  o 223.6685 3.349053 221.7241  223.8 1.906876       6.698107 0.99 
1 1 1 45  7  2  o 118.0274 5.324680 145.5388  133.0 53.50372       10.64936 0.96 
1 1 1 45  7  3  o 190.1965 3.837993 282.1527  318.5 -17.28014      7.675987 0.99 
1 1 1 45  7  4  o 174.8285 4.033358 190.2334  337.7 -0.2267761     8.066715 0.98 
1 1 1 45  7  5  o 29.13939 9.068237 116.8161  180.8 3.261251       18.13647 0.68 
1 1 1 45  7  6  o 37.27678 9.983372 38.96664  210.2 2.357853       19.96674 0.35 
1 1 1 45  7  7  f 150.3690 4.249510 227.0622  350.9 35.07841       8.499020 0.00 
1 1 1 45  7  8  o 39.22664 10.21301 33.69188  332.8 14.43795       20.42601 0.36 
1 1 1 45  7  9  o 130.3466 4.875899 169.2381  161.0 27.18022       9.751798 0.97 
1 1 1 45  7  10 o 39.47774 10.36211 17.06722  184.9 7.529324       20.72421 0.25 
1 1 1 45  7  11 f 34.15928 8.136617 81.98972  46.4  -26.59373      16.27323 0.00 
1 1 1 45  7  12 o 94.47502 6.545187 121.5204  100.3 1.874992       13.09037 0.96 
1 1 1 45  7  13 o 95.12733 6.051123 103.8606  168.6 6.992393       12.10225 0.96 
1 1 1 45  7  14 o 104.6960 5.688939 140.9060  256.1 20.04949       11.37788 0.97 
1 1 1 45  7  15 o 55.54423 10.80783 74.35887  256.3 -5.260468      21.61566 0.89 
1 1 1 45  7  16 o 48.57010 11.41364 71.16777  139.9 ?              ?        0.87 
1 1 1 45  9  0  o 124.2670 5.507070 205.7605  345.1 -4.477715      11.01414 0.97 
1 1 1 45  9  1  o 112.9718 5.573980 109.8673  2.5   0.3973999      11.14796 0.93 
1 1 1 45  9  2  o 32.06926 9.682699 96.54617  278.2 3.008049       19.36540 0.66 
1 1 1 45  9  3  o 41.75277 10.81664 41.16838  174.3 15.38946       21.63328 0.45 
1 1 1 45  9  4  o 178.3377 3.986501 232.3156  176.5 5.555344       7.973001 0.98 
1 1 1 45  9  5  o 67.19349 8.600658 107.2074  179.8 42.95130       17.20132 0.90 
1 1 1 45  9  6  o 61.47609 9.737241 73.53027  65.5  -23.80612      19.47448 0.84 
1 1 1 45  9  7  o 36.65361 10.49456 52.67047  140.3 4.295311       20.98911 0.64 
1 1 1 45  9  8  o 57.15184 10.38415 75.21254  185.5 14.33780       20.76829 0.87 
1 1 1 45  9  9  o 133.9678 4.957900 119.1216  177.0 11.41159       9.915800 0.98 
1 1 1 45  9  10 f 120.6686 5.764377 103.3676  219.5 -8.511902      11.52875 0.00 
1 1 1 45  9  11 o 48.98816 10.82332 53.03896  345.5 32.80907       21.64665 0.80 
1 1 1 45  9  12 o 83.23183 7.917432 101.7544  348.2 20.55684       15.83486 0.95 
1 1 1 45  9  13 o 31.22417 9.662494 54.07502  242.2 ?              ?        0.73 
1 1 1 45  11 0  o 45.91397 10.98837 32.62011  21.0  -3.439877      21.97675 0.53 
1 1 1 45  11 1  o 71.05708 10.44786 114.3835  15.6  11.77795       20.89571 0.93 
1 1 1 45  11 2  o 38.00014 11.11147 29.82105  308.9 -6.647949      22.22293 0.48 
1 1 1 45  11 3  o 40.12533 9.174292 94.66119  57.3  -27.99832      18.34858 0.87 
1 1 1 45  11 4  o 36.87994 10.22592 59.10077  41.7  -14.51685      20.45184 0.77 
1 1 1 45  11 5  o 84.49564 8.697257 110.7378  245.7 -38.89872      17.39451 0.96 
1 1 1 45  11 6  o 35.13052 10.14433 62.60370  308.9 -4.569527      20.28866 0.77 
1 1 1 45  11 7  o 40.39315 9.428677 79.69238  309.2 -23.50476      18.85735 0.86 
1 1 1 45  11 8  o 26.73801 8.832952 18.98273  71.4  2.102146       17.66590 0.31 
1 1 1 45  11 9  o 56.94023 11.28138 81.95828  142.5 ?              ?        0.91 
1 1 1 45  11 10 x ?        ?        62.26346  9.0   ?              ?        0.00 
1 1 1 45  13 0  o 26.28283 8.620667 28.82222  128.5 -7.224150      17.24133 0.46 
1 1 1 45  13 1  o 98.48531 7.329679 143.1415  339.8 25.99972       14.65936 0.98 
1 1 1 45  13 2  o 111.9447 6.462917 159.0443  357.2 3.229271       12.92583 0.98 
1 1 1 45  13 3  o 34.77837 10.07392 62.36375  95.6  ?              ?        0.81 
1 1 1 45  13 4  o 26.84376 9.125036 12.89829  195.1 ?              ?        0.26 
1 1 1 46  0  0  o 15.67650 10.99138 60.31671  180.0 0.000000       0.000000 0.12 
1 1 1 46  0  1  o 66.35388 9.367807 79.70820  0.0   0.000000       0.000000 0.71 
1 1 1 46  0  2  o 209.2671 4.382065 343.2463  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  3  o 146.8440 5.040367 142.6522  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  4  o 35.29374 14.70960 37.19783  0.0   0.000000       0.000000 0.28 
1 1 1 46  0  5  o 93.99824 6.302819 182.3947  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  6  o 41.96874 14.57988 96.98629  0.0   0.000000       0.000000 0.76 
1 1 1 46  0  7  o 221.7134 4.859325 279.4749  0.0   0.000000       0.000000 1.00 
1 1 1 46  0  8  o 182.8221 4.579543 247.1673  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  9  o 243.7558 4.528137 219.3664  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  10 o 54.84848 9.793341 134.6474  0.0   0.000000       0.000000 0.95 
1 1 1 46  0  11 o 171.5542 5.299441 211.2189  0.0   0.000000       0.000000 1.00 
1 1 1 46  0  12 o 184.1893 5.370221 136.2569  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  13 o 70.31776 12.11415 61.50586  0.0   0.000000       0.000000 0.89 
1 1 1 46  0  14 f 188.5142 6.290534 292.0549  180.0 0.000000       0.000000 0.00 
1 1 1 46  0  15 o 20.86484 13.80750 28.62656  180.0 0.000000       0.000000 0.27 
1 1 1 46  0  16 o 44.65154 19.49815 34.50044  180.0 0.000000       0.000000 0.60 
1 1 1 46  0  17 o 79.93334 11.83954 119.4802  180.0 0.000000       0.000000 1.00 
1 1 1 46  0  18 o 17.13267 12.11828 12.34571  0.0   0.000000       0.000000 0.12 
1 1 1 46  0  19 x ?        ?        144.5867  0.0   ?              ?        0.00 
1 1 1 46  2  0  o 199.0973 3.069564 220.3998  181.8 25.64394       6.139129 0.97 
1 1 1 46  2  1  o 180.8690 3.217676 173.1933  18.5  34.60765       6.435353 0.96 
1 1 1 46  2  2  o 131.8850 3.905881 202.9641  97.8  16.24495       7.811761 0.96 
1 1 1 46  2  3  o 156.6597 3.597163 194.8067  206.9 30.82469       7.194325 0.96 
1 1 1 46  2  4  o 204.9536 3.163513 244.8882  220.7 -12.70213      6.327027 0.98 
1 1 1 46  2  5  o 182.0518 3.159300 259.3600  230.4 -31.43559      6.318600 0.98 
1 1 1 46  2  6  o 195.3673 3.190120 294.9294  97.4  28.79286       6.380240 0.98 
1 1 1 46  2  7  o 106.3908 3.899792 120.0818  63.9  23.30131       7.799585 0.94 
1 1 1 46  2  8  o 165.7405 3.092354 167.6524  222.0 -26.01967      6.184707 0.97 
1 1 1 46  2  9  o 153.6535 4.108659 157.9951  283.3 -10.72472      8.217318 0.96 
1 1 1 46  2  10 o 115.4302 4.863031 93.72363  274.7 19.46479       9.726062 0.90 
1 1 1 46  2  11 o 102.4693 4.940955 124.6805  299.1 -3.966118      9.881910 0.92 
1 1 1 46  2  12 o 83.32625 6.198363 72.76286  262.7 -1.588890      12.39673 0.85 
1 1 1 46  2  13 f 108.0378 5.461934 141.4932  39.7  -16.33669      10.92387 0.00 
1 1 1 46  2  14 o 107.8360 6.609895 111.1236  219.6 -4.199173      13.21979 0.95 
1 1 1 46  2  15 f 114.5311 5.574838 118.9807  340.2 36.14700       11.14968 0.00 
1 1 1 46  2  16 o 56.48989 9.576090 94.06782  208.0 1.303436       19.15218 0.90 
1 1 1 46  2  17 o 34.94107 10.59063 73.11518  320.5 6.389425       21.18126 0.78 
1 1 1 46  2  18 o 35.93113 10.10689 34.92613  124.5 ?              ?        0.58 
1 1 1 46  4  0  o 156.7437 3.567858 189.4001  123.7 -20.11191      7.135716 0.96 
1 1 1 46  4  1  o 108.9034 4.454197 105.6377  307.4 -11.23249      8.908394 0.90 
1 1 1 46  4  2  o 78.46758 5.943804 76.44023  17.7  -14.24509      11.88761 0.80 
1 1 1 46  4  3  o 116.1156 3.902030 230.9415  179.1 -17.76031      7.804060 0.96 
1 1 1 46  4  4  o 121.5999 3.486417 146.9723  270.1 -23.27271      6.972835 0.95 
1 1 1 46  4  5  o 54.53461 7.817335 43.59320  298.3 -19.01309      15.63467 0.58 
1 1 1 46  4  6  o 42.94011 8.360866 60.06576  198.4 20.12871       16.72173 0.67 
1 1 1 46  4  7  o 52.11071 8.364041 57.34077  137.9 46.28779       16.72808 0.68 
1 1 1 46  4  8  o 126.5537 4.334117 115.5517  192.5 31.53980       8.668234 0.94 
1 1 1 46  4  9  o 69.74577 9.097311 89.32288  230.9 -0.4295731     18.19462 0.82 
1 1 1 46  4  10 o 42.55745 10.25763 96.82955  42.5  2.223072       20.51525 0.72 
1 1 1 46  4  11 o 72.90025 6.965074 58.61378  69.7  16.86301       13.93015 0.78 
1 1 1 46  4  12 o 41.53783 9.057981 36.17568  49.7  -22.01709      18.11596 0.47 
1 1 1 46  4  13 o 66.56010 7.449954 82.58282  11.1  16.37416       14.89991 0.89 
1 1 1 46  4  14 o 153.6410 4.617938 196.2293  273.1 -4.416977      9.235875 0.98 
1 1 1 46  4  15 o 78.07449 8.578876 71.15548  39.7  -1.445305      17.15775 0.91 
1 1 1 46  4  16 o 29.38796 9.481785 37.31506  0.5   -2.720709      18.96357 0.50 
1 1 1 46  4  17 o 50.56014 11.16663 34.24059  165.2 -15.96126      22.33325 0.68 
1 1 1 46  4  18 x ?        ?        89.55428  207.2 ?              ?        0.00 
1 1 1 46  6  0  f 137.9498 4.078678 177.3965  305.7 10.96396       8.157355 0.00 
1 1 1 46  6  1  f 90.14211 4.913527 164.2987  317.0 6.939606       9.827053 0.00 
1 1 1 46  6  2  o 129.8619 3.525460 187.9204  147.8 10.03131       7.050921 0.97 
1 1 1 46  6  3  o 143.9389 3.679476 229.2709  293.9 9.945465       7.358952 0.98 
1 1 1 46  6  4  o 111.7641 5.156425 120.3154  318.2 4.045982       10.31285 0.95 
1 1 1 46  6  5  o 142.5760 4.282211 154.9277  55.5  -0.6151886     8.564423 0.96 
1 1 1 46  6  6  o 93.46228 5.947750 66.19376  37.0  -13.22767      11.89550 0.83 
1 1 1 46  6  7  o 114.9681 5.521077 198.1444  350.6 23.02721       11.04215 0.96 
1 1 1 46  6  8  o 89.97679 6.039762 119.4368  284.8 -3.234261      12.07952 0.92 
1 1 1 46  6  9  o 46.82076 9.968831 63.42823  336.9 32.48063       19.93766 0.66 
1 1 1 46  6  10 o 72.82676 8.232970 76.63912  10.3  45.37326       16.46594 0.87 
1 1 1 46  6  11 o 58.91320 8.735196 66.93538  186.4 -13.30929      17.47039 0.83 
1 1 1 46  6  12 o 41.62125 9.904543 52.95398  185.1 -15.50658      19.80909 0.72 
1 1 1 46  6  13 o 39.69689 10.57988 56.57457  157.7 12.68608       21.15977 0.75 
1 1 1 46  6  14 o 26.78954 8.668401 34.50042  198.8 20.15180       17.33680 0.45 
1 1 1 46  6  15 o 38.77984 10.34813 29.27444  172.6 -4.702007      20.69625 0.53 
1 1 1 46  6  16 f 36.98240 10.69336 7.259943  193.0 ?              ?        0.00 
1 1 1 46  8  0  o 116.7496 6.018080 180.4618  7.6   -39.48720      12.03616 0.96 
1 1 1 46  8  1  o 209.4750 4.062702 248.5615  98.8  -17.64847      8.125403 0.98 
1 1 1 46  8  2  o 155.2958 5.002796 180.9219  116.8 -4.824753      10.00559 0.97 
1 1 1 46  8  3  o 49.20621 10.23734 50.06879  192.7 -14.31039      20.47468 0.55 
1 1 1 46  8  4  o 84.23492 7.820519 107.9202  337.1 -46.53754      15.64104 0.90 
1 1 1 46  8  5  o 125.3413 5.039894 124.7633  26.8  -16.59900      10.07979 0.95 
1 1 1 46  8  6  o 168.2303 4.369783 203.7885  52.4  -22.17220      8.739566 0.98 
1 1 1 46  8  7  o 108.3446 5.250213 129.1424  45.9  8.823647       10.50043 0.95 
1 1 1 46  8  8  o 50.82102 9.395001 93.42411  127.5 38.78302       18.79000 0.87 
1 1 1 46  8  9  o 143.2573 4.499600 173.6178  137.0 17.45546       8.999201 0.98 
1 1 1 46  8  10 o 51.41149 10.27091 45.30111  258.6 28.40970       20.54182 0.77 
1 1 1 46  8  11 o 91.23027 6.760479 100.0669  303.0 -4.879387      13.52096 0.95 
1 1 1 46  8  12 o 90.41408 6.689988 112.7104  270.6 4.607964       13.37998 0.96 
1 1 1 46  8  13 o 38.47307 10.80777 57.69605  194.6 9.794926       21.61554 0.77 
1 1 1 46  8  14 o 47.80136 10.38801 79.39368  77.3  ?              ?        0.89 
1 1 1 46  10 0  o 60.50571 10.02921 95.70683  71.4  6.127651       20.05843 0.86 
1 1 1 46  10 1  o 49.96880 10.90897 78.24702  7.4   20.94321       21.81795 0.79 
1 1 1 46  10 2  o 136.7350 7.523113 164.6683  286.9 17.77776       15.04623 0.97 
1 1 1 46  10 3  o 128.6759 6.062755 156.9695  110.5 -7.069427      12.12551 0.97 
1 1 1 46  10 4  o 163.5373 4.802707 244.7021  147.7 4.097717       9.605414 0.99 
1 1 1 46  10 5  f 45.75200 8.558309 51.23189  158.6 44.04790       17.11662 0.00 
1 1 1 46  10 6  o 66.02527 9.076152 97.50958  359.2 39.36439       18.15230 0.93 
1 1 1 46  10 7  f 82.27751 7.584499 148.8494  247.7 15.04581       15.16900 0.00 
1 1 1 46  10 8  o 57.94860 11.21802 94.93259  281.6 4.272362       22.43605 0.91 
1 1 1 46  10 9  o 44.97087 11.32147 88.43896  110.0 -4.364323      22.64294 0.88 
1 1 1 46  10 10 o 28.10941 9.064660 12.22979  204.8 5.545515       18.12932 0.22 
1 1 1 46  10 11 o 35.24165 10.15609 71.20804  217.4 ?              ?        0.84 
1 1 1 46  12 0  o 124.5732 5.946170 156.6786  228.7 20.69748       11.89234 0.98 
1 1 1 46  12 1  o 85.75689 7.570745 111.7147  302.3 -14.95930      15.14149 0.96 
1 1 1 46  12 2  o 114.8623 6.738400 149.3317  293.2 11.11654       13.47680 0.98 
1 1 1 46  12 3  o 57.76836 10.04192 66.88750  79.4  -35.28088      20.08385 0.89 
1 1 1 46  12 4  o 53.57472 11.52265 82.94762  73.1  30.70316       23.04530 0.90 
1 1 1 46  12 5  o 31.90595 10.12572 33.80188  242.6 12.69553       20.25143 0.58 
1 1 1 46  12 6  o 41.04524 10.76249 68.33234  267.4 ?              ?        0.86 
1 1 1 46  12 7  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 47  1  0  o 129.0726 3.693363 182.0886  155.3 5.839401       7.386727 0.94 
1 1 1 47  1  1  o 148.3834 3.584817 307.3006  251.2 25.73477       7.169635 0.97 
1 1 1 47  1  2  o 76.34500 5.828948 97.57961  82.0  33.68058       11.65790 0.83 
1 1 1 47  1  3  o 175.5292 3.342636 219.8584  112.2 29.72377       6.685273 0.97 
1 1 1 47  1  4  o 164.2309 3.156055 225.3624  118.5 -29.77777      6.312110 0.97 
1 1 1 47  1  5  o 209.6874 3.206505 237.6741  140.9 -20.40276      6.413011 0.98 
1 1 1 47  1  6  o 169.2110 3.385212 232.5751  44.5  -22.55397      6.770425 0.98 
1 1 1 47  1  7  o 43.32249 9.334932 36.95520  134.5 14.80851       18.66986 0.49 
1 1 1 47  1  8  o 91.74074 4.935453 77.01608  79.6  -12.45108      9.870907 0.87 
1 1 1 47  1  9  o 95.77171 4.370932 169.5574  332.4 -2.281761      8.741864 0.94 
1 1 1 47  1  10 o 88.10025 6.162325 68.77129  311.0 30.30393       12.32465 0.82 
1 1 1 47  1  11 o 133.3698 4.304590 114.8454  292.5 41.75776       8.609180 0.94 
1 1 1 47  1  12 o 76.94537 6.834307 67.67628  188.5 -1.799904      13.66861 0.83 
1 1 1 47  1  13 o 123.6953 5.607425 119.6445  56.5  -14.99012      11.21485 0.96 
1 1 1 47  1  14 o 105.7809 5.844668 133.7023  272.3 -9.585533      11.68934 0.96 
1 1 1 47  1  15 o 78.40760 8.069397 79.38860  312.4 37.71571       16.13879 0.92 
1 1 1 47  1  16 o 69.41383 8.274625 63.13717  153.6 -48.80779      16.54925 0.88 
1 1 1 47  1  17 o 82.60838 9.902908 76.06098  355.1 -25.52654      19.80582 0.92 
1 1 1 47  1  18 o 120.5392 5.977005 170.7771  12.0  ?              ?        0.98 
1 1 1 47  3  0  o 269.6960 3.381828 334.5742  129.7 -2.619507      6.763656 0.99 
1 1 1 47  3  1  o 42.38145 9.539676 135.7629  329.9 0.2045746      19.07935 0.77 
1 1 1 47  3  2  o 60.15266 6.124086 122.9828  350.4 -25.90092      12.24817 0.84 
1 1 1 47  3  3  o 100.1772 4.505740 66.43787  86.9  -7.311096      9.011479 0.83 
1 1 1 47  3  4  o 41.60207 8.885700 41.88245  70.3  12.28376       17.77140 0.41 
1 1 1 47  3  5  o 40.96367 8.282844 31.43927  352.6 -18.57187      16.56569 0.36 
1 1 1 47  3  6  o 39.56513 8.153765 23.76954  309.1 22.93655       16.30753 0.32 
1 1 1 47  3  7  o 143.7127 3.642648 134.1728  140.3 23.25972       7.285295 0.96 
1 1 1 47  3  8  o 76.13255 6.595965 113.8066  202.7 9.504829       13.19193 0.88 
1 1 1 47  3  9  o 180.6552 3.741261 232.4366  273.8 -6.781723      7.482522 0.98 
1 1 1 47  3  10 o 117.5043 4.487062 217.8010  247.8 -2.852081      8.974125 0.96 
1 1 1 47  3  11 o 81.86374 7.015500 89.08218  5.6   6.224159       14.03100 0.88 
1 1 1 47  3  12 o 89.23128 6.449890 95.47771  34.2  -5.223900      12.89978 0.92 
1 1 1 47  3  13 o 69.74278 7.534979 28.70664  28.3  -11.61275      15.06996 0.65 
1 1 1 47  3  14 o 158.1298 4.904316 142.9759  263.5 -22.13879      9.808633 0.98 
1 1 1 47  3  15 f 108.9056 6.863652 131.0150  351.2 -12.84283      13.72730 0.00 
1 1 1 47  3  16 o 37.32593 10.30971 65.78704  252.6 11.64340       20.61943 0.77 
1 1 1 47  3  17 o 31.56341 9.931620 90.56358  104.6 ?              ?        0.83 
1 1 1 47  5  0  o 137.6176 3.974265 167.4278  223.7 -8.220032      7.948531 0.96 
1 1 1 47  5  1  o 172.6965 3.316441 215.2974  318.9 -2.801453      6.632882 0.98 
1 1 1 47  5  2  o 99.54478 4.814916 192.1464  76.4  -14.12720      9.629832 0.96 
1 1 1 47  5  3  o 140.1968 3.572984 194.7171  240.8 19.61572       7.145968 0.97 
1 1 1 47  5  4  o 215.6558 3.168097 262.9598  266.7 -2.232544      6.336195 0.99 
1 1 1 47  5  5  o 165.2001 3.991527 224.0137  319.6 19.40700       7.983055 0.98 
1 1 1 47  5  6  o 92.26723 8.798683 85.88293  159.3 -19.33600      17.59737 0.87 
1 1 1 47  5  7  o 143.9256 4.091357 165.5794  166.7 2.399719       8.182714 0.96 
1 1 1 47  5  8  o 134.4504 4.493051 135.1216  195.2 -2.546371      8.986101 0.95 
1 1 1 47  5  9  o 209.4011 3.765908 284.5413  183.0 -11.62486      7.531816 0.99 
1 1 1 47  5  10 o 94.04392 6.282451 98.04897  176.0 -10.07762      12.56490 0.92 
1 1 1 47  5  11 o 44.53344 10.00255 84.99719  116.9 11.15308       20.00510 0.81 
1 1 1 47  5  12 o 36.70213 10.12860 59.98177  340.0 11.64523       20.25719 0.70 
1 1 1 47  5  13 o 95.97788 6.234517 100.2503  49.9  -2.164291      12.46903 0.95 
1 1 1 47  5  14 o 97.05021 6.528426 88.83636  38.0  -4.687210      13.05685 0.95 
1 1 1 47  5  15 o 71.47768 9.541592 39.43767  128.3 -33.47011      19.08318 0.82 
1 1 1 47  5  16 o 42.26810 11.63021 42.91180  245.3 ?              ?        0.71 
1 1 1 47  7  0  o 74.92761 5.543797 102.5572  68.1  -0.5380402     11.08759 0.91 
1 1 1 47  7  1  o 60.26218 8.133986 56.08652  62.9  -11.25503      16.26797 0.74 
1 1 1 47  7  2  o 170.9903 4.572907 257.7717  90.3  -18.59142      9.145814 0.98 
1 1 1 47  7  3  o 285.8549 3.716161 355.0099  68.5  -21.27661      7.432322 0.99 
1 1 1 47  7  4  o 165.0495 4.365155 222.1877  13.3  -2.680222      8.730310 0.98 
1 1 1 47  7  5  o 75.85047 7.596544 78.91660  275.3 -16.44576      15.19309 0.84 
1 1 1 47  7  6  o 40.14793 9.433874 26.15787  213.6 -16.83660      18.86775 0.29 
1 1 1 47  7  7  o 115.9571 4.878186 151.6583  351.3 12.33386       9.756371 0.96 
1 1 1 47  7  8  o 118.1044 5.458436 125.8292  338.1 4.737144       10.91687 0.96 
1 1 1 47  7  9  o 49.09536 10.11354 91.01750  137.8 29.68275       20.22707 0.86 
1 1 1 47  7  10 o 54.41206 10.09549 58.45546  240.3 -1.836517      20.19098 0.82 
1 1 1 47  7  11 o 113.4327 5.740942 121.3257  294.2 -11.09113      11.48188 0.97 
1 1 1 47  7  12 o 40.23049 10.35021 49.95220  53.3  12.84973       20.70043 0.72 
1 1 1 47  7  13 o 30.76646 9.425789 24.43338  102.0 -1.830799      18.85158 0.39 
1 1 1 47  7  14 o 30.88356 9.352444 31.64128  262.9 ?              ?        0.52 
1 1 1 47  7  15 x ?        ?        65.22205  291.7 ?              ?        0.00 
1 1 1 47  9  0  o 73.31316 9.487372 120.1348  335.5 -40.06898      18.97474 0.90 
1 1 1 47  9  1  o 54.50600 11.24891 16.97396  184.8 -1.647072      22.49782 0.27 
1 1 1 47  9  2  o 175.6796 4.642150 218.9938  312.5 19.95064       9.284301 0.98 
1 1 1 47  9  3  f 214.2552 4.870073 264.8557  1.6   -6.431229      9.740147 0.00 
1 1 1 47  9  4  o 222.4427 4.173457 269.6736  52.3  18.42961       8.346914 0.99 
1 1 1 47  9  5  o 85.57205 6.894693 98.30829  45.0  21.51130       13.78939 0.93 
1 1 1 47  9  6  o 129.8793 5.274203 177.8311  321.4 3.407364       10.54841 0.98 
1 1 1 47  9  7  o 56.60560 10.05499 76.83573  318.6 -29.24066      20.10998 0.89 
1 1 1 47  9  8  o 49.94920 10.44075 59.63374  296.7 -2.456692      20.88151 0.83 
1 1 1 47  9  9  o 49.28622 9.874771 56.59993  11.3  -12.10673      19.74954 0.82 
1 1 1 47  9  10 o 39.68930 10.98688 48.16997  170.7 20.52456       21.97375 0.72 
1 1 1 47  9  11 o 46.54562 11.03044 90.23984  167.3 24.52726       22.06088 0.89 
1 1 1 47  9  12 o 55.08749 10.46759 91.34096  319.0 ?              ?        0.92 
1 1 1 47  11 0  o 75.59761 9.828930 77.67857  183.3 2.267319       19.65786 0.92 
1 1 1 47  11 1  o 87.80908 8.215128 103.7248  276.7 16.03165       16.43026 0.95 
1 1 1 47  11 2  o 66.54526 12.03779 71.60967  272.7 -17.68414      24.07557 0.90 
1 1 1 47  11 3  o 106.4391 6.291403 173.9418  112.0 -34.62398      12.58281 0.98 
1 1 1 47  11 4  o 72.20792 8.817265 82.76688  132.7 7.821320       17.63453 0.93 
1 1 1 47  11 5  f 90.27216 7.119818 96.86262  16.7  -9.876068      14.23964 0.00 
1 1 1 47  11 6  f 50.64996 9.850572 64.09182  300.1 -22.57795      19.70114 0.00 
1 1 1 47  11 7  o 60.68783 10.84767 93.40780  278.6 18.49817       21.69534 0.93 
1 1 1 47  11 8  o 46.25903 11.18888 38.56486  306.0 ?              ?        0.75 
1 1 1 47  13 0  o 51.34669 11.06672 69.22151  177.3 ?              ?        0.89 
1 1 1 47  13 1  o 66.96674 9.618912 138.1633  210.0 ?              ?        0.96 
1 1 1 47  13 2  o 39.59423 11.08556 99.82099  258.8 ?              ?        0.91 
1 1 1 48  0  0  o 152.2136 5.214014 282.5018  180.0 0.000000       0.000000 1.00 
1 1 1 48  0  1  f 38.97525 15.87302 111.0902  180.0 0.000000       0.000000 0.00 
1 1 1 48  0  2  o 311.2325 4.832304 340.7945  0.0   0.000000       0.000000 1.00 
1 1 1 48  0  3  o 61.88975 11.45876 161.1028  180.0 0.000000       0.000000 0.98 
1 1 1 48  0  4  f 273.6062 4.456259 278.5979  180.0 0.000000       0.000000 0.00 
1 1 1 48  0  5  o 37.16752 15.30313 9.519473  180.0 0.000000       0.000000 0.10 
1 1 1 48  0  6  o 25.81761 14.30296 14.29555  180.0 0.000000       0.000000 0.12 
1 1 1 48  0  7  o 68.00117 10.10736 7.841959  0.0   0.000000       0.000000 0.16 
1 1 1 48  0  8  f 362.0278 5.186307 432.9149  0.0   0.000000       0.000000 0.00 
1 1 1 48  0  9  o 16.30362 11.32361 9.428645  180.0 0.000000       0.000000 0.04 
1 1 1 48  0  10 o 48.59840 13.75095 32.55976  180.0 0.000000       0.000000 0.39 
1 1 1 48  0  11 o 24.82152 15.79797 49.81997  180.0 0.000000       0.000000 0.34 
1 1 1 48  0  12 o 28.87906 16.89606 46.80584  0.0   0.000000       0.000000 0.42 
1 1 1 48  0  13 o 72.31271 11.54052 59.30481  0.0   0.000000       0.000000 0.95 
1 1 1 48  0  14 o 140.5309 7.127582 115.3502  0.0   0.000000       0.000000 1.00 
1 1 1 48  0  15 o 82.62249 9.584886 47.79111  0.0   0.000000       0.000000 0.97 
1 1 1 48  0  16 o 63.16200 16.32459 34.84322  180.0 0.000000       0.000000 0.79 
1 1 1 48  0  17 o 42.10960 18.50777 67.58422  180.0 ?              ?        0.90 
1 1 1 48  2  0  o 242.5727 3.217316 314.1171  321.0 4.268707       6.434633 0.99 
1 1 1 48  2  1  o 77.43243 5.428349 103.7067  227.4 14.73595       10.85670 0.85 
1 1 1 48  2  2  o 129.6471 3.663345 164.2133  109.5 9.909241       7.326691 0.95 
1 1 1 48  2  3  o 102.3425 4.359737 137.5358  65.1  -25.31483      8.719475 0.93 
1 1 1 48  2  4  f 68.78365 6.327892 85.54515  113.4 13.39716       12.65578 0.00 
1 1 1 48  2  5  o 31.40165 8.483300 48.70436  192.4 10.46414       16.96660 0.44 
1 1 1 48  2  6  o 217.9094 3.264461 249.3665  4.1   7.261780       6.528922 0.99 
1 1 1 48  2  7  o 87.42982 4.719335 148.8115  116.5 12.61342       9.438670 0.93 
1 1 1 48  2  8  o 135.3705 3.467243 139.3424  49.3  15.62108       6.934486 0.95 
1 1 1 48  2  9  o 47.19226 8.336697 20.83925  353.6 -32.43570      16.67339 0.24 
1 1 1 48  2  10 o 34.56339 9.626660 36.10473  101.5 1.145691       19.25332 0.32 
1 1 1 48  2  11 o 36.72424 9.727945 41.11745  279.6 5.231049       19.45589 0.42 
1 1 1 48  2  12 o 44.48022 9.666213 36.83909  15.2  5.597355       19.33243 0.52 
1 1 1 48  2  13 o 136.5834 5.137007 147.2177  168.0 26.43906       10.27401 0.97 
1 1 1 48  2  14 o 59.69958 11.79048 92.44083  49.9  -11.35507      23.58096 0.90 
1 1 1 48  2  15 o 44.25491 10.69573 18.33614  46.9  3.754475       21.39145 0.37 
1 1 1 48  2  16 o 27.35726 8.969768 28.26447  282.9 -2.667328      17.93954 0.39 
1 1 1 48  2  17 o 34.52272 10.54850 46.03600  68.0  ?              ?        0.67 
1 1 1 48  4  0  o 201.9419 3.211546 308.6808  241.9 -19.69052      6.423092 0.98 
1 1 1 48  4  1  o 176.9592 3.448090 178.8515  315.8 10.30367       6.896181 0.97 
1 1 1 48  4  2  o 97.62576 5.372337 125.2607  7.4   44.22459       10.74467 0.93 
1 1 1 48  4  3  o 111.4941 4.061471 124.2412  169.0 3.086578       8.122942 0.94 
1 1 1 48  4  4  o 29.07562 8.704028 25.83712  85.7  -6.982832      17.40806 0.26 
1 1 1 48  4  5  o 180.6835 3.296135 247.8445  357.5 24.58316       6.592269 0.98 
1 1 1 48  4  6  o 122.8388 3.985819 223.9366  314.3 21.34779       7.971639 0.97 
1 1 1 48  4  7  o 169.2095 3.855875 208.4169  221.2 -5.721985      7.711749 0.97 
1 1 1 48  4  8  o 69.11155 7.859873 90.65583  173.3 8.705551       15.71975 0.83 
1 1 1 48  4  9  o 59.81933 9.704116 77.36334  100.9 6.642220       19.40823 0.77 
1 1 1 48  4  10 o 127.4882 5.288260 173.7834  235.6 -34.45940      10.57652 0.97 
1 1 1 48  4  11 o 68.63029 8.267568 118.3702  223.8 -21.72208      16.53514 0.92 
1 1 1 48  4  12 o 33.21436 10.00369 60.25941  236.7 3.942829       20.00738 0.66 
1 1 1 48  4  13 f 48.99921 9.755286 51.23534  280.5 -10.89022      19.51057 0.00 
1 1 1 48  4  14 o 55.84013 10.20843 88.04688  325.4 8.853352       20.41685 0.89 
1 1 1 48  4  15 o 40.98735 10.89248 36.20742  43.3  6.934361       21.78496 0.61 
1 1 1 48  4  16 o 35.26143 10.61985 42.81543  97.1  ?              ?        0.65 
1 1 1 48  6  0  o 45.28586 10.33821 133.1397  337.9 12.28288       20.67641 0.87 
1 1 1 48  6  1  o 124.6051 4.339394 150.4387  75.1  -9.108551      8.678788 0.97 
1 1 1 48  6  2  o 208.4820 3.269719 286.5161  85.8  -22.24188      6.539439 0.99 
1 1 1 48  6  3  o 74.22372 6.787567 124.9079  36.3  -26.03540      13.57513 0.90 
1 1 1 48  6  4  o 69.19730 6.968384 77.15893  258.3 0.3732834      13.93677 0.80 
1 1 1 48  6  5  o 55.72893 10.16893 95.30444  301.1 -19.31639      20.33785 0.79 
1 1 1 48  6  6  o 36.40226 10.03903 50.59380  101.3 16.88237       20.07805 0.45 
1 1 1 48  6  7  o 56.44241 11.20677 109.1479  167.4 13.02865       22.41354 0.84 
1 1 1 48  6  8  o 102.1533 6.248006 130.8137  180.4 -11.83216      12.49601 0.95 
1 1 1 48  6  9  o 41.97710 10.62023 64.95009  173.7 6.539539       21.24047 0.72 
1 1 1 48  6  10 o 44.39884 10.49773 20.91465  228.0 12.43195       20.99545 0.38 
1 1 1 48  6  11 o 84.09779 6.602076 98.29956  139.4 3.778008       13.20415 0.95 
1 1 1 48  6  12 o 64.82054 9.672619 57.38714  5.8   -27.03931      19.34524 0.86 
1 1 1 48  6  13 o 29.86757 9.514017 62.11560  225.8 5.002039       19.02803 0.70 
1 1 1 48  6  14 f 39.41798 10.46554 61.67330  155.3 -3.502640      20.93109 0.00 
1 1 1 48  6  15 o 39.26470 10.61576 66.09774  48.2  ?              ?        0.83 
1 1 1 48  8  0  o 39.72633 10.92752 59.26289  19.0  8.035938       21.85504 0.53 
1 1 1 48  8  1  o 172.3111 5.235826 307.6612  357.4 -14.50885      10.47165 0.98 
1 1 1 48  8  2  f 97.86394 7.097529 166.6975  17.3  18.61089       14.19506 0.00 
1 1 1 48  8  3  o 45.22095 10.75502 36.11008  136.0 2.989838       21.51005 0.44 
1 1 1 48  8  4  o 79.34611 7.655671 118.6725  348.3 1.305695       15.31134 0.92 
1 1 1 48  8  5  o 139.5438 4.708594 120.5150  313.2 8.822510       9.417189 0.96 
1 1 1 48  8  6  o 81.72428 7.159099 108.4889  332.7 16.74393       14.31820 0.93 
1 1 1 48  8  7  o 87.02736 6.826585 107.8425  91.8  19.41282       13.65317 0.95 
1 1 1 48  8  8  o 34.19018 10.30315 25.20106  200.4 10.09069       20.60629 0.41 
1 1 1 48  8  9  o 63.48929 10.60179 74.74788  271.5 19.16755       21.20358 0.90 
1 1 1 48  8  10 o 122.1794 5.661512 127.9901  74.5  8.433006       11.32302 0.97 
1 1 1 48  8  11 o 27.99609 9.154778 38.41668  45.2  13.40776       18.30956 0.53 
1 1 1 48  8  12 o 117.3319 6.195204 174.3742  241.6 ?              ?        0.98 
1 1 1 48  8  13 x ?        ?        55.01388  298.0 ?              ?        0.00 
1 1 1 48  10 0  o 81.48926 7.034217 95.60048  323.1 -18.30741      14.06843 0.93 
1 1 1 48  10 1  o 69.98666 10.02165 80.56853  263.2 11.03599       20.04331 0.90 
1 1 1 48  10 2  o 146.6765 8.274066 210.0669  313.3 -31.33044      16.54813 0.98 
1 1 1 48  10 3  o 110.3034 7.206285 177.9232  322.6 -20.88155      14.41257 0.98 
1 1 1 48  10 4  o 115.1324 6.261314 154.3699  195.5 -20.47343      12.52263 0.98 
1 1 1 48  10 5  o 51.50165 11.04447 75.47030  9.1   18.54531       22.08894 0.88 
1 1 1 48  10 6  o 121.3427 5.871634 155.2787  318.2 -12.14953      11.74327 0.98 
1 1 1 48  10 7  o 55.27228 10.75087 72.65807  317.2 -17.18830      21.50174 0.88 
1 1 1 48  10 8  o 47.53059 11.23094 50.59671  146.8 -8.806244      22.46188 0.80 
1 1 1 48  10 9  o 35.52536 10.36791 37.80943  155.3 ?              ?        0.65 
1 1 1 48  10 10 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 48  12 0  o 63.07298 10.96765 102.5315  206.9 15.26924       21.93530 0.93 
1 1 1 48  12 1  o 87.61593 7.704317 149.5560  159.9 30.64322       15.40863 0.97 
1 1 1 48  12 2  o 35.67720 10.20016 32.40372  104.5 -14.59355      20.40032 0.59 
1 1 1 48  12 3  f 36.93592 10.66395 70.58625  341.8 0.9317741      21.32789 0.00 
1 1 1 48  12 4  o 51.89791 11.74012 66.74541  93.2  ?              ?        0.88 
1 1 1 48  12 5  x ?        ?        121.0883  64.6  ?              ?        0.00 
1 1 1 49  1  0  o 184.6802 3.409818 250.7235  276.9 30.96045       6.819636 0.98 
1 1 1 49  1  1  o 109.5689 4.359927 183.1205  158.9 -15.39546      8.719853 0.95 
1 1 1 49  1  2  o 109.8162 4.610065 139.7300  342.3 9.238777       9.220131 0.93 
1 1 1 49  1  3  o 208.2795 3.534286 199.1004  302.5 4.246155       7.068573 0.98 
1 1 1 49  1  4  o 61.27829 7.609746 50.95068  185.8 53.20886       15.21949 0.68 
1 1 1 49  1  5  o 42.71194 8.484967 51.69824  110.0 -5.034546      16.96993 0.61 
1 1 1 49  1  6  o 209.9540 3.414987 281.8878  266.6 0.7417450      6.829974 0.99 
1 1 1 49  1  7  o 129.0798 3.948038 161.0466  202.0 1.954269       7.896076 0.95 
1 1 1 49  1  8  o 183.9219 3.609191 170.8725  7.0   -0.6814880     7.218383 0.97 
1 1 1 49  1  9  o 99.67172 4.811450 103.9139  125.4 32.12872       9.622901 0.91 
1 1 1 49  1  10 o 158.3979 4.153608 198.3311  96.4  27.63010       8.307217 0.97 
1 1 1 49  1  11 o 39.91185 9.713954 36.55302  201.6 -3.182083      19.42791 0.44 
1 1 1 49  1  12 o 32.07938 10.18620 18.65974  245.4 0.5892906      20.37240 0.23 
1 1 1 49  1  13 o 120.5816 6.000742 200.0552  166.3 5.520767       12.00148 0.98 
1 1 1 49  1  14 o 53.24627 11.06535 51.54706  359.0 15.59195       22.13071 0.79 
1 1 1 49  1  15 o 84.40575 7.144575 84.08220  229.7 8.362473       14.28915 0.93 
1 1 1 49  1  16 o 29.93093 9.710916 26.86409  254.2 4.196701       19.42183 0.41 
1 1 1 49  1  17 x ?        ?        83.80595  135.3 ?              ?        0.00 
1 1 1 49  3  0  o 78.20338 7.174729 136.4658  356.8 -40.08083      14.34946 0.90 
1 1 1 49  3  1  o 179.9007 3.306603 216.5502  227.2 18.63181       6.613205 0.98 
1 1 1 49  3  2  o 64.15442 7.383677 50.26457  327.8 15.13572       14.76735 0.66 
1 1 1 49  3  3  o 145.5211 3.567947 182.1246  102.7 21.82283       7.135894 0.97 
1 1 1 49  3  4  o 59.64456 7.820019 105.7781  79.5  17.19169       15.64004 0.88 
1 1 1 49  3  5  o 64.34975 7.781554 170.0459  312.5 -47.92243      15.56311 0.92 
1 1 1 49  3  6  o 119.6434 4.022553 189.4831  291.1 -4.843040      8.045106 0.96 
1 1 1 49  3  7  o 114.3777 4.394356 133.9927  204.6 34.21571       8.788712 0.93 
1 1 1 49  3  8  o 191.0518 3.854310 250.7935  39.4  8.076660       7.708620 0.98 
1 1 1 49  3  9  o 129.5874 4.827936 176.2316  48.0  0.3573151      9.655871 0.96 
1 1 1 49  3  10 o 115.1503 4.715812 129.3331  185.4 14.59927       9.431623 0.95 
1 1 1 49  3  11 o 113.2907 6.860644 148.2744  215.9 11.00695       13.72129 0.96 
1 1 1 49  3  12 o 42.32552 10.08145 40.23628  69.1  -1.492325      20.16291 0.61 
1 1 1 49  3  13 o 100.9324 6.102176 93.97647  142.9 -4.685837      12.20435 0.95 
1 1 1 49  3  14 o 97.88696 7.584096 100.0190  92.0  -2.902977      15.16819 0.95 
1 1 1 49  3  15 o 67.31940 10.09049 72.03567  246.9 -11.91648      20.18098 0.90 
1 1 1 49  3  16 o 67.32889 10.86892 98.46449  348.1 ?              ?        0.93 
1 1 1 49  5  0  o 136.4017 4.600915 183.9432  214.3 18.37981       9.201830 0.97 
1 1 1 49  5  1  o 72.42946 8.067575 117.4555  338.7 36.72688       16.13515 0.91 
1 1 1 49  5  2  o 180.0231 3.596723 197.4004  21.8  21.39806       7.193447 0.98 
1 1 1 49  5  3  o 114.7871 4.170077 170.8341  120.7 -19.87547      8.340155 0.96 
1 1 1 49  5  4  o 38.16143 8.965095 64.10499  159.7 5.437801       17.93019 0.54 
1 1 1 49  5  5  o 159.1390 4.142708 131.1394  319.9 -0.1711121     8.285416 0.95 
1 1 1 49  5  6  f 116.5359 5.158182 102.7474  303.1 3.000732       10.31636 0.00 
1 1 1 49  5  7  o 41.88615 10.36112 88.56256  248.2 14.50207       20.72223 0.71 
1 1 1 49  5  8  o 63.28230 9.308618 69.46426  104.0 -1.360996      18.61724 0.79 
1 1 1 49  5  9  o 71.07946 8.464126 66.23129  52.0  14.85211       16.92825 0.84 
1 1 1 49  5  10 o 62.91885 8.650051 74.12889  118.3 -21.05536      17.30010 0.87 
1 1 1 49  5  11 f 110.4191 5.480429 143.4231  165.3 18.11462       10.96086 0.00 
1 1 1 49  5  12 o 79.87505 7.118785 138.9881  271.5 -6.537422      14.23757 0.96 
1 1 1 49  5  13 o 36.29224 9.843729 72.37560  264.3 -7.989040      19.68746 0.79 
1 1 1 49  5  14 f 33.02407 9.965375 50.93023  2.1   2.460941       19.93075 0.00 
1 1 1 49  5  15 o 50.65976 10.50239 22.82943  339.0 ?              ?        0.57 
1 1 1 49  7  0  o 49.86058 9.140230 49.18220  338.7 13.55986       18.28046 0.56 
1 1 1 49  7  1  o 101.0070 5.162572 157.6837  303.9 -36.48975      10.32514 0.94 
1 1 1 49  7  2  o 82.01981 7.847890 113.0270  217.9 -21.63518      15.69578 0.90 
1 1 1 49  7  3  o 77.13599 7.069893 75.83508  99.6  -2.710503      14.13979 0.84 
1 1 1 49  7  4  o 48.16676 10.57521 35.93945  160.1 0.3419762      21.15043 0.45 
1 1 1 49  7  5  o 118.6284 4.998465 146.5448  312.6 0.6529083      9.996929 0.96 
1 1 1 49  7  6  o 65.13707 9.323809 87.80415  79.0  -19.07925      18.64762 0.87 
1 1 1 49  7  7  o 45.99237 9.806349 58.48759  120.4 26.76012       19.61270 0.74 
1 1 1 49  7  8  o 51.03591 10.84559 97.20851  245.7 23.78031       21.69117 0.88 
1 1 1 49  7  9  o 57.30847 9.726999 72.59884  125.6 11.84122       19.45400 0.88 
1 1 1 49  7  10 o 111.0619 6.025230 103.9550  83.3  7.496117       12.05046 0.96 
1 1 1 49  7  11 f 100.3204 6.374587 117.4055  198.2 13.38807       12.74917 0.00 
1 1 1 49  7  12 o 39.82714 10.69949 56.03123  153.5 7.563187       21.39898 0.77 
1 1 1 49  7  13 o 76.23947 9.231075 104.2686  43.7  ?              ?        0.95 
1 1 1 49  9  0  o 28.95693 9.369047 31.15616  125.6 -1.633015      18.73809 0.30 
1 1 1 49  9  1  o 46.62727 11.30586 30.58994  55.2  22.63290       22.61173 0.46 
1 1 1 49  9  2  o 77.86404 8.288497 90.97298  159.8 -7.261734      16.57699 0.91 
1 1 1 49  9  3  o 128.4247 5.828365 226.5187  213.1 5.572990       11.65673 0.98 
1 1 1 49  9  4  o 94.51988 6.781639 159.0513  152.5 21.00510       13.56328 0.97 
1 1 1 49  9  5  o 43.32760 10.86810 48.37491  40.5  3.135799       21.73620 0.73 
1 1 1 49  9  6  o 105.8921 6.295212 137.9155  253.1 20.82772       12.59042 0.97 
1 1 1 49  9  7  o 71.76416 8.655688 102.1944  132.7 26.02906       17.31138 0.94 
1 1 1 49  9  8  o 110.9306 5.669992 158.6166  56.2  11.02548       11.33998 0.98 
1 1 1 49  9  9  o 57.52431 10.87203 70.83304  331.9 27.29713       21.74406 0.89 
1 1 1 49  9  10 o 81.16725 8.806909 117.0072  235.3 ?              ?        0.96 
1 1 1 49  9  11 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 49  11 0  o 32.11948 10.17275 26.88686  166.1 8.955006       20.34549 0.46 
1 1 1 49  11 1  o 58.65492 12.29874 37.40828  223.7 10.30313       24.59748 0.75 
1 1 1 49  11 2  o 63.84003 11.79424 134.8659  291.1 9.413235       23.58849 0.95 
1 1 1 49  11 3  o 96.24849 7.236413 125.3289  297.0 27.28254       14.47283 0.97 
1 1 1 49  11 4  o 65.51682 10.86313 84.66068  187.5 7.950455       21.72625 0.92 
1 1 1 49  11 5  o 50.23516 11.66117 68.72837  166.1 21.76588       23.32235 0.87 
1 1 1 49  11 6  o 36.96520 10.92901 79.37436  180.7 ?              ?        0.86 
1 1 1 49  11 7  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 50  0  0  o 173.0001 5.254792 218.7230  180.0 0.000000       0.000000 1.00 
1 1 1 50  0  1  o 21.04464 13.57181 36.46180  0.0   0.000000       0.000000 0.18 
1 1 1 50  0  2  o 182.7447 4.874812 251.1522  0.0   0.000000       0.000000 1.00 
1 1 1 50  0  3  o 243.9904 5.035433 207.6443  0.0   0.000000       0.000000 1.00 
1 1 1 50  0  4  o 272.8788 4.794743 285.7740  0.0   0.000000       0.000000 1.00 
1 1 1 50  0  5  o 49.09814 13.03123 34.62866  0.0   0.000000       0.000000 0.48 
1 1 1 50  0  6  o 249.7458 5.133238 328.9560  180.0 0.000000       0.000000 1.00 
1 1 1 50  0  7  o 140.7708 5.770721 162.3574  180.0 0.000000       0.000000 1.00 
1 1 1 50  0  8  o 17.70954 12.20408 55.24545  180.0 0.000000       0.000000 0.25 
1 1 1 50  0  9  o 86.47697 7.620766 36.42805  0.0   0.000000       0.000000 0.72 
1 1 1 50  0  10 o 17.21863 12.02558 31.33213  180.0 0.000000       0.000000 0.17 
1 1 1 50  0  11 o 68.55476 17.27454 82.81138  180.0 0.000000       0.000000 0.97 
1 1 1 50  0  12 o 21.34634 14.16433 22.70716  180.0 0.000000       0.000000 0.21 
1 1 1 50  0  13 o 161.5806 6.351652 161.3537  180.0 0.000000       0.000000 1.00 
1 1 1 50  0  14 o 75.49422 10.29940 97.11889  180.0 0.000000       0.000000 1.00 
1 1 1 50  0  15 o 30.88180 18.02294 62.70194  180.0 0.000000       0.000000 0.74 
1 1 1 50  0  16 o 117.4906 9.195136 140.1214  0.0   ?              ?        1.00 
1 1 1 50  2  0  o 125.5386 4.711836 189.2961  321.3 -9.782845      9.423673 0.96 
1 1 1 50  2  1  o 140.3173 3.697874 189.2065  196.2 1.492935       7.395749 0.96 
1 1 1 50  2  2  f 38.40316 8.435423 57.03225  265.1 19.92260       16.87085 0.00 
1 1 1 50  2  3  o 89.81570 5.715787 85.12979  54.5  18.00629       11.43157 0.90 
1 1 1 50  2  4  o 52.44422 7.203075 55.34510  337.4 -55.13290      14.40615 0.70 
1 1 1 50  2  5  o 74.32693 5.922893 91.60648  50.8  -23.79593      11.84579 0.86 
1 1 1 50  2  6  o 37.80221 8.143166 24.13924  304.1 -29.61090      16.28633 0.22 
1 1 1 50  2  7  o 222.9975 3.614128 228.4348  221.6 -30.92729      7.228256 0.98 
1 1 1 50  2  8  o 72.72910 5.444139 49.99136  230.9 -14.67545      10.88828 0.70 
1 1 1 50  2  9  o 76.29501 6.574773 93.75933  64.2  -0.9460526     13.14955 0.88 
1 1 1 50  2  10 o 85.89120 6.285771 157.7454  106.3 16.25825       12.57154 0.95 
1 1 1 50  2  11 o 60.58705 8.623981 76.65131  19.1  33.23779       17.24796 0.86 
1 1 1 50  2  12 o 87.87480 6.239491 112.1521  303.4 -10.90591      12.47898 0.95 
1 1 1 50  2  13 o 41.85737 9.736424 59.32143  276.5 32.89390       19.47285 0.77 
1 1 1 50  2  14 o 67.76644 10.32498 82.27374  204.7 2.654053       20.64997 0.90 
1 1 1 50  2  15 f 73.72974 8.995486 77.91367  174.8 39.70958       17.99097 0.00 
1 1 1 50  2  16 o 138.4238 6.090638 130.7468  3.0   ?              ?        0.98 
1 1 1 50  4  0  o 114.4677 4.446008 172.9704  148.5 45.36759       8.892015 0.96 
1 1 1 50  4  1  o 205.9301 3.424009 264.8293  275.2 -10.62511      6.848018 0.99 
1 1 1 50  4  2  o 93.22649 5.192455 90.79352  72.5  5.606087       10.38491 0.92 
1 1 1 50  4  3  o 202.1247 3.376380 175.2941  148.1 -1.902603      6.752761 0.98 
1 1 1 50  4  4  o 117.4876 4.087843 117.0581  182.6 29.42436       8.175686 0.93 
1 1 1 50  4  5  o 96.50334 4.718160 102.9873  235.6 11.53382       9.436319 0.90 
1 1 1 50  4  6  o 81.80208 5.524430 54.41071  290.0 -11.40862      11.04886 0.75 
1 1 1 50  4  7  o 50.58523 10.05507 38.60892  280.1 23.44074       20.11014 0.47 
1 1 1 50  4  8  o 78.43542 8.348062 102.4991  60.5  -27.53856      16.69612 0.90 
1 1 1 50  4  9  o 82.47057 6.807530 130.6812  50.4  -4.064598      13.61506 0.94 
1 1 1 50  4  10 o 111.9864 5.644298 143.5630  52.2  -19.01228      11.28860 0.96 
1 1 1 50  4  11 o 95.55360 6.002404 79.90665  136.0 15.69968       12.00481 0.94 
1 1 1 50  4  12 o 38.80262 11.02315 58.12696  74.6  2.984932       22.04630 0.74 
1 1 1 50  4  13 o 29.69848 9.507048 16.11986  2.1   0.7501411E-01  19.01410 0.24 
1 1 1 50  4  14 o 27.50364 8.729842 12.07880  146.5 -0.4489326     17.45968 0.19 
1 1 1 50  4  15 o 45.56142 10.92323 52.75380  226.8 ?              ?        0.80 
1 1 1 50  6  0  o 174.3427 3.962445 251.8244  242.1 18.78632       7.924889 0.98 
1 1 1 50  6  1  o 335.1703 3.990367 392.4998  292.9 -21.07684      7.980735 0.99 
1 1 1 50  6  2  o 88.80977 5.118533 115.0833  312.5 -24.23512      10.23707 0.90 
1 1 1 50  6  3  o 90.43500 6.094257 113.8528  32.3  37.09251       12.18851 0.91 
1 1 1 50  6  4  o 116.3590 5.165715 149.4231  110.8 -17.49133      10.33143 0.95 
1 1 1 50  6  5  o 74.52257 7.256306 86.62396  226.6 -0.5075760     14.51261 0.86 
1 1 1 50  6  6  o 45.49055 10.42775 83.60909  307.6 -0.5517654     20.85550 0.76 
1 1 1 50  6  7  o 41.76898 10.42698 27.34330  312.2 6.500694       20.85396 0.39 
1 1 1 50  6  8  o 41.17938 10.49570 32.26604  4.3   8.757732       20.99139 0.49 
1 1 1 50  6  9  o 111.3327 5.645077 129.0577  341.5 23.92714       11.29015 0.97 
1 1 1 50  6  10 o 99.09077 5.459020 107.9183  85.9  -5.014732      10.91804 0.96 
1 1 1 50  6  11 o 82.42809 7.126288 98.80813  147.0 10.31592       14.25258 0.94 
1 1 1 50  6  12 f 30.35147 9.434311 37.09400  324.7 0.4777870      18.86862 0.00 
1 1 1 50  6  13 o 36.37135 10.16437 23.08431  263.2 ?              ?        0.45 
1 1 1 50  6  14 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 50  8  0  o 108.0457 8.184723 114.8322  179.4 -7.084732      16.36945 0.93 
1 1 1 50  8  1  o 65.68284 9.700495 10.62195  149.3 -25.01111      19.40099 0.22 
1 1 1 50  8  2  o 35.13363 10.38239 18.33405  222.6 5.540520       20.76479 0.22 
1 1 1 50  8  3  o 57.05731 9.950439 124.8149  130.9 0.9073181      19.90088 0.90 
1 1 1 50  8  4  o 100.6994 6.161262 182.5808  126.5 -5.963173      12.32252 0.97 
1 1 1 50  8  5  o 72.11684 8.858680 70.81015  258.1 41.29453       17.71736 0.89 
1 1 1 50  8  6  o 108.0549 6.415373 131.2964  199.2 8.182404       12.83075 0.97 
1 1 1 50  8  7  o 102.7936 6.425778 128.0978  80.0  19.61541       12.85156 0.97 
1 1 1 50  8  8  o 27.90145 9.160502 36.07100  274.5 -1.780369      18.32100 0.49 
1 1 1 50  8  9  o 91.34309 7.527405 184.3901  204.5 -6.899551      15.05481 0.97 
1 1 1 50  8  10 o 34.61975 9.924775 65.08093  74.7  -4.995499      19.84955 0.78 
1 1 1 50  8  11 o 27.35035 8.982889 35.83353  87.1  ?              ?        0.55 
1 1 1 50  10 0  o 32.16762 10.05047 40.41985  238.0 0.2140808      20.10093 0.56 
1 1 1 50  10 1  o 125.5522 6.250314 130.6249  181.7 13.94400       12.50063 0.98 
1 1 1 50  10 2  o 134.6591 7.395570 180.4623  156.5 12.75630       14.79114 0.98 
1 1 1 50  10 3  o 68.40051 10.58544 73.24165  106.9 4.670601       21.17088 0.91 
1 1 1 50  10 4  o 69.41947 10.45985 110.4538  115.1 -31.32573      20.91970 0.94 
1 1 1 50  10 5  o 128.8029 5.694301 125.6876  164.4 -23.64820      11.38860 0.98 
1 1 1 50  10 6  o 29.02765 9.508236 28.81718  177.7 -1.204990      19.01647 0.46 
1 1 1 50  10 7  o 49.07638 9.733312 73.85535  21.0  ?              ?        0.89 
1 1 1 50  10 8  x ?        ?        130.9179  9.6   ?              ?        0.00 
1 1 1 50  12 0  o 46.27550 10.60479 44.25801  260.6 -27.71521      21.20958 0.78 
1 1 1 50  12 1  o 33.98150 10.45152 45.26708  133.8 ?              ?        0.71 
1 1 1 50  12 2  o 38.77660 11.34434 81.78783  155.0 ?              ?        0.87 
1 1 1 51  1  0  o 140.1841 3.793873 91.61192  200.0 -5.148941      7.587745 0.92 
1 1 1 51  1  1  o 102.8854 4.835567 92.55153  15.8  21.08491       9.671135 0.91 
1 1 1 51  1  2  o 71.92422 6.099769 102.1020  141.5 20.12082       12.19954 0.89 
1 1 1 51  1  3  o 31.08646 8.801203 14.77872  348.2 -15.53426      17.60241 0.16 
1 1 1 51  1  4  o 90.56734 5.480424 167.6720  16.1  18.21365       10.96085 0.95 
1 1 1 51  1  5  o 150.0107 3.658092 208.1678  334.6 -52.68518      7.316185 0.97 
1 1 1 51  1  6  o 118.0484 4.188027 100.3341  257.0 -2.563393      8.376055 0.91 
1 1 1 51  1  7  o 168.7110 3.748751 148.8814  225.3 -5.655685      7.497502 0.96 
1 1 1 51  1  8  o 209.1180 3.534746 216.7048  195.7 2.127853       7.069493 0.98 
1 1 1 51  1  9  o 32.65083 9.291128 41.42484  327.9 -0.3530426     18.58226 0.40 
1 1 1 51  1  10 o 107.7564 5.385406 82.39875  237.8 -7.794327      10.77081 0.93 
1 1 1 51  1  11 o 86.20397 6.673456 126.6310  357.1 8.911072       13.34691 0.95 
1 1 1 51  1  12 o 54.85424 11.71947 68.81805  30.6  -9.903595      23.43895 0.85 
1 1 1 51  1  13 o 45.13311 11.36471 53.55313  57.9  -5.073601      22.72941 0.75 
1 1 1 51  1  14 o 122.2871 6.225176 143.4514  155.1 -4.281082      12.45035 0.97 
1 1 1 51  1  15 o 71.41865 9.462392 68.82175  19.6  ?              ?        0.91 
1 1 1 51  3  0  o 82.22130 5.584137 84.87328  358.4 -4.692749      11.16827 0.88 
1 1 1 51  3  1  o 255.2573 3.351255 328.2318  244.8 -0.1337891     6.702510 0.99 
1 1 1 51  3  2  o 70.30379 6.765829 62.55829  123.2 -14.29930      13.53166 0.82 
1 1 1 51  3  3  o 55.40354 7.874913 75.12421  356.4 33.94509       15.74983 0.77 
1 1 1 51  3  4  o 32.77621 8.913579 57.58625  48.1  -13.13355      17.82716 0.44 
1 1 1 51  3  5  o 37.74297 9.056905 94.35098  132.7 -12.33578      18.11381 0.65 
1 1 1 51  3  6  o 84.76111 5.834133 71.21893  327.0 -15.33598      11.66827 0.83 
1 1 1 51  3  7  o 121.6012 4.524978 156.4815  231.3 -24.82941      9.049955 0.95 
1 1 1 51  3  8  o 61.67638 9.216516 87.79591  203.4 1.527348       18.43303 0.84 
1 1 1 51  3  9  o 63.15855 9.462480 103.2511  64.1  -36.40371      18.92496 0.89 
1 1 1 51  3  10 o 77.65928 7.375824 106.0593  92.9  0.2387695      14.75165 0.93 
1 1 1 51  3  11 o 39.49572 10.23315 61.75530  233.6 8.321465       20.46631 0.76 
1 1 1 51  3  12 o 127.3297 5.036433 124.3006  280.4 3.371185       10.07287 0.97 
1 1 1 51  3  13 o 30.41693 9.610183 24.77867  25.7  10.18567       19.22037 0.36 
1 1 1 51  3  14 o 101.2165 7.623157 135.0308  177.9 4.292366       15.24631 0.97 
1 1 1 51  3  15 o 78.31034 8.777663 119.6080  156.4 ?              ?        0.96 
1 1 1 51  5  0  o 183.5862 4.116926 224.4811  165.0 62.60835       8.233852 0.98 
1 1 1 51  5  1  o 150.0768 4.068323 151.7386  217.1 -33.50256      8.136645 0.96 
1 1 1 51  5  2  o 47.55642 8.474319 87.97542  86.8  29.61412       16.94864 0.72 
1 1 1 51  5  3  o 80.85616 6.306430 70.40881  295.6 0.4762192      12.61286 0.81 
1 1 1 51  5  4  o 130.7145 3.920388 120.8240  113.7 22.61257       7.840776 0.94 
1 1 1 51  5  5  o 91.50986 6.946050 81.33022  132.9 17.04704       13.89210 0.88 
1 1 1 51  5  6  o 84.32278 8.876239 123.7138  264.7 -39.83090      17.75248 0.92 
1 1 1 51  5  7  o 63.64254 9.265623 65.00249  326.2 -34.01805      18.53125 0.81 
1 1 1 51  5  8  o 42.92249 10.14835 43.74777  272.5 -18.83529      20.29670 0.61 
1 1 1 51  5  9  f 133.9507 5.758863 171.2872  318.4 7.011276       11.51773 0.00 
1 1 1 51  5  10 o 129.0741 4.980437 166.2788  28.2  12.44626       9.960874 0.98 
1 1 1 51  5  11 o 50.09940 9.850426 81.73083  190.0 -18.21295      19.70085 0.87 
1 1 1 51  5  12 o 96.60874 6.884591 106.1593  142.1 30.93713       13.76918 0.96 
1 1 1 51  5  13 o 64.57959 8.865303 83.79607  338.8 19.94418       17.73061 0.92 
1 1 1 51  5  14 x ?        ?        22.60188  271.1 ?              ?        0.00 
1 1 1 51  7  0  o 140.0190 4.765259 181.2304  250.1 26.13625       9.530518 0.97 
1 1 1 51  7  1  o 51.37734 8.503184 27.72408  205.5 37.53475       17.00637 0.39 
1 1 1 51  7  2  o 107.7139 5.758502 162.0484  182.6 -2.326401      11.51700 0.95 
1 1 1 51  7  3  o 32.32065 9.995754 47.71173  102.7 9.976629       19.99151 0.46 
1 1 1 51  7  4  o 31.16935 8.879008 8.999445  198.7 -20.99769      17.75802 0.11 
1 1 1 51  7  5  o 52.16070 10.20431 91.40543  189.9 -10.66302      20.40861 0.86 
1 1 1 51  7  6  o 199.6451 4.033971 207.6341  137.2 13.14989       8.067943 0.99 
1 1 1 51  7  7  o 57.93944 9.835718 69.67904  93.3  -4.811180      19.67144 0.87 
1 1 1 51  7  8  o 106.1730 6.617501 111.7784  300.4 -5.582237      13.23500 0.96 
1 1 1 51  7  9  o 76.68867 9.025050 96.24447  296.0 -29.72751      18.05010 0.94 
1 1 1 51  7  10 o 44.17999 10.79099 53.53513  59.2  -3.442909      21.58198 0.77 
1 1 1 51  7  11 o 64.20299 9.033011 84.35363  169.7 ?              ?        0.92 
1 1 1 51  7  12 x ?        ?        70.11990  264.7 ?              ?        0.00 
1 1 1 51  9  0  o 112.4524 7.054674 163.9194  225.1 -15.51832      14.10935 0.97 
1 1 1 51  9  1  o 33.30737 10.55278 65.08493  152.9 11.20761       21.10555 0.70 
1 1 1 51  9  2  o 108.3155 6.248617 170.1818  50.4  -2.842659      12.49723 0.98 
1 1 1 51  9  3  o 50.08546 11.27577 60.84685  68.3  8.266491       22.55153 0.83 
1 1 1 51  9  4  o 113.8548 5.795466 148.8199  171.6 13.54270       11.59093 0.98 
1 1 1 51  9  5  o 68.33595 9.725224 74.97107  156.7 -18.06586      19.45045 0.91 
1 1 1 51  9  6  o 40.57652 11.15077 57.12685  148.4 6.580223       22.30153 0.77 
1 1 1 51  9  7  o 99.65274 6.836375 163.3063  206.5 -1.759132      13.67275 0.98 
1 1 1 51  9  8  o 25.94704 8.873203 12.02576  307.4 ?              ?        0.20 
1 1 1 51  9  9  x ?        ?        101.0965  70.6  ?              ?        0.00 
1 1 1 51  11 0  o 41.27225 10.10756 82.83584  10.8  -24.36508      20.21512 0.87 
1 1 1 51  11 1  f 68.28973 11.72037 89.48637  49.0  12.26507       23.44073 0.00 
1 1 1 51  11 2  o 63.50150 12.07055 87.04367  200.7 27.47764       24.14109 0.92 
1 1 1 51  11 3  o 44.70471 12.07509 81.64404  233.0 ?              ?        0.88 
1 1 1 51  11 4  o 65.58365 10.90691 92.59430  309.9 ?              ?        0.94 
1 1 1 51  11 5  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 52  0  0  o 29.85627 16.32327 83.37421  0.0   0.000000       0.000000 0.60 
1 1 1 52  0  1  o 96.32986 6.713845 101.3402  0.0   0.000000       0.000000 1.00 
1 1 1 52  0  2  o 117.4377 6.170745 107.6273  180.0 0.000000       0.000000 1.00 
1 1 1 52  0  3  o 39.47759 16.63471 62.75690  180.0 0.000000       0.000000 0.61 
1 1 1 52  0  4  o 20.98143 13.54519 29.73951  0.0   0.000000       0.000000 0.16 
1 1 1 52  0  5  o 16.60852 11.56958 1.634299  180.0 0.000000       0.000000 0.01 
1 1 1 52  0  6  f 27.89209 15.23302 63.42521  0.0   0.000000       0.000000 0.00 
1 1 1 52  0  7  o 25.48330 15.24565 6.860439  180.0 0.000000       0.000000 0.05 
1 1 1 52  0  8  o 31.88559 17.01184 35.21221  180.0 0.000000       0.000000 0.32 
1 1 1 52  0  9  o 132.5182 5.660244 166.4525  0.0   0.000000       0.000000 1.00 
1 1 1 52  0  10 o 135.0901 5.883878 138.2150  180.0 0.000000       0.000000 1.00 
1 1 1 52  0  11 f 36.22137 16.45911 51.26413  0.0   0.000000       0.000000 0.00 
1 1 1 52  0  12 o 18.29863 13.23572 38.52744  0.0   0.000000       0.000000 0.35 
1 1 1 52  0  13 o 110.3427 8.398898 96.79295  0.0   0.000000       0.000000 1.00 
1 1 1 52  0  14 o 46.60528 17.73331 34.61470  180.0 0.000000       0.000000 0.68 
1 1 1 52  0  15 x ?        ?        123.4132  0.0   ?              ?        0.00 
1 1 1 52  2  0  o 129.4270 4.553407 204.0238  230.4 -21.21940      9.106814 0.97 
1 1 1 52  2  1  o 33.13116 9.377698 18.61156  48.5  -0.7358513     18.75540 0.22 
1 1 1 52  2  2  o 165.4740 3.458851 137.1602  115.4 -1.893997      6.917702 0.97 
1 1 1 52  2  3  f 58.01139 8.095743 97.64183  281.7 41.69653       16.19149 0.00 
1 1 1 52  2  4  o 114.7626 4.659594 107.6138  199.5 -1.218063      9.319187 0.92 
1 1 1 52  2  5  o 157.4724 3.804556 122.0891  236.9 22.93456       7.609111 0.95 
1 1 1 52  2  6  o 92.13229 5.673479 90.30456  297.2 15.97492       11.34696 0.88 
1 1 1 52  2  7  o 37.94388 9.290686 37.92647  131.6 -18.03616      18.58137 0.38 
1 1 1 52  2  8  o 180.1504 3.432578 193.7798  239.0 22.78517       6.865155 0.98 
1 1 1 52  2  9  o 103.5284 5.197404 153.4589  292.0 31.11752       10.39481 0.96 
1 1 1 52  2  10 o 39.93034 9.300410 90.31149  134.1 -18.81595      18.60082 0.83 
1 1 1 52  2  11 o 130.5117 4.830875 152.5860  171.8 -5.108040      9.661750 0.98 
1 1 1 52  2  12 o 36.79442 10.04533 13.99121  337.5 3.074249       20.09065 0.25 
1 1 1 52  2  13 o 90.17680 8.814921 82.25665  18.9  30.51593       17.62984 0.93 
1 1 1 52  2  14 o 107.7496 6.778823 147.7584  171.4 ?              ?        0.97 
1 1 1 52  2  15 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 52  4  0  o 50.11055 9.586235 64.35481  68.6  -3.113201      19.17247 0.70 
1 1 1 52  4  1  o 117.8693 4.508516 117.9949  245.7 -9.411232      9.017033 0.94 
1 1 1 52  4  2  o 133.8018 4.390871 160.3744  229.1 -4.165207      8.781741 0.96 
1 1 1 52  4  3  o 45.06561 9.385284 70.31670  240.2 -9.584225      18.77057 0.62 
1 1 1 52  4  4  o 63.50922 8.161795 100.2231  29.8  15.62662       16.32359 0.84 
1 1 1 52  4  5  o 66.25361 7.850415 121.9645  8.3   27.77586       15.70083 0.88 
1 1 1 52  4  6  o 36.97057 9.748699 73.24230  223.2 0.3107758      19.49740 0.63 
1 1 1 52  4  7  o 128.0372 5.215504 192.1269  307.0 -32.53236      10.43101 0.97 
1 1 1 52  4  8  f 65.07135 10.13415 69.45155  291.5 -13.73354      20.26830 0.00 
1 1 1 52  4  9  o 31.35525 9.250230 64.50120  219.3 -4.689669      18.50046 0.68 
1 1 1 52  4  10 o 37.44359 10.51877 80.03002  255.8 1.835930       21.03754 0.82 
1 1 1 52  4  11 o 49.60888 10.24868 66.31290  253.3 -3.509514      20.49736 0.83 
1 1 1 52  4  12 o 39.51205 10.73920 67.44336  215.7 -6.195656      21.47840 0.79 
1 1 1 52  4  13 o 71.18795 9.425797 102.3792  273.0 ?              ?        0.94 
1 1 1 52  4  14 x ?        ?        63.05872  145.1 ?              ?        0.00 
1 1 1 52  6  0  o 80.22485 6.105436 148.2623  63.7  5.875420       12.21087 0.92 
1 1 1 52  6  1  o 75.74718 6.899612 85.39427  130.1 -12.36732      13.79922 0.85 
1 1 1 52  6  2  o 80.79428 6.669776 166.7200  227.4 -4.266647      13.33955 0.94 
1 1 1 52  6  3  o 66.35794 7.627168 99.57497  249.7 5.812145       15.25434 0.87 
1 1 1 52  6  4  o 31.98062 9.477926 34.47677  73.0  18.23681       18.95585 0.35 
1 1 1 52  6  5  o 84.15993 7.105335 134.6729  125.5 17.78858       14.21067 0.94 
1 1 1 52  6  6  o 127.4891 5.991144 125.8119  151.6 29.62960       11.98229 0.97 
1 1 1 52  6  7  o 41.28407 10.58812 87.42403  211.7 23.04750       21.17624 0.84 
1 1 1 52  6  8  o 111.8599 5.549195 138.0076  246.0 18.10954       11.09839 0.97 
1 1 1 52  6  9  o 66.17966 9.427397 56.04188  321.8 -5.230865      18.85479 0.86 
1 1 1 52  6  10 o 67.33017 9.349290 94.75421  55.4  6.042915       18.69858 0.92 
1 1 1 52  6  11 o 42.57375 11.16000 49.42041  137.8 -2.311100      22.32001 0.75 
1 1 1 52  6  12 o 64.27142 9.745908 46.28608  141.2 ?              ?        0.86 
1 1 1 52  8  0  o 209.9128 4.159267 275.1488  205.4 2.894943       8.318534 0.99 
1 1 1 52  8  1  o 181.9802 4.943955 223.1434  173.6 -9.560867      9.887911 0.99 
1 1 1 52  8  2  o 59.19082 10.29557 15.78971  46.7  16.09704       20.59113 0.38 
1 1 1 52  8  3  o 67.26917 9.723358 90.77969  325.0 2.348282       19.44672 0.91 
1 1 1 52  8  4  o 37.45285 10.58694 41.13430  347.0 -3.212162      21.17388 0.62 
1 1 1 52  8  5  o 38.82550 10.06809 41.50162  123.6 -16.71108      20.13618 0.66 
1 1 1 52  8  6  o 99.47623 6.535265 101.0424  136.1 1.237617       13.07053 0.96 
1 1 1 52  8  7  o 45.45940 9.742298 102.1952  189.6 -21.88456      19.48460 0.90 
1 1 1 52  8  8  o 53.61494 10.94570 102.2139  314.3 1.991821       21.89141 0.92 
1 1 1 52  8  9  o 32.88822 9.824959 79.19724  310.4 ?              ?        0.83 
1 1 1 52  8  10 x ?        ?        56.39015  229.8 ?              ?        0.00 
1 1 1 52  10 0  o 109.2788 6.659362 186.0399  256.2 7.195160       13.31872 0.98 
1 1 1 52  10 1  o 29.34468 9.619227 36.61732  94.1  3.685848       19.23845 0.53 
1 1 1 52  10 2  o 42.45570 12.61116 56.11264  36.3  18.70894       25.22232 0.76 
1 1 1 52  10 3  o 40.42535 11.96300 67.70583  242.5 8.289272       23.92601 0.81 
1 1 1 52  10 4  o 54.11583 9.942261 109.0705  284.7 -33.31932      19.88452 0.93 
1 1 1 52  10 5  o 62.90275 11.29956 109.0650  91.3  ?              ?        0.94 
1 1 1 52  10 6  x ?        ?        38.40229  73.1  ?              ?        0.00 
1 1 1 52  12 0  x ?        ?        150.6557  2.0   ?              ?        0.00 
1 1 1 53  1  0  o 47.21995 7.739192 89.12366  354.0 43.62785       15.47838 0.82 
1 1 1 53  1  1  o 66.59116 8.161211 125.4269  311.1 30.21507       16.32242 0.90 
1 1 1 53  1  2  o 92.69897 5.034203 146.7713  73.9  13.24419       10.06841 0.94 
1 1 1 53  1  3  o 43.28176 9.390888 24.72886  161.1 -4.568134      18.78178 0.26 
1 1 1 53  1  4  o 123.2670 4.514244 133.4644  129.6 -10.96359      9.028488 0.94 
1 1 1 53  1  5  o 205.6516 3.638685 231.6699  154.9 -7.757187      7.277370 0.98 
1 1 1 53  1  6  o 56.64907 8.544072 7.811468  322.9 -22.56893      17.08814 0.12 
1 1 1 53  1  7  o 172.4423 3.718346 202.2574  336.6 10.79927       7.436693 0.98 
1 1 1 53  1  8  o 48.40280 8.597216 57.14059  321.5 -19.59547      17.19443 0.71 
1 1 1 53  1  9  o 107.5006 5.102284 110.5247  303.4 -2.669060      10.20457 0.95 
1 1 1 53  1  10 o 89.02405 5.369735 94.59971  206.8 -15.25279      10.73947 0.94 
1 1 1 53  1  11 o 192.4548 4.212397 228.9594  203.2 -23.12564      8.424794 0.99 
1 1 1 53  1  12 o 76.97520 10.05452 109.1782  271.0 -27.22087      20.10904 0.94 
1 1 1 53  1  13 o 51.06498 11.15425 47.32949  350.8 24.25159       22.30849 0.77 
1 1 1 53  1  14 o 53.62162 12.02328 76.45357  153.7 ?              ?        0.88 
1 1 1 53  3  0  o 50.00328 8.383409 60.18296  346.1 27.51802       16.76682 0.68 
1 1 1 53  3  1  o 132.0922 4.284411 106.4739  109.0 -5.308365      8.568823 0.94 
1 1 1 53  3  2  o 96.89500 5.841085 152.5849  189.2 -2.997635      11.68217 0.93 
1 1 1 53  3  3  o 68.02802 6.654922 90.07240  61.9  -15.21185      13.30984 0.82 
1 1 1 53  3  4  o 80.86500 6.843379 93.85403  143.2 2.587860       13.68676 0.87 
1 1 1 53  3  5  o 38.39934 9.284273 51.80748  283.2 2.391262       18.56855 0.48 
1 1 1 53  3  6  o 37.26646 9.807053 29.25305  193.8 9.349285       19.61411 0.32 
1 1 1 53  3  7  o 150.4530 4.065147 194.7119  305.1 -24.70992      8.130294 0.98 
1 1 1 53  3  8  o 173.1872 4.107295 211.6836  297.3 -14.54459      8.214590 0.98 
1 1 1 53  3  9  o 68.41813 9.267483 97.15810  39.0  -16.12361      18.53497 0.92 
1 1 1 53  3  10 o 106.4924 6.336954 115.9100  101.7 1.916679       12.67391 0.96 
1 1 1 53  3  11 o 35.05200 9.316725 51.41998  88.3  -14.21523      18.63345 0.67 
1 1 1 53  3  12 o 28.53448 9.211330 9.977805  70.9  4.985838       18.42266 0.15 
1 1 1 53  3  13 o 172.5280 4.785734 179.9430  295.0 ?              ?        0.99 
1 1 1 53  5  0  o 122.0785 5.073238 134.7913  320.7 13.84307       10.14648 0.94 
1 1 1 53  5  1  o 76.41600 7.530577 62.36926  102.0 -7.431664      15.06115 0.77 
1 1 1 53  5  2  o 122.5055 4.523178 157.0435  252.8 3.413597       9.046355 0.95 
1 1 1 53  5  3  o 73.64687 6.929322 71.27959  180.5 11.91261       13.85864 0.82 
1 1 1 53  5  4  o 30.15372 9.281701 44.70100  48.5  -0.4239025     18.56340 0.40 
1 1 1 53  5  5  o 113.6962 4.813696 145.6074  135.1 -2.469810      9.627393 0.96 
1 1 1 53  5  6  o 92.86459 6.544176 118.0413  110.9 21.20326       13.08835 0.95 
1 1 1 53  5  7  o 97.91196 6.717668 117.9707  40.7  -35.35425      13.43534 0.96 
1 1 1 53  5  8  o 62.35987 9.381686 69.89794  185.3 12.01761       18.76337 0.89 
1 1 1 53  5  9  f 41.91866 11.17716 86.66277  116.2 -4.632267      22.35432 0.00 
1 1 1 53  5  10 o 98.33528 6.599890 133.5482  348.5 -8.000381      13.19978 0.97 
1 1 1 53  5  11 o 121.1262 5.786746 125.3958  25.5  0.1077652      11.57349 0.97 
1 1 1 53  5  12 o 39.94540 10.84351 69.60570  172.8 ?              ?        0.83 
1 1 1 53  7  0  o 101.9695 6.184147 59.52647  333.8 -22.33531      12.36829 0.87 
1 1 1 53  7  1  f 82.04227 6.875573 35.02845  345.7 -21.64778      13.75115 0.00 
1 1 1 53  7  2  o 111.0178 7.407905 159.9405  15.0  22.11098       14.81581 0.97 
1 1 1 53  7  3  o 51.39456 12.18935 62.80796  282.4 -9.160862      24.37869 0.78 
1 1 1 53  7  4  o 106.9108 5.794207 123.3169  321.7 -5.820465      11.58841 0.96 
1 1 1 53  7  5  o 48.70842 10.95109 69.99623  311.1 -7.406586      21.90219 0.84 
1 1 1 53  7  6  o 43.84010 11.30742 27.01060  134.5 17.77140       22.61484 0.53 
1 1 1 53  7  7  o 102.3673 6.362129 87.24163  188.3 27.79013       12.72426 0.95 
1 1 1 53  7  8  o 30.95790 9.624347 68.38833  230.3 -4.310976      19.24869 0.75 
1 1 1 53  7  9  o 94.48573 7.213786 88.96261  41.5  20.99784       14.42757 0.95 
1 1 1 53  7  10 o 47.62255 10.97559 55.25016  41.0  ?              ?        0.83 
1 1 1 53  9  0  o 55.46411 14.18640 133.7738  205.3 17.04921       28.37280 0.93 
1 1 1 53  9  1  o 77.03148 10.19490 147.7754  78.8  1.901077       20.38981 0.96 
1 1 1 53  9  2  o 161.4437 5.632469 223.3453  8.9   -10.44012      11.26494 0.99 
1 1 1 53  9  3  f 92.24680 7.948153 116.0205  3.9   -28.07504      15.89631 0.00 
1 1 1 53  9  4  f 61.05902 9.933265 86.33921  261.2 1.750614       19.86653 0.00 
1 1 1 53  9  5  o 56.34265 10.65942 71.77905  114.7 25.16256       21.31884 0.89 
1 1 1 53  9  6  o 37.67905 10.26112 44.52738  326.0 ?              ?        0.71 
1 1 1 53  9  7  o 86.88753 8.281836 129.7259  262.8 ?              ?        0.97 
1 1 1 53  11 0  o 41.61529 11.67578 42.07947  214.7 -1.865166      23.35155 0.72 
1 1 1 53  11 1  o 42.40949 11.94114 84.68724  104.7 ?              ?        0.88 
1 1 1 53  11 2  f 60.38274 12.72069 112.9456  64.6  ?              ?        0.00 
1 1 1 54  0  0  o 36.68393 16.34793 99.31765  180.0 0.000000       0.000000 0.79 
1 1 1 54  0  1  o 182.6403 5.465092 213.5635  180.0 0.000000       0.000000 1.00 
1 1 1 54  0  2  o 139.7250 6.523429 168.5256  0.0   0.000000       0.000000 1.00 
1 1 1 54  0  3  o 84.43024 7.705543 72.50015  180.0 0.000000       0.000000 0.92 
1 1 1 54  0  4  o 105.0134 6.488205 122.0892  0.0   0.000000       0.000000 1.00 
1 1 1 54  0  5  o 34.66702 17.69186 32.78773  180.0 0.000000       0.000000 0.29 
1 1 1 54  0  6  o 204.2849 4.795197 228.5077  180.0 0.000000       0.000000 1.00 
1 1 1 54  0  7  o 25.89415 15.18709 111.6869  180.0 0.000000       0.000000 0.76 
1 1 1 54  0  8  o 38.55947 17.46104 57.60290  180.0 0.000000       0.000000 0.69 
1 1 1 54  0  9  f 82.67891 8.329073 114.9336  180.0 0.000000       0.000000 0.00 
1 1 1 54  0  10 o 43.47515 17.38232 6.730943  0.0   0.000000       0.000000 0.14 
1 1 1 54  0  11 o 121.4634 6.408457 159.7376  180.0 0.000000       0.000000 1.00 
1 1 1 54  0  12 o 32.54558 19.16549 29.89270  180.0 0.000000       0.000000 0.43 
1 1 1 54  0  13 o 19.28149 13.67356 51.91036  180.0 ?              ?        0.53 
1 1 1 54  2  0  o 132.1380 4.313294 166.5503  328.6 -8.815468      8.626588 0.96 
1 1 1 54  2  1  o 59.02125 8.421740 84.68301  197.0 -12.71377      16.84348 0.78 
1 1 1 54  2  2  o 100.7592 5.383931 128.0077  98.9  12.19054       10.76786 0.92 
1 1 1 54  2  3  o 160.1914 3.793507 217.3500  359.2 -4.178940      7.587014 0.97 
1 1 1 54  2  4  f 119.4698 4.693595 32.28009  41.7  11.98301       9.387190 0.00 
1 1 1 54  2  5  o 34.51016 8.889046 43.05194  332.9 -17.99160      17.77809 0.40 
1 1 1 54  2  6  o 60.47079 7.563591 45.42251  342.8 7.676853       15.12718 0.67 
1 1 1 54  2  7  o 96.57837 5.996953 99.71059  9.2   24.53889       11.99391 0.93 
1 1 1 54  2  8  o 82.30277 6.355562 87.52304  300.2 -27.81424      12.71112 0.92 
1 1 1 54  2  9  o 133.2246 5.628741 197.1880  352.5 -13.18378      11.25748 0.98 
1 1 1 54  2  10 o 80.09081 7.428490 107.6597  347.6 21.93182       14.85698 0.94 
1 1 1 54  2  11 o 34.55839 9.997764 10.35303  244.4 14.03329       19.99553 0.18 
1 1 1 54  2  12 o 39.79626 10.09747 41.01365  225.0 -13.15021      20.19495 0.66 
1 1 1 54  2  13 o 121.6899 7.310118 163.0779  248.6 ?              ?        0.98 
1 1 1 54  4  0  o 120.5432 5.114289 146.6482  26.8  -2.135895      10.22858 0.94 
1 1 1 54  4  1  o 116.7149 4.930390 154.5122  26.5  -4.830788      9.860780 0.95 
1 1 1 54  4  2  o 46.90883 9.794684 47.86897  356.1 17.23854       19.58937 0.52 
1 1 1 54  4  3  o 203.1848 3.560669 271.4387  115.4 10.53546       7.121339 0.98 
1 1 1 54  4  4  o 44.01680 9.924962 106.5448  128.6 5.272522       19.84992 0.81 
1 1 1 54  4  5  o 133.8440 4.131537 210.2150  134.2 -12.22186      8.263075 0.98 
1 1 1 54  4  6  o 62.96788 9.089522 130.0471  128.8 -4.141636      18.17904 0.92 
1 1 1 54  4  7  o 61.43970 8.276471 52.99218  25.7  -60.09198      16.55294 0.82 
1 1 1 54  4  8  o 66.76502 10.77337 81.69921  279.9 -17.33013      21.54675 0.91 
1 1 1 54  4  9  o 77.62337 7.984339 125.1971  109.4 -16.88970      15.96868 0.95 
1 1 1 54  4  10 o 39.95362 10.14252 50.27408  117.7 -1.521637      20.28505 0.71 
1 1 1 54  4  11 o 141.6033 5.263011 165.4560  52.8  3.111954       10.52602 0.98 
1 1 1 54  4  12 f 49.62796 11.14681 97.84296  90.7  ?              ?        0.00 
1 1 1 54  6  0  o 144.1673 4.731507 146.7293  13.6  11.32094       9.463015 0.96 
1 1 1 54  6  1  o 148.4211 4.279579 160.0145  64.4  -3.627869      8.559157 0.97 
1 1 1 54  6  2  o 147.5789 5.008504 146.4939  333.0 -10.55064      10.01701 0.97 
1 1 1 54  6  3  o 97.50375 5.712615 122.1046  230.2 2.190826       11.42523 0.95 
1 1 1 54  6  4  o 84.49196 7.269229 70.10256  280.8 -0.4252472     14.53846 0.90 
1 1 1 54  6  5  o 38.08884 10.05704 53.61686  30.0  10.11686       20.11407 0.70 
1 1 1 54  6  6  o 167.2007 5.273749 184.6979  48.3  1.869202       10.54750 0.99 
1 1 1 54  6  7  o 55.95390 9.679932 61.67420  41.3  -23.80597      19.35986 0.85 
1 1 1 54  6  8  o 66.90706 9.932404 81.15007  224.9 -13.73592      19.86481 0.91 
1 1 1 54  6  9  o 42.48178 10.48987 52.06421  334.0 22.46902       20.97975 0.76 
1 1 1 54  6  10 o 70.93070 9.910838 127.1924  315.2 ?              ?        0.95 
1 1 1 54  6  11 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 54  8  0  o 93.53894 6.953146 139.2984  34.9  20.46738       13.90629 0.96 
1 1 1 54  8  1  o 96.66356 10.58999 178.5240  45.4  -12.56042      21.17998 0.97 
1 1 1 54  8  2  o 55.38964 10.81002 100.6945  294.0 -9.249157      21.62004 0.91 
1 1 1 54  8  3  o 35.58184 10.68527 63.59131  247.3 17.53144       21.37055 0.76 
1 1 1 54  8  4  o 41.65768 10.89362 69.87744  106.1 15.41857       21.78724 0.82 
1 1 1 54  8  5  o 40.98435 10.73807 52.67049  33.8  -13.04005      21.47614 0.75 
1 1 1 54  8  6  o 31.06832 10.11029 28.66753  326.1 6.266882       20.22058 0.46 
1 1 1 54  8  7  o 42.49852 10.82140 28.94395  206.0 ?              ?        0.59 
1 1 1 54  8  8  x ?        ?        55.15773  54.9  ?              ?        0.00 
1 1 1 54  10 0  o 67.17648 10.65684 85.41742  98.7  3.717308       21.31367 0.92 
1 1 1 54  10 1  o 51.09203 11.28565 47.63124  180.5 -3.012833      22.57131 0.80 
1 1 1 54  10 2  o 55.03857 13.13880 64.18394  91.1  -3.932156      26.27760 0.86 
1 1 1 54  10 3  o 48.29066 11.87447 62.59837  168.0 ?              ?        0.85 
1 1 1 54  10 4  x ?        ?        75.63290  237.6 ?              ?        0.00 
1 1 1 55  1  0  o 106.7851 5.009313 89.64376  167.6 51.68068       10.01863 0.90 
1 1 1 55  1  1  o 93.53860 5.472426 174.8285  231.6 18.91107       10.94485 0.94 
1 1 1 55  1  2  o 45.51766 10.04379 35.96008  325.2 -12.00774      20.08757 0.38 
1 1 1 55  1  3  o 55.94639 8.860081 42.86826  250.8 6.304855       17.72016 0.54 
1 1 1 55  1  4  o 158.2633 3.931578 190.5913  345.1 -23.94102      7.863157 0.97 
1 1 1 55  1  5  o 134.5825 4.494543 137.1742  18.9  -26.25581      8.989086 0.96 
1 1 1 55  1  6  o 107.9167 5.383229 127.4100  198.5 34.03524       10.76646 0.95 
1 1 1 55  1  7  o 80.14189 6.618651 88.44213  183.1 1.516716       13.23730 0.91 
1 1 1 55  1  8  o 40.26783 9.244130 63.21381  194.8 -9.752506      18.48826 0.76 
1 1 1 55  1  9  o 70.06001 7.138939 61.61081  125.7 5.423225       14.27788 0.89 
1 1 1 55  1  10 o 85.70603 6.235492 87.15874  55.2  12.37341       12.47098 0.94 
1 1 1 55  1  11 o 42.47301 11.13426 27.45214  121.5 14.51738       22.26853 0.51 
1 1 1 55  1  12 o 33.45018 10.75014 32.93527  144.1 ?              ?        0.52 
1 1 1 55  1  13 x ?        ?        14.49541  222.9 ?              ?        0.00 
1 1 1 55  3  0  o 79.10420 7.203587 133.9805  224.1 1.792763       14.40717 0.90 
1 1 1 55  3  1  o 156.8204 3.892724 234.7135  232.1 -2.553696      7.785447 0.97 
1 1 1 55  3  2  o 61.69866 8.563449 53.81886  24.9  -7.856529      17.12690 0.67 
1 1 1 55  3  3  o 77.61497 6.330504 69.99620  22.0  -12.00655      12.66101 0.83 
1 1 1 55  3  4  o 70.05090 7.322140 90.14384  240.8 -6.152222      14.64428 0.87 
1 1 1 55  3  5  f 219.0988 3.573564 259.8666  97.7  -5.436035      7.147128 0.00 
1 1 1 55  3  6  o 117.3586 5.128069 132.0509  106.2 -16.29452      10.25614 0.96 
1 1 1 55  3  7  o 45.57756 9.189707 42.93178  241.0 -26.80768      18.37941 0.67 
1 1 1 55  3  8  o 92.50781 7.168615 126.6939  294.4 -8.537239      14.33723 0.96 
1 1 1 55  3  9  o 31.74341 9.681699 55.13053  53.8  -2.593533      19.36340 0.66 
1 1 1 55  3  10 o 39.19734 10.34142 49.25905  329.0 20.39942       20.68284 0.69 
1 1 1 55  3  11 o 102.6664 5.943150 107.4835  61.8  10.40887       11.88630 0.96 
1 1 1 55  3  12 o 101.6152 6.775834 88.03548  114.7 ?              ?        0.96 
1 1 1 55  5  0  o 105.4231 5.216304 102.1473  222.5 -18.70004      10.43261 0.92 
1 1 1 55  5  1  o 41.48215 9.959382 38.35846  317.0 -8.919067      19.91876 0.44 
1 1 1 55  5  2  o 47.96293 9.683567 72.09251  359.3 -11.53267      19.36713 0.75 
1 1 1 55  5  3  o 71.32979 7.542149 75.01214  147.9 11.78178       15.08430 0.87 
1 1 1 55  5  4  o 45.35863 10.01248 4.603349  191.8 -0.6557808     20.02495 0.09 
1 1 1 55  5  5  o 74.73322 7.326356 62.57522  233.2 -2.002625      14.65271 0.88 
1 1 1 55  5  6  o 103.9713 6.568113 100.6450  102.7 -7.801895      13.13623 0.96 
1 1 1 55  5  7  o 61.54811 10.00413 83.37347  71.2  -4.194374      20.00826 0.90 
1 1 1 55  5  8  o 52.95194 9.877622 60.67276  248.2 35.28654       19.75524 0.83 
1 1 1 55  5  9  o 120.9980 5.719319 167.1993  209.6 -17.80109      11.43864 0.98 
1 1 1 55  5  10 o 41.86334 10.68954 26.26876  225.5 ?              ?        0.54 
1 1 1 55  5  11 x ?        ?        115.1911  28.1  ?              ?        0.00 
1 1 1 55  7  0  o 98.19304 6.674253 162.9252  122.1 -16.02097      13.34851 0.97 
1 1 1 55  7  1  o 119.5734 5.033617 150.1429  178.8 5.001556       10.06723 0.97 
1 1 1 55  7  2  o 147.0139 4.671399 204.8291  248.3 20.06898       9.342797 0.99 
1 1 1 55  7  3  f 54.72568 10.48098 62.45472  188.9 25.93326       20.96196 0.00 
1 1 1 55  7  4  o 53.10637 9.480521 80.89162  75.7  -27.75189      18.96104 0.89 
1 1 1 55  7  5  o 48.01640 8.819901 61.19052  277.1 -34.34691      17.63980 0.83 
1 1 1 55  7  6  o 29.10903 9.427238 52.36163  52.6  2.418802       18.85448 0.64 
1 1 1 55  7  7  o 86.59021 8.658511 100.7073  278.3 -26.30872      17.31702 0.95 
1 1 1 55  7  8  o 112.3590 6.928010 145.2691  247.1 ?              ?        0.98 
1 1 1 55  7  9  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 55  9  0  o 63.57004 12.17800 103.6894  56.6  -14.88956      24.35599 0.93 
1 1 1 55  9  1  o 68.20769 12.67741 79.07537  267.6 9.935486       25.35481 0.90 
1 1 1 55  9  2  o 41.36917 11.19611 61.80253  235.4 21.65393       22.39221 0.80 
1 1 1 55  9  3  o 47.59941 10.05094 45.31152  170.4 -27.04145      20.10189 0.78 
1 1 1 55  9  4  o 38.81792 10.23366 35.33577  114.6 ?              ?        0.65 
1 1 1 55  9  5  o 73.32133 9.737471 76.26541  296.7 ?              ?        0.93 
1 1 1 56  0  0  o 243.8427 4.855613 254.4665  180.0 0.000000       0.000000 1.00 
1 1 1 56  0  1  o 63.25852 11.66785 95.06861  180.0 0.000000       0.000000 0.91 
1 1 1 56  0  2  o 131.7649 6.308598 124.5057  0.0   0.000000       0.000000 1.00 
1 1 1 56  0  3  o 19.62222 13.17067 40.49597  0.0   0.000000       0.000000 0.22 
1 1 1 56  0  4  o 115.4931 6.355477 79.38451  180.0 0.000000       0.000000 1.00 
1 1 1 56  0  5  o 122.7171 7.005733 165.6430  0.0   0.000000       0.000000 1.00 
1 1 1 56  0  6  o 22.17268 14.68893 93.65926  0.0   0.000000       0.000000 0.68 
1 1 1 56  0  7  o 27.40785 15.67501 81.34045  0.0   0.000000       0.000000 0.76 
1 1 1 56  0  8  o 23.51942 14.71753 55.25033  0.0   0.000000       0.000000 0.58 
1 1 1 56  0  9  o 52.24360 14.39184 3.508978  0.0   0.000000       0.000000 0.09 
1 1 1 56  0  10 o 35.71920 18.12776 75.56174  0.0   0.000000       0.000000 0.86 
1 1 1 56  0  11 o 132.5882 6.268700 126.5271  0.0   0.000000       0.000000 1.00 
1 1 1 56  0  12 x ?        ?        161.5414  0.0   ?              ?        0.00 
1 1 1 56  2  0  o 97.35991 5.998419 80.86718  165.0 29.46566       11.99684 0.87 
1 1 1 56  2  1  o 92.66539 6.205009 97.24870  283.2 8.975716       12.41002 0.89 
1 1 1 56  2  2  o 48.53440 9.763777 45.14218  290.8 20.23164       19.52755 0.52 
1 1 1 56  2  3  f 141.8922 3.949713 152.6348  203.6 8.354202       7.899425 0.00 
1 1 1 56  2  4  o 115.3456 4.999203 107.4806  275.0 25.32711       9.998406 0.94 
1 1 1 56  2  5  o 72.52849 8.113015 100.5089  40.3  -25.14314      16.22603 0.91 
1 1 1 56  2  6  o 90.83833 5.520608 105.6393  104.8 -4.491005      11.04122 0.94 
1 1 1 56  2  7  o 86.38931 6.366425 107.1096  183.0 -6.349594      12.73285 0.95 
1 1 1 56  2  8  o 57.51661 9.123059 90.06516  162.3 5.204021       18.24612 0.90 
1 1 1 56  2  9  o 127.3475 4.615887 158.8194  147.1 12.87008       9.231774 0.98 
1 1 1 56  2  10 o 43.87496 11.49042 8.017963  150.4 4.658443       22.98084 0.18 
1 1 1 56  2  11 o 90.84041 6.967643 105.9672  66.8  ?              ?        0.96 
1 1 1 56  2  12 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 56  4  0  o 152.2173 4.091574 147.4973  183.0 -21.33661      8.183147 0.96 
1 1 1 56  4  1  o 169.9286 4.082745 170.1804  226.5 -31.27826      8.165490 0.97 
1 1 1 56  4  2  o 62.10974 7.997367 67.44423  344.0 34.55413       15.99473 0.80 
1 1 1 56  4  3  o 54.34978 9.618800 118.4717  281.9 -18.53826      19.23760 0.89 
1 1 1 56  4  4  o 57.42335 9.939621 40.32136  42.4  18.82676       19.87924 0.68 
1 1 1 56  4  5  o 116.2414 4.878621 130.6653  27.7  19.95910       9.757242 0.97 
1 1 1 56  4  6  o 136.1611 4.552565 155.8447  42.9  10.60794       9.105130 0.98 
1 1 1 56  4  7  o 26.10040 8.706481 27.12661  298.2 -3.181267      17.41296 0.35 
1 1 1 56  4  8  o 34.97563 10.17498 6.506780  238.5 -11.80625      20.34995 0.12 
1 1 1 56  4  9  o 61.67677 9.964126 81.57545  240.7 -14.01111      19.92825 0.90 
1 1 1 56  4  10 o 97.71115 6.824391 112.1311  288.8 ?              ?        0.96 
1 1 1 56  4  11 x ?        ?        ?         ?     ?              ?        ?    
1 1 1 56  6  0  f 100.8828 5.475378 159.8471  208.1 5.046623       10.95076 0.00 
1 1 1 56  6  1  f 126.7447 4.646110 148.8310  185.2 -12.55759      9.292220 0.00 
1 1 1 56  6  2  o 88.39439 6.180087 83.81892  195.2 -14.79228      12.36017 0.93 
1 1 1 56  6  3  o 39.03548 10.39332 58.09992  129.1 2.592278       20.78663 0.74 
1 1 1 56  6  4  o 104.4357 7.974328 95.21770  168.7 14.46941       15.94866 0.95 
1 1 1 56  6  5  o 89.06137 7.394979 130.1312  213.2 8.520317       14.78996 0.96 
1 1 1 56  6  6  f 43.27998 11.11816 33.45353  153.9 13.72880       22.23632 0.00 
1 1 1 56  6  7  o 27.99734 9.091726 24.26300  87.1  4.664213       18.18345 0.36 
1 1 1 56  6  8  o 80.66517 7.726068 83.45312  149.4 ?              ?        0.94 
1 1 1 56  6  9  x ?        ?        115.7051  221.5 ?              ?        0.00 
1 1 1 56  8  0  o 82.94710 8.250659 104.9355  260.9 3.474327       16.50132 0.95 
1 1 1 56  8  1  o 37.02689 11.47536 34.85557  267.9 9.682663       22.95072 0.56 
1 1 1 56  8  2  o 42.54499 12.35856 44.96453  180.9 5.952686       24.71712 0.69 
1 1 1 56  8  3  o 38.84076 11.00133 38.59501  222.8 -8.568668      22.00266 0.63 
1 1 1 56  8  4  o 40.75521 11.04502 62.98792  13.8  -9.060387      22.09003 0.80 
1 1 1 56  8  5  o 48.11630 11.24459 112.7951  276.7 ?              ?        0.92 
1 1 1 56  8  6  o 38.52401 10.96796 35.05880  237.6 ?              ?        0.65 
1 1 1 56  10 0  o 90.81905 10.70988 165.0298  32.0  ?              ?        0.97 
1 1 1 56  10 1  o 45.80952 12.33315 61.70907  305.7 ?              ?        0.84 
1 1 1 56  10 2  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 57  1  0  o 73.81979 7.927233 99.98449  126.5 0.7283859      15.85447 0.86 
1 1 1 57  1  1  o 108.5941 5.060526 88.42261  74.0  5.491455       10.12105 0.90 
1 1 1 57  1  2  o 86.52702 6.416814 81.11102  224.2 26.24864       12.83363 0.88 
1 1 1 57  1  3  o 106.4534 5.100615 126.5165  190.3 -10.09637      10.20123 0.95 
1 1 1 57  1  4  o 156.0302 4.213008 187.9545  202.3 2.530380       8.426017 0.98 
1 1 1 57  1  5  o 39.38919 9.764019 62.54805  355.2 -5.185566      19.52804 0.71 
1 1 1 57  1  6  o 157.6507 3.711097 173.9120  39.9  2.026291       7.422194 0.98 
1 1 1 57  1  7  o 31.49172 9.536194 54.62818  49.0  2.158529       19.07239 0.66 
1 1 1 57  1  8  o 74.29967 6.830898 71.97494  358.4 18.91186       13.66180 0.91 
1 1 1 57  1  9  o 86.37298 6.636163 96.66067  26.2  5.457779       13.27233 0.94 
1 1 1 57  1  10 o 71.04919 7.121718 115.9065  18.9  -11.14835      14.24344 0.95 
1 1 1 57  1  11 o 31.02071 9.930897 43.83751  62.1  ?              ?        0.63 
1 1 1 57  3  0  o 36.24629 9.479077 18.05739  80.0  20.63899       18.95815 0.18 
1 1 1 57  3  1  o 59.07099 7.949501 86.21684  46.0  -11.80368      15.89900 0.82 
1 1 1 57  3  2  o 151.8288 4.632321 169.8832  1.2   16.21507       9.264643 0.97 
1 1 1 57  3  3  o 78.36946 7.089382 102.6994  294.9 6.771416       14.17876 0.92 
1 1 1 57  3  4  o 48.07120 10.36862 71.05028  16.4  -3.667732      20.73724 0.80 
1 1 1 57  3  5  o 87.91868 5.999844 80.94585  316.5 -10.27782      11.99969 0.93 
1 1 1 57  3  6  o 147.1234 4.659787 182.2184  95.4  -3.278320      9.319573 0.98 
1 1 1 57  3  7  o 72.21628 6.793096 87.04216  159.1 -1.972069      13.58619 0.92 
1 1 1 57  3  8  o 78.26595 9.592492 114.7371  143.8 5.804619       19.18498 0.94 
1 1 1 57  3  9  o 57.48335 9.743150 26.51819  247.7 -30.02473      19.48630 0.64 
1 1 1 57  3  10 o 79.73344 9.054533 90.80573  291.0 ?              ?        0.94 
1 1 1 57  5  0  o 50.02209 9.304276 75.41921  190.7 5.273327       18.60855 0.80 
1 1 1 57  5  1  o 41.77536 9.919342 78.13200  229.4 -15.22590      19.83868 0.78 
1 1 1 57  5  2  o 38.47158 10.20373 29.12580  304.5 -4.205635      20.40746 0.44 
1 1 1 57  5  3  f 32.91515 9.909015 12.36917  119.1 10.71703       19.81803 0.00 
1 1 1 57  5  4  o 87.04437 6.997451 60.25308  80.2  -15.03130      13.99490 0.91 
1 1 1 57  5  5  o 29.44463 8.824723 34.21071  348.6 7.295691       17.64945 0.48 
1 1 1 57  5  6  o 36.84349 10.75491 4.128527  247.7 1.718895       21.50981 0.08 
1 1 1 57  5  7  o 106.7159 6.647761 89.08879  321.8 -6.133438      13.29552 0.95 
1 1 1 57  5  8  o 29.21674 9.506409 45.23672  28.0  -8.137964      19.01282 0.61 
1 1 1 57  5  9  x ?        ?        131.7661  285.2 ?              ?        0.00 
1 1 1 57  7  0  o 93.94475 7.168890 87.98635  334.2 -11.46777      14.33778 0.95 
1 1 1 57  7  1  o 68.27606 8.549200 119.8517  310.9 16.54890       17.09840 0.95 
1 1 1 57  7  2  o 46.61529 9.477475 50.46227  200.3 -0.2117157     18.95495 0.78 
1 1 1 57  7  3  o 38.20945 10.72463 79.30357  89.9  -7.020325      21.44926 0.82 
1 1 1 57  7  4  o 39.97230 11.12172 64.02819  342.0 11.55215       22.24344 0.79 
1 1 1 57  7  5  o 36.53546 9.356826 27.87963  236.8 -20.36125      18.71365 0.52 
1 1 1 57  7  6  o 77.26096 9.160669 90.31844  83.6  ?              ?        0.94 
1 1 1 57  7  7  x ?        ?        97.22388  87.5  ?              ?        0.00 
1 1 1 57  9  0  o 35.40292 11.25217 22.42562  164.1 7.821772       22.50434 0.42 
1 1 1 57  9  1  o 29.80159 10.44062 45.58318  150.4 12.17285       20.88123 0.64 
1 1 1 57  9  2  o 29.60345 9.332195 24.60846  35.4  ?              ?        0.44 
1 1 1 57  9  3  x ?        ?        98.17424  320.7 ?              ?        0.00 
1 1 1 58  0  0  o 23.88054 15.03673 15.91864  180.0 0.000000       0.000000 0.10 
1 1 1 58  0  1  o 96.79518 7.818145 111.4158  180.0 0.000000       0.000000 1.00 
1 1 1 58  0  2  o 222.4478 5.525401 264.5287  180.0 0.000000       0.000000 1.00 
1 1 1 58  0  3  o 17.65409 12.49567 48.63676  180.0 0.000000       0.000000 0.32 
1 1 1 58  0  4  o 134.0941 6.129818 107.1271  180.0 0.000000       0.000000 1.00 
1 1 1 58  0  5  o 140.8023 6.088834 119.3921  180.0 0.000000       0.000000 1.00 
1 1 1 58  0  6  o 31.11189 17.28678 1.604515  180.0 0.000000       0.000000 0.02 
1 1 1 58  0  7  o 22.01238 14.17165 23.58347  0.0   0.000000       0.000000 0.26 
1 1 1 58  0  8  o 41.88424 18.60920 21.11420  0.0   0.000000       0.000000 0.39 
1 1 1 58  0  9  o 67.68535 13.44102 57.79379  0.0   0.000000       0.000000 0.97 
1 1 1 58  0  10 o 30.16383 16.83675 9.853415  180.0 ?              ?        0.16 
1 1 1 58  2  0  o 113.3879 5.281696 114.3842  299.9 -8.942444      10.56339 0.94 
1 1 1 58  2  1  o 142.8033 4.096154 153.4448  27.9  -4.191483      8.192308 0.97 
1 1 1 58  2  2  o 129.1105 4.587986 137.6566  332.8 18.92210       9.175971 0.96 
1 1 1 58  2  3  o 130.7452 4.839361 128.0826  56.9  36.01163       9.678722 0.96 
1 1 1 58  2  4  o 23.57938 7.676453 32.34169  59.3  5.538616       15.35291 0.33 
1 1 1 58  2  5  o 102.2456 5.633493 101.1348  271.1 -2.684494      11.26699 0.95 
1 1 1 58  2  6  o 190.1562 4.026725 183.9348  20.3  -5.631622      8.053450 0.99 
1 1 1 58  2  7  o 114.6833 5.023619 120.6580  354.1 -14.85175      10.04724 0.97 
1 1 1 58  2  8  o 31.51067 8.986653 14.31380  336.7 17.43568       17.97331 0.24 
1 1 1 58  2  9  o 70.22443 8.415602 115.7348  344.6 17.47942       16.83120 0.95 
1 1 1 58  2  10 x ?        ?        103.6893  291.4 ?              ?        0.00 
1 1 1 58  4  0  o 51.24820 9.646311 37.11188  62.5  0.1238785      19.29262 0.57 
1 1 1 58  4  1  o 137.5488 4.859433 139.0488  36.2  -22.94282      9.718866 0.97 
1 1 1 58  4  2  o 48.07779 10.21002 42.94226  26.1  6.866524       20.42004 0.66 
1 1 1 58  4  3  o 75.17284 7.929175 89.29966  145.2 22.40854       15.85835 0.92 
1 1 1 58  4  4  o 44.24566 10.38316 43.28643  178.8 3.786610       20.76633 0.70 
1 1 1 58  4  5  o 86.56081 6.430649 78.52757  273.7 5.265564       12.86130 0.93 
1 1 1 58  4  6  o 47.96442 9.642636 38.84601  26.7  29.45089       19.28527 0.69 
1 1 1 58  4  7  o 41.28142 12.11276 7.998626  185.4 -1.935253      24.22552 0.17 
1 1 1 58  4  8  o 103.8912 6.863117 121.2576  138.8 ?              ?        0.97 
1 1 1 58  4  9  x ?        ?        6.303771  84.4  ?              ?        0.00 
1 1 1 58  6  0  o 31.31992 9.433204 14.71572  24.5  7.004114       18.86641 0.23 
1 1 1 58  6  1  o 99.12274 6.688716 99.07633  330.1 -10.36081      13.37743 0.96 
1 1 1 58  6  2  o 39.34854 9.995234 57.55352  279.8 -2.410412      19.99047 0.76 
1 1 1 58  6  3  o 46.92210 10.31283 48.33758  19.7  2.031200       20.62566 0.75 
1 1 1 58  6  4  o 39.25486 11.82537 51.49002  359.7 18.72214       23.65074 0.71 
1 1 1 58  6  5  o 37.08743 11.31630 45.18555  165.5 29.74821       22.63261 0.66 
1 1 1 58  6  6  o 32.46513 9.902469 26.11283  339.9 ?              ?        0.46 
1 1 1 58  6  7  x ?        ?        90.69624  8.1   ?              ?        0.00 
1 1 1 58  8  0  o 69.85120 9.023740 95.82348  298.7 -40.26517      18.04748 0.93 
1 1 1 58  8  1  o 35.59671 11.48001 33.06877  37.8  14.30437       22.96002 0.54 
1 1 1 58  8  2  o 51.10284 12.43846 90.98615  57.8  -14.19434      24.87691 0.90 
1 1 1 58  8  3  o 34.80685 11.09740 47.91191  59.9  ?              ?        0.71 
1 1 1 58  8  4  x ?        ?        68.17579  150.3 ?              ?        0.00 
1 1 1 59  1  0  o 129.3411 4.374256 168.7151  287.2 -10.97475      8.748511 0.97 
1 1 1 59  1  1  o 124.8015 4.765597 142.3877  10.3  -4.513527      9.531195 0.96 
1 1 1 59  1  2  o 56.88980 9.285059 33.58016  236.6 26.30012       18.57012 0.60 
1 1 1 59  1  3  o 28.34736 8.945692 8.728842  11.4  -2.037083      17.89138 0.11 
1 1 1 59  1  4  o 52.58961 9.758841 33.18739  100.1 -2.967834      19.51768 0.64 
1 1 1 59  1  5  o 56.88906 9.200277 69.20194  179.0 -23.78701      18.40055 0.87 
1 1 1 59  1  6  o 37.67374 10.21705 58.61741  318.8 1.230530       20.43410 0.73 
1 1 1 59  1  7  o 24.06050 7.959434 6.367215  303.6 2.697758       15.91887 0.08 
1 1 1 59  1  8  o 165.3640 4.356026 189.1490  173.5 -14.93744      8.712052 0.99 
1 1 1 59  1  9  o 47.17165 10.08210 47.01307  190.0 ?              ?        0.78 
1 1 1 59  3  0  o 51.20288 9.678648 54.10746  348.5 -2.009315      19.35730 0.71 
1 1 1 59  3  1  o 80.45143 7.440148 60.73800  112.5 -11.32845      14.88030 0.87 
1 1 1 59  3  2  o 80.81413 6.752733 70.12785  218.5 4.405937       13.50547 0.90 
1 1 1 59  3  3  o 46.19608 10.43704 50.55714  54.3  -6.558250      20.87408 0.74 
1 1 1 59  3  4  o 68.61708 8.257241 72.42330  301.3 26.65066       16.51448 0.90 
1 1 1 59  3  5  o 79.08529 7.883880 106.5020  240.0 25.70956       15.76776 0.94 
1 1 1 59  3  6  o 81.25806 6.888295 88.96796  307.9 -3.771812      13.77659 0.93 
1 1 1 59  3  7  o 28.83092 8.832905 36.56050  0.9   -0.1866150E-01 17.66581 0.51 
1 1 1 59  3  8  o 26.60271 9.200167 23.60961  114.2 ?              ?        0.36 
1 1 1 59  3  9  x ?        ?        52.63559  60.6  ?              ?        0.00 
1 1 1 59  5  0  f 31.77370 9.440775 34.19701  134.6 -6.596064      18.88155 0.00 
1 1 1 59  5  1  o 124.4378 5.394016 139.6148  3.0   -16.94178      10.78803 0.98 
1 1 1 59  5  2  o 32.27953 9.503573 36.50278  218.6 3.859482       19.00715 0.54 
1 1 1 59  5  3  o 32.04810 9.631333 33.72118  113.0 -6.080269      19.26267 0.50 
1 1 1 59  5  4  o 76.99306 7.802269 111.0746  347.3 -3.715660      15.60454 0.95 
1 1 1 59  5  5  o 31.45038 9.566132 16.87420  24.5  -3.766069      19.13226 0.28 
1 1 1 59  5  6  o 40.91250 11.59002 36.71207  195.8 2.552509       23.18004 0.64 
1 1 1 59  5  7  o 107.9426 7.785893 158.7308  164.8 ?              ?        0.98 
1 1 1 59  7  0  o 49.92388 9.890795 56.95747  173.7 21.83450       19.78159 0.82 
1 1 1 59  7  1  o 40.97600 9.680345 29.69559  129.1 20.77018       19.36069 0.56 
1 1 1 59  7  2  o 45.25552 10.47685 51.96597  249.6 14.67767       20.95371 0.78 
1 1 1 59  7  3  o 41.50156 12.33181 44.22145  176.5 28.08361       24.66363 0.70 
1 1 1 59  7  4  o 54.09109 11.51474 83.02936  168.7 ?              ?        0.90 
1 1 1 59  7  5  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 59  9  0  o 50.00871 11.96169 27.37446  72.5  ?              ?        0.65 
1 1 1 60  0  0  o 104.5385 8.445600 120.5559  180.0 0.000000       0.000000 1.00 
1 1 1 60  0  1  f 151.4913 6.068509 212.0931  0.0   0.000000       0.000000 0.00 
1 1 1 60  0  2  o 21.93849 14.43929 55.18518  0.0   0.000000       0.000000 0.49 
1 1 1 60  0  3  o 25.42335 15.60483 2.245588  180.0 0.000000       0.000000 0.03 
1 1 1 60  0  4  o 130.6895 7.399892 177.3591  0.0   0.000000       0.000000 1.00 
1 1 1 60  0  5  o 16.21861 11.55303 1.410480  0.0   0.000000       0.000000 0.01 
1 1 1 60  0  6  o 24.99559 15.77551 63.36602  180.0 0.000000       0.000000 0.65 
1 1 1 60  0  7  o 26.58544 16.23614 29.85234  0.0   0.000000       0.000000 0.39 
1 1 1 60  0  8  o 49.33589 15.79617 15.37395  180.0 ?              ?        0.41 
1 1 1 60  0  9  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 60  2  0  o 97.05238 5.866531 97.28596  207.2 -3.540100      11.73306 0.94 
1 1 1 60  2  1  o 82.42653 7.403389 119.5768  213.6 0.5690079      14.80678 0.94 
1 1 1 60  2  2  o 117.5990 4.783689 138.7760  212.4 15.36379       9.567377 0.97 
1 1 1 60  2  3  o 70.54263 7.834804 72.34035  254.2 11.75832       15.66961 0.91 
1 1 1 60  2  4  o 44.61995 10.39641 77.65655  165.7 -2.595810      20.79283 0.84 
1 1 1 60  2  5  o 115.9113 5.317135 148.2330  139.7 -2.558098      10.63427 0.97 
1 1 1 60  2  6  f 100.4919 5.953140 139.0750  171.6 -5.841591      11.90628 0.00 
1 1 1 60  2  7  o 113.9160 5.442623 146.7561  167.2 -17.23416      10.88525 0.98 
1 1 1 60  2  8  o 63.83008 8.423770 84.61557  206.0 ?              ?        0.92 
1 1 1 60  4  0  o 51.42594 10.28478 99.26833  210.5 7.205738       20.56956 0.89 
1 1 1 60  4  1  o 79.07928 7.524450 104.7339  306.4 8.205887       15.04890 0.94 
1 1 1 60  4  2  o 38.44109 9.857681 59.75489  26.4  -5.629505      19.71536 0.76 
1 1 1 60  4  3  o 90.33292 6.994856 109.0109  60.4  -15.51148      13.98971 0.95 
1 1 1 60  4  4  o 40.06869 10.46862 66.37266  234.3 -13.95337      20.93724 0.79 
1 1 1 60  4  5  o 52.10822 9.917126 100.3371  229.9 -2.045788      19.83425 0.91 
1 1 1 60  4  6  o 96.40147 6.341198 130.3566  296.0 ?              ?        0.97 
1 1 1 60  4  7  o 35.43228 10.35236 24.27789  304.2 ?              ?        0.47 
1 1 1 60  6  0  o 111.6827 5.474197 141.3803  158.7 -25.11216      10.94839 0.97 
1 1 1 60  6  1  o 67.43858 10.63998 83.62321  81.7  9.577793       21.27996 0.91 
1 1 1 60  6  2  o 42.57935 9.599627 25.21005  344.1 23.83488       19.19925 0.51 
1 1 1 60  6  3  o 33.45905 9.900842 62.72850  134.9 5.335773       19.80168 0.76 
1 1 1 60  6  4  o 29.64870 9.957038 39.08716  70.5  ?              ?        0.58 
1 1 1 60  6  5  x ?        ?        71.46557  74.4  ?              ?        0.00 
1 1 1 60  8  0  o 82.01257 7.855947 123.8931  275.5 ?              ?        0.96 
1 1 1 60  8  1  o 44.16464 13.02025 46.69620  258.3 ?              ?        0.76 
1 1 1 61  1  0  o 114.7243 5.904316 188.4275  188.1 -21.08688      11.80863 0.97 
1 1 1 61  1  1  o 48.73667 10.43242 87.46380  88.7  8.594982       20.86484 0.86 
1 1 1 61  1  2  o 87.87904 6.800050 65.11040  348.1 -3.288795      13.60010 0.92 
1 1 1 61  1  3  o 120.9665 4.930009 156.6337  303.1 22.54090       9.860018 0.98 
1 1 1 61  1  4  o 66.39906 8.655240 55.57761  43.0  17.25912       17.31048 0.86 
1 1 1 61  1  5  o 34.28877 9.759047 34.31115  116.2 8.930527       19.51809 0.52 
1 1 1 61  1  6  o 31.25061 9.635216 52.68230  73.6  -1.725883      19.27043 0.67 
1 1 1 61  1  7  o 49.40658 9.727939 66.55283  66.1  ?              ?        0.86 
1 1 1 61  1  8  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 61  3  0  o 54.72223 9.173157 25.29463  11.4  30.93151       18.34631 0.56 
1 1 1 61  3  1  o 42.12067 9.720729 66.00845  52.2  -28.78276      19.44146 0.81 
1 1 1 61  3  2  o 107.0858 5.669232 122.5198  113.4 -26.62390      11.33846 0.97 
1 1 1 61  3  3  o 36.65092 10.12262 74.02711  116.3 18.16894       20.24524 0.79 
1 1 1 61  3  4  o 54.62536 8.542457 56.28925  129.0 22.31462       17.08491 0.83 
1 1 1 61  3  5  o 49.53361 8.889591 50.35974  87.4  -33.93775      17.77918 0.80 
1 1 1 61  3  6  o 46.89494 10.54367 85.31859  184.5 ?              ?        0.89 
1 1 1 61  3  7  x ?        ?        53.37826  188.4 ?              ?        0.00 
1 1 1 61  5  0  o 55.25341 10.52091 84.73448  145.3 1.227093       21.04182 0.89 
1 1 1 61  5  1  o 38.59942 10.44010 24.79450  145.1 -19.13374      20.88019 0.45 
1 1 1 61  5  2  o 40.11135 9.724707 63.11177  153.9 16.96801       19.44941 0.79 
1 1 1 61  5  3  o 116.0930 5.853267 139.3383  124.3 3.830734       11.70653 0.98 
1 1 1 61  5  4  o 30.66481 9.675365 16.40275  228.3 ?              ?        0.29 
1 1 1 61  5  5  x ?        ?        128.4838  349.5 ?              ?        0.00 
1 1 1 61  7  0  o 34.23915 10.04647 50.72874  335.4 2.414288       20.09294 0.71 
1 1 1 61  7  1  f 54.75772 10.76778 85.16951  3.8   ?              ?        0.00 
1 1 1 61  7  2  o 31.34526 9.790304 22.28352  355.2 ?              ?        0.42 
1 1 1 62  0  0  o 84.33371 10.50465 61.59343  0.0   0.000000       0.000000 0.99 
1 1 1 62  0  1  o 49.95090 18.88476 89.22872  180.0 0.000000       0.000000 0.97 
1 1 1 62  0  2  o 29.72598 16.73787 13.31282  180.0 0.000000       0.000000 0.19 
1 1 1 62  0  3  o 62.16160 16.09076 50.40927  0.0   0.000000       0.000000 0.91 
1 1 1 62  0  4  o 21.87634 14.34886 25.02087  0.0   0.000000       0.000000 0.28 
1 1 1 62  0  5  o 23.98120 15.50860 29.02817  0.0   0.000000       0.000000 0.36 
1 1 1 62  0  6  f 19.57159 13.17235 16.98781  0.0   ?              ?        0.00 
1 1 1 62  0  7  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 62  2  0  o 94.73842 7.363579 97.73693  34.0  26.05318       14.72716 0.95 
1 1 1 62  2  1  o 134.5530 4.700059 137.0011  54.6  -3.925888      9.400119 0.98 
1 1 1 62  2  2  o 111.1971 6.047837 140.7200  50.1  -10.83199      12.09567 0.97 
1 1 1 62  2  3  o 52.60966 9.107631 80.22989  57.4  33.96159       18.21526 0.88 
1 1 1 62  2  4  o 37.76604 10.35756 38.06728  51.5  0.4672585      20.71513 0.60 
1 1 1 62  2  5  o 99.36015 6.147237 119.5835  331.1 -18.73095      12.29447 0.97 
1 1 1 62  2  6  o 87.22379 6.323003 96.07215  46.2  ?              ?        0.96 
1 1 1 62  4  0  o 103.9832 6.229644 127.0315  110.4 -3.626762      12.45929 0.97 
1 1 1 62  4  1  o 82.50060 7.205190 90.75584  206.3 -2.788010      14.41038 0.94 
1 1 1 62  4  2  o 84.91230 6.957267 111.9554  262.1 13.82680       13.91453 0.95 
1 1 1 62  4  3  o 40.37186 9.894598 52.45212  40.5  -28.59190      19.78920 0.75 
1 1 1 62  4  4  o 76.43011 7.121744 84.58075  97.0  ?              ?        0.94 
1 1 1 62  4  5  x ?        ?        69.01921  91.1  ?              ?        0.00 
1 1 1 62  6  0  o 36.59327 10.01291 21.58006  179.5 -16.14521      20.02583 0.42 
1 1 1 62  6  1  o 49.13707 10.43680 15.14709  139.2 -27.55215      20.87361 0.41 
1 1 1 62  6  2  o 31.15946 9.419102 36.95625  60.7  ?              ?        0.60 
1 1 1 62  6  3  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 63  1  0  o 38.27984 10.79962 61.07344  327.5 -2.780758      21.59924 0.75 
1 1 1 63  1  1  o 38.04383 10.26304 51.78287  95.1  -3.511951      20.52607 0.70 
1 1 1 63  1  2  o 97.23562 6.171513 123.5844  68.6  -20.51308      12.34303 0.96 
1 1 1 63  1  3  o 36.16756 10.64628 76.68221  91.8  10.97825       21.29256 0.80 
1 1 1 63  1  4  o 31.94344 9.764769 39.29643  173.8 -7.003960      19.52954 0.58 
1 1 1 63  1  5  f 30.01335 9.192410 22.05313  272.8 ?              ?        0.00 
1 1 1 63  3  0  o 33.13420 10.03111 40.91513  177.5 13.20230       20.06223 0.57 
1 1 1 63  3  1  o 70.93948 8.137016 97.60040  247.5 4.716293       16.27403 0.93 
1 1 1 63  3  2  o 83.59845 7.630346 93.80354  258.3 -10.37206      15.26069 0.94 
1 1 1 63  3  3  o 31.08459 9.519863 36.96091  171.1 10.09468       19.03973 0.55 
1 1 1 63  3  4  o 33.54791 9.923611 18.66389  276.2 ?              ?        0.36 
1 1 1 63  3  5  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 63  5  0  o 64.62291 10.62726 111.0915  337.3 -17.77158      21.25452 0.93 
1 1 1 63  5  1  o 123.9988 5.608638 149.4090  328.5 6.165703       11.21728 0.98 
1 1 1 63  5  2  o 82.58739 7.050245 90.93542  315.2 ?              ?        0.95 
1 1 1 63  5  3  x ?        ?        29.43761  94.5  ?              ?        0.00 
1 1 1 64  0  0  o 23.66386 15.31771 58.79400  0.0   0.000000       0.000000 0.61 
1 1 1 64  0  1  o 127.7705 7.858036 169.4010  0.0   0.000000       0.000000 1.00 
1 1 1 64  0  2  o 27.63085 16.69847 19.83439  0.0   0.000000       0.000000 0.27 
1 1 1 64  0  3  o 94.74908 8.581213 112.2222  180.0 0.000000       0.000000 1.00 
1 1 1 64  0  4  o 50.09124 18.73556 47.35189  0.0   ?              ?        0.86 
1 1 1 64  2  0  o 55.16721 10.28979 58.95446  170.6 -20.34494      20.57958 0.83 
1 1 1 64  2  1  f 30.34962 9.440756 23.69425  274.9 -11.11233      18.88151 0.00 
1 1 1 64  2  2  o 30.47852 9.401795 18.51254  265.6 -4.452497      18.80359 0.30 
1 1 1 64  2  3  o 42.80450 10.63559 10.00204  75.5  ?              ?        0.24 
1 1 1 64  2  4  x ?        ?        70.08382  251.8 ?              ?        0.00 
1 1 1 64  4  0  o 45.08094 10.97120 45.37772  73.6  -25.28469      21.94241 0.73 
1 1 1 64  4  1  o 42.80392 10.67856 80.88764  38.9  7.764938       21.35713 0.86 
1 1 1 64  4  2  o 65.13411 9.604139 61.95649  272.7 ?              ?        0.90 
1 1 1 64  4  3  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 64  6  0  x ?        ?        56.18932  46.9  ?              ?        0.00 
1 1 1 65  1  0  o 75.18689 7.659948 80.56976  204.1 0.6857071      15.31990 0.92 
1 1 1 65  1  1  o 64.72240 9.971741 89.88821  308.4 -17.82227      19.94348 0.92 
1 1 1 65  1  2  o 31.22400 9.208952 51.83348  256.5 ?              ?        0.69 
1 1 1 65  1  3  o 25.92121 8.707992 34.45547  281.9 ?              ?        0.50 
1 1 1 65  3  0  f 38.49753 9.960730 76.89713  32.9  19.79513       19.92146 0.00 
1 1 1 65  3  1  o 73.87216 8.327575 79.31991  79.1  ?              ?        0.93 
1 1 1 65  3  2  o 30.21143 9.484174 12.14147  41.9  ?              ?        0.23 
1 1 1 65  5  0  x ?        ?        146.6909  109.0 ?              ?        0.00 
1 1 1 66  0  0  o 43.33638 19.95540 77.05759  180.0 0.000000       0.000000 0.93 
1 1 1 66  0  1  o 71.39151 11.80402 47.47081  0.0   ?              ?        0.97 
1 1 1 66  0  2  x ?        ?        21.51440  180.0 ?              ?        0.00 
1 1 1 66  2  0  o 37.30972 10.13642 59.44017  193.5 ?              ?        0.78 
1 1 1 66  2  1  o 63.42397 10.27546 70.68887  82.3  ?              ?        0.90 
1 1 1 66  2  2  x ?        ?        ?         ?     ?              ?        ?    
1 1 1 66  4  0  x ?        ?        29.26004  263.5 ?              ?        0.00 
1 1 1 67  1  0  o 46.51569 10.60323 59.70321  87.3  ?              ?        0.84 
1 1 1 67  1  1  x ?        ?        ?         ?     ?              ?        ?    
# 
#END OF REFLECTIONS
