data_r4tk2sf
# 
_audit.revision_id     1_0 
_audit.creation_date   2014-12-24 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      4tk2 
_cell.length_a      164.5095 
_cell.length_b      164.5095 
_cell.length_c      129.4290 
_cell.angle_alpha   90.0000 
_cell.angle_beta    90.0000 
_cell.angle_gamma   120.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.93927 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   3.547 
_diffrn_reflns.pdbx_d_res_low    142.469 
_diffrn_reflns.limit_h_max       39 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       39 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       36 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            23624 
_diffrn_reflns.pdbx_number_obs   15704 
# 
_entry.id   4tk2 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               4tk2 
_symmetry.space_group_name_H-M   "P 61" 
_symmetry.Int_Tables_number      169 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 "X,  Y,  Z"         
2 "Y,  -X+Y,  Z+5/6"  
3 "X-Y,  X,  Z+1/6"   
4 "-X+Y,  -X,  Z+2/3" 
5 "-X,  -Y,  Z+1/2"   
6 "-Y,  X-Y,  Z+1/3"  
# 
loop_
_refln.crystal_id 
_refln.wavelength_id 
_refln.scale_group_code 
_refln.index_h 
_refln.index_k 
_refln.index_l 
_refln.status 
_refln.F_meas_au 
_refln.F_meas_sigma_au 
_refln.intensity_meas 
_refln.intensity_sigma 
_refln.pdbx_I_plus 
_refln.pdbx_I_plus_sigma 
_refln.pdbx_I_minus 
_refln.pdbx_I_minus_sigma 
_refln.pdbx_F_plus 
_refln.pdbx_F_plus_sigma 
_refln.pdbx_F_minus 
_refln.pdbx_F_minus_sigma 
_refln.pdbx_anom_difference 
_refln.pdbx_anom_difference_sigma 
1 1 1 0  0  6  o 75.664 1.1043 5740.40  167.106 5683.90   235.513 5797.67   237.143 75.288 1.5641 76.039 1.5594 -0.7503967     2.208600  
1 1 1 0  0  12 o 97.872 1.3526 9608.74  264.693 9288.55   370.523 9942.44   378.262 96.206 1.9257 99.539 1.9001 -3.333427      2.705274  
1 1 1 0  0  18 o 22.581 0.6990 510.164  31.410  442.290   43.012  587.716   45.976  20.975 1.0253 24.187 0.9504 -3.212664      1.398062  
1 1 1 0  0  24 o 38.917 0.8198 1533.24  63.641  1541.40   87.074  1523.89   93.245  39.045 1.1151 38.788 1.2020 0.2567863      1.639535  
1 1 1 0  0  30 o 9.1063 1.2449 95.060   20.172  104.231   24.307  74.773    36.152  10.071 1.2068 8.1415 2.1778 1.929560       2.489781  
1 1 1 0  0  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  3  o 16.788 0.4418 282.410  14.831  288.326   20.985  276.507   20.962  16.964 0.6185 16.612 0.6309 0.3519650      0.8835256 
1 1 1 0  1  4  o 7.6766 0.3322 57.991   5.0572  50.364    6.6686  68.315    7.7583  7.0927 0.4701 8.2606 0.4696 -1.167908      0.6644689 
1 1 1 0  1  5  o 17.903 0.2928 321.080  10.277  321.096   13.281  321.056   16.223  17.907 0.3708 17.900 0.4532 0.7165909E-02  0.5855576 
1 1 1 0  1  6  o 26.397 0.3118 700.563  16.102  711.902   20.812  683.657   25.413  26.668 0.3902 26.126 0.4863 0.5417137      0.6235353 
1 1 1 0  1  7  o 2.4388 0.3546 6.0792   1.7029  4.8115    2.3620  7.4516    2.4575  2.1499 0.5478 2.7276 0.4505 -0.5776191     0.7092080 
1 1 1 0  1  8  o 20.143 0.2653 406.351  10.679  424.432   15.101  388.266   15.103  20.592 0.3667 19.694 0.3834 0.8977299      0.5305492 
1 1 1 0  1  9  o 23.820 0.2726 568.138  12.976  538.286   18.232  598.780   18.472  23.186 0.3932 24.455 0.3777 -1.269384      0.5451699 
1 1 1 0  1  10 o 22.654 0.2706 513.703  12.255  495.893   17.216  532.001   17.450  22.256 0.3868 23.052 0.3785 -0.7966022     0.5411529 
1 1 1 0  1  11 o 21.013 0.2689 442.077  11.298  446.312   15.876  437.730   16.082  21.115 0.3759 20.911 0.3845 0.2044868      0.5377733 
1 1 1 0  1  12 o 18.479 0.2665 341.617  9.8473  334.202   13.776  349.362   14.081  18.274 0.3769 18.684 0.3768 -0.4098701     0.5329981 
1 1 1 0  1  13 o 22.069 0.2739 488.213  12.074  511.827   16.941  463.837   17.212  22.613 0.3746 21.525 0.3998 1.087610       0.5478843 
1 1 1 0  1  14 o 19.136 0.2721 367.566  10.387  390.695   14.533  343.418   14.850  19.754 0.3679 18.518 0.4010 1.235830       0.5441372 
1 1 1 0  1  15 o 38.570 0.3163 1491.51  24.384  1536.83   34.310  1445.26   34.662  39.164 0.4380 37.976 0.4564 1.187927       0.6325645 
1 1 1 0  1  16 o 19.372 0.2776 377.366  10.721  399.322   14.907  353.837   15.432  19.960 0.3734 18.784 0.4108 1.175722       0.5551324 
1 1 1 0  1  17 o 5.3824 0.3803 28.677   4.0597  25.075    5.3503  33.565    6.2328  4.9908 0.5360 5.7739 0.5397 -0.7831149     0.7606835 
1 1 1 0  1  18 o 8.1443 0.3256 66.343   5.2677  63.420    6.9952  70.170    8.0059  7.9406 0.4405 8.3481 0.4795 -0.4074411     0.6511070 
1 1 1 0  1  19 o 10.031 0.3132 101.084  6.2397  99.188    8.3139  103.530   9.4419  9.9271 0.4187 10.134 0.4658 -0.2071981     0.6263850 
1 1 1 0  1  20 o 14.485 0.2995 214.144  8.5603  235.441   11.603  188.704   12.681  15.296 0.3793 13.673 0.4637 1.623162       0.5990663 
1 1 1 0  1  21 o 8.7368 0.3543 78.564   6.0281  83.501    7.8422  71.434    9.4242  9.0926 0.4312 8.3810 0.5622 0.7116213      0.7085736 
1 1 1 0  1  22 o 4.8712 0.5090 23.848   4.8511  21.773    6.1471  27.274    7.8986  4.6071 0.6671 5.1353 0.7691 -0.5281496     1.018094  
1 1 1 0  1  23 o 5.2661 0.5074 26.904   5.1853  20.961    6.4933  37.366    8.6149  4.5098 0.7199 6.0224 0.7152 -1.512619      1.014801  
1 1 1 0  1  24 o 10.154 0.3681 107.536  7.1936  118.016   9.3001  91.926    11.350  10.810 0.4302 9.4975 0.5975 1.312592       0.7362545 
1 1 1 0  1  25 o 2.0007 0.6281 -4.0426  4.6954  -7.0100   5.6141  2.8639    8.5650  1.4602 0.6958 2.5412 1.0459 -1.080965      1.256226  
1 1 1 0  1  26 o 12.763 0.3506 165.484  8.7053  167.182   11.129  162.806   13.974  12.867 0.4324 12.659 0.5519 0.2078962      0.7011461 
1 1 1 0  1  27 o 10.472 0.3895 111.028  7.8245  109.824   9.7521  113.205   13.109  10.417 0.4681 10.527 0.6226 -0.1106758     0.7789620 
1 1 1 0  1  28 o 11.747 0.3809 137.822  8.5671  131.381   10.570  150.160   14.627  11.383 0.4643 12.111 0.6039 -0.7284994     0.7617382 
1 1 1 0  1  29 o 4.5107 0.7365 26.348   6.3551  31.477    7.4022  11.968    12.394  5.5175 0.6708 3.5040 1.3115 2.013559       1.473095  
1 1 1 0  1  30 f 4.2575 0.7301 25.105   6.4419  30.754    7.3856  7.1403    13.171  5.4034 0.6834 3.1115 1.2904 2.291869       1.460177  
1 1 1 0  1  31 o 4.8823 0.8148 25.911   6.9650  22.758    7.9856  35.935    14.239  4.4612 0.9253 5.3034 1.3415 -0.8422174     1.629679  
1 1 1 0  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  2  o 19.768 0.4603 391.867  18.199  394.321   25.746  389.417   25.728  19.830 0.6492 19.706 0.6528 0.1239967      0.9206208 
1 1 1 0  2  3  o 20.056 0.4587 403.011  18.397  394.943   26.010  411.089   26.025  19.854 0.6550 20.257 0.6424 -0.4025021     0.9174348 
1 1 1 0  2  4  o 18.273 0.4527 334.780  16.543  331.857   23.375  337.712   23.416  18.193 0.6424 18.353 0.6379 -0.1601315     0.9053573 
1 1 1 0  2  5  o 18.574 0.4533 346.241  16.838  339.033   23.765  353.507   23.860  18.379 0.6465 18.769 0.6356 -0.3893471     0.9066495 
1 1 1 0  2  6  o 25.695 0.4774 662.249  24.533  656.218   34.634  668.322   34.755  25.578 0.6770 25.813 0.6732 -0.2352581     0.9547679 
1 1 1 0  2  7  o 18.451 0.3961 339.889  13.861  336.879   17.044  345.766   23.817  18.338 0.4647 18.564 0.6415 -0.2257710     0.7921132 
1 1 1 0  2  8  o 14.790 0.3583 223.603  10.355  246.706   13.737  193.202   15.758  15.696 0.4376 13.883 0.5675 1.812479       0.7166295 
1 1 1 0  2  9  o 9.0537 0.3296 82.120   5.9597  88.276    8.5084  76.192    8.3503  9.3872 0.4532 8.7201 0.4788 0.6670523      0.6592627 
1 1 1 0  2  10 o 30.180 0.3247 910.623  19.239  920.644   30.328  903.875   24.888  30.315 0.5002 30.046 0.4142 0.2688313      0.6494268 
1 1 1 0  2  11 o 70.785 0.4359 5023.76  61.700  4909.74   86.864  5139.87   87.656  69.973 0.6207 71.597 0.6121 -1.623810      0.8717687 
1 1 1 0  2  12 o 84.403 0.5184 7143.34  87.146  7172.92   129.445 7118.81   117.855 84.551 0.7655 84.255 0.6994 0.2961731      1.036884  
1 1 1 0  2  13 o 49.549 0.3534 2459.45  35.016  2477.95   49.489  2440.91   49.552  49.736 0.4975 49.363 0.5019 0.3737984      0.7067161 
1 1 1 0  2  14 f 5.2233 0.3397 27.263   3.5427  25.987    4.8467  28.727    5.1913  5.0925 0.4759 5.3541 0.4848 -0.2615418     0.6793212 
1 1 1 0  2  15 o 36.221 0.3111 1314.68  22.535  1321.99   31.715  1307.22   32.027  36.324 0.4366 36.119 0.4434 0.2045860      0.6222141 
1 1 1 0  2  16 o 9.6890 0.2970 95.117   5.6974  105.884   7.8491  83.126    8.2830  10.277 0.3819 9.1010 0.4551 1.175994       0.5940611 
1 1 1 0  2  17 o 11.817 0.2961 142.308  6.8938  163.100   9.4915  119.094   10.029  12.749 0.3722 10.885 0.4607 1.864679       0.5922911 
1 1 1 0  2  18 o 7.8441 0.3319 62.046   5.1649  62.914    6.9090  60.946    7.7764  7.9098 0.4367 7.7784 0.4999 0.1313825      0.6637823 
1 1 1 0  2  19 o 15.675 0.2903 247.094  9.0760  245.537   12.371  248.908   13.357  15.625 0.3959 15.725 0.4247 -0.1000862     0.5805984 
1 1 1 0  2  20 o 4.4316 0.5271 21.275   4.3305  23.895    5.5581  17.229    6.9082  4.8537 0.5726 4.0094 0.8852 0.8443179      1.054205  
1 1 1 0  2  21 f 11.455 0.3216 133.471  7.2791  138.369   9.6861  127.115   11.034  11.709 0.4136 11.201 0.4925 0.5077991      0.6431658 
1 1 1 0  2  22 o 2.2866 0.6161 3.7412   4.1266  6.5135    5.1373  -1.3012   6.9284  2.5558 0.8548 2.0174 0.8874 0.5383937      1.232156  
1 1 1 0  2  23 o 11.370 0.3339 130.682  7.5039  129.098   9.8617  132.861   11.565  11.299 0.4364 11.441 0.5054 -0.1419811     0.6677237 
1 1 1 0  2  24 o 19.819 0.3086 396.682  12.157  395.603   16.297  398.037   18.255  19.800 0.4115 19.838 0.4601 -0.3848839E-01 0.6172930 
1 1 1 0  2  25 o 9.0764 0.4033 86.554   6.9652  94.404    8.8590  73.846    11.272  9.6609 0.4585 8.4919 0.6637 1.168997       0.8066611 
1 1 1 0  2  26 f 10.867 0.3804 122.920  7.8945  131.732   10.018  108.484   12.823  11.421 0.4386 10.313 0.6217 1.107879       0.7608476 
1 1 1 0  2  27 o 8.9801 0.4195 79.499   7.2278  73.218    8.8896  91.749    12.415  8.4930 0.5233 9.4672 0.6557 -0.9742136     0.8389438 
1 1 1 0  2  28 o 9.8277 0.4197 99.594   7.7931  101.314   9.6192  96.309    13.294  9.9900 0.4814 9.6653 0.6877 0.3247147      0.8394844 
1 1 1 0  2  29 o 7.1304 0.5556 54.084   7.1028  55.286    8.4372  51.160    13.160  7.3434 0.5745 6.9173 0.9512 0.4260898      1.111251  
1 1 1 0  2  30 o 5.6236 0.7476 44.730   7.0351  54.149    8.2596  19.836    13.427  7.2246 0.5716 4.0226 1.3817 3.202055       1.495268  
1 1 1 0  2  31 o 6.7771 0.6499 49.208   8.5135  43.949    10.555  59.000    14.403  6.3409 0.8323 7.2133 0.9984 -0.8723803     1.299772  
1 1 1 0  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  2  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  3  0  o 17.957 0.6802 327.579  23.943  393.251   34.346  265.492   33.396  19.749 0.8735 16.166 1.0429 -0.000000      0.000000  
1 1 1 0  3  1  o 25.012 0.4875 627.301  24.389  627.833   34.509  626.769   34.474  25.023 0.6895 25.001 0.6894 0.2121162E-01  0.9750929 
1 1 1 0  3  2  o 11.697 0.4509 137.121  10.542  142.787   14.922  131.477   14.894  11.939 0.6249 11.456 0.6501 0.4834223      0.9017314 
1 1 1 0  3  3  o 42.804 0.5684 1838.11  48.653  1867.19   68.966  1809.30   68.646  43.141 0.7993 42.466 0.8082 0.6755486      1.136719  
1 1 1 0  3  4  o 20.710 0.4658 430.737  19.286  418.101   27.246  443.425   27.303  20.404 0.6677 21.015 0.6496 -0.6112289     0.9315460 
1 1 1 0  3  5  o 19.936 0.4633 398.696  18.475  400.770   26.142  396.626   26.113  19.988 0.6539 19.884 0.6566 0.1038456      0.9266997 
1 1 1 0  3  6  o 22.101 0.4696 489.967  20.758  486.684   29.323  493.265   29.391  22.027 0.6656 22.176 0.6627 -0.1487350     0.9392506 
1 1 1 0  3  7  o 12.316 0.4580 152.169  11.279  153.777   15.886  150.536   16.015  12.381 0.6415 12.250 0.6537 0.1319113      0.9159067 
1 1 1 0  3  8  o 16.311 0.4599 266.886  15.003  262.642   21.115  271.213   21.322  16.180 0.6525 16.442 0.6484 -0.2622452     0.9198684 
1 1 1 0  3  9  o 39.293 0.5483 1552.28  43.087  1563.46   60.898  1541.06   60.970  39.435 0.7721 39.150 0.7787 0.2852898      1.096586  
1 1 1 0  3  10 o 34.579 0.4563 1197.52  29.860  1194.54   36.691  1203.37   51.382  34.530 0.5313 34.627 0.7419 -0.9692383E-01 0.9125431 
1 1 1 0  3  11 o 52.167 0.4451 2728.79  46.441  2729.88   65.772  2727.71   65.584  52.178 0.6303 52.157 0.6287 0.2041626E-01  0.8902402 
1 1 1 0  3  12 o 18.278 0.3344 334.503  12.223  335.222   17.343  333.792   17.231  18.297 0.4739 18.258 0.4719 0.3894997E-01  0.6687694 
1 1 1 0  3  13 o 43.742 0.4084 1918.33  35.712  1854.25   50.443  1982.71   50.565  43.008 0.5864 44.476 0.5685 -1.468113      0.8167316 
1 1 1 0  3  14 o 8.5721 0.3598 73.656   6.1630  77.785    8.7800  69.645    8.6529  8.8094 0.4983 8.3348 0.5191 0.4745245      0.7195732 
1 1 1 0  3  15 o 8.7570 0.3625 76.883   6.3487  78.014    9.0625  75.793    8.8966  8.8201 0.5137 8.6938 0.5117 0.1263590      0.7250720 
1 1 1 0  3  16 f 14.509 0.3414 211.402  9.9045  216.235   14.069  206.653   13.946  14.674 0.4794 14.344 0.4861 0.3296442      0.6827255 
1 1 1 0  3  17 o 12.775 0.3494 164.276  8.9271  164.295   12.598  164.257   12.652  12.776 0.4930 12.775 0.4952 0.1840591E-02  0.6987739 
1 1 1 0  3  18 o 10.970 0.3532 121.599  7.7150  116.154   11.306  126.343   10.554  10.735 0.5266 11.205 0.4710 -0.4698343     0.7064903 
1 1 1 0  3  19 o 4.2682 0.5573 18.806   4.6387  22.242    6.8557  15.906    6.2996  4.6695 0.7341 3.8669 0.8387 0.8026061      1.114587  
1 1 1 0  3  20 o 11.551 0.3285 134.652  7.5875  140.024   10.826  129.467   10.637  11.779 0.4596 11.324 0.4697 0.4550152      0.6570975 
1 1 1 0  3  21 f 5.9853 0.4390 38.135   4.9982  43.481    6.4714  30.231    7.8689  6.5502 0.4940 5.4204 0.7259 1.129829       0.8779999 
1 1 1 0  3  22 o 3.6254 0.6292 14.666   4.4573  16.055    5.5998  12.265    7.3636  3.8813 0.7485 3.3694 1.0116 0.5118759      1.258436  
1 1 1 0  3  23 o 5.6777 0.4732 32.907   5.2424  32.360    6.6946  33.775    8.4293  5.6319 0.5944 5.7235 0.7364 -0.9159422E-01 0.9463153 
1 1 1 0  3  24 o 13.094 0.3411 178.363  8.6638  200.661   11.446  148.453   13.257  14.103 0.4058 12.086 0.5484 2.016694       0.6822582 
1 1 1 0  3  25 o 2.4135 0.6709 1.3324   4.6386  -2.0442   5.5547  9.1124    8.4317  1.7445 0.7794 3.0826 1.0924 -1.338098      1.341890  
1 1 1 0  3  26 f 18.537 0.3223 346.111  11.821  339.483   15.553  355.175   18.188  18.340 0.4240 18.733 0.4855 -0.3923779     0.6445720 
1 1 1 0  3  27 o 18.743 0.3312 360.393  12.157  384.724   16.008  327.243   18.685  19.526 0.4099 17.960 0.5202 1.566711       0.6623018 
1 1 1 0  3  28 o 12.249 0.3818 154.226  8.9585  157.758   11.247  148.094   14.818  12.477 0.4507 12.020 0.6164 0.4570570      0.7635794 
1 1 1 0  3  29 o 14.154 0.3749 206.707  10.145  211.869   12.716  197.668   16.827  14.446 0.4401 13.861 0.6070 0.5857830      0.7497616 
1 1 1 0  3  30 o 3.1506 0.8456 9.1502   6.1838  8.5133    6.8747  11.850    14.154  2.8406 0.9879 3.4606 1.3726 -0.6199787     1.691179  
1 1 1 0  3  31 o 3.6431 0.7614 17.646   6.4281  21.788    7.3670  4.4287    13.159  4.3867 0.8704 2.8994 1.2496 1.487287       1.522834  
1 1 1 0  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  3  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  4  0  o 42.884 0.8202 1848.31  70.226  1877.79   99.960  1819.58   98.682  43.223 1.1582 42.546 1.1617 -0.000000      0.000000  
1 1 1 0  4  1  o 39.607 0.5584 1573.11  44.230  1577.33   62.603  1568.91   62.499  39.660 0.7892 39.553 0.7901 0.1061935      1.116742  
1 1 1 0  4  2  o 24.987 0.4881 625.951  24.394  627.925   34.493  623.975   34.504  25.027 0.6891 24.948 0.6915 0.7906532E-01  0.9762697 
1 1 1 0  4  3  o 33.890 0.5248 1154.08  35.573  1148.23   50.323  1159.92   50.294  33.803 0.7443 33.976 0.7401 -0.1726494     1.049690  
1 1 1 0  4  4  o 15.289 0.4601 234.611  14.069  230.327   19.841  238.943   19.953  15.149 0.6549 15.430 0.6465 -0.2814589     0.9202726 
1 1 1 0  4  5  o 25.596 0.4863 657.237  24.889  671.510   35.271  643.080   35.127  25.874 0.6816 25.319 0.6937 0.5550194      0.9725162 
1 1 1 0  4  6  o 22.560 0.4769 510.803  21.516  506.068   30.404  515.554   30.453  22.455 0.6770 22.665 0.6718 -0.2100868     0.9537410 
1 1 1 0  4  7  o 11.530 0.4689 133.386  10.811  136.059   15.266  130.696   15.312  11.647 0.6554 11.414 0.6707 0.2326622      0.9377710 
1 1 1 0  4  8  f 28.618 0.4998 822.364  28.595  850.484   40.540  794.522   40.339  29.106 0.6964 28.129 0.7170 0.9771709      0.9995627 
1 1 1 0  4  9  o 39.840 0.5535 1595.90  44.102  1572.64   62.151  1619.49   62.591  39.547 0.7858 40.134 0.7798 -0.5864754     1.107031  
1 1 1 0  4  10 o 20.834 0.4790 435.251  19.958  426.611   27.982  444.198   28.475  20.623 0.6784 21.044 0.6765 -0.4209881     0.9580877 
1 1 1 0  4  11 o 50.262 0.6164 2538.09  61.956  2475.50   87.095  2602.21   88.152  49.634 0.8774 50.891 0.8661 -1.257580      1.232838  
1 1 1 0  4  12 o 22.182 0.4845 493.300  21.492  480.475   30.081  506.674   30.717  21.887 0.6872 22.477 0.6833 -0.5892010     0.9690876 
1 1 1 0  4  13 o 38.120 0.3919 1456.53  29.876  1443.28   42.284  1469.73   42.219  37.946 0.5572 38.293 0.5513 -0.3471375     0.7837837 
1 1 1 0  4  14 o 11.402 0.3523 130.693  8.0113  120.943   11.446  140.058   11.217  10.983 0.5211 11.822 0.4744 -0.8387203     0.7046938 
1 1 1 0  4  15 o 19.637 0.3437 386.561  13.496  395.774   19.259  377.671   18.918  19.867 0.4847 19.407 0.4874 0.4599762      0.6873697 
1 1 1 0  4  16 o 9.8811 0.3654 98.070   7.2145  103.706   10.337  92.717    10.074  10.159 0.5088 9.6037 0.5245 0.5548000      0.7307112 
1 1 1 0  4  17 o 9.1341 0.3824 84.305   6.9747  79.906    9.9615  88.535    9.7688  8.8972 0.5598 9.3711 0.5212 -0.4739180     0.7648932 
1 1 1 0  4  18 o 7.4570 0.4247 56.446   6.3061  51.139    9.0110  61.540    8.8281  7.1074 0.6339 7.8065 0.5654 -0.6990881     0.8494445 
1 1 1 0  4  19 o 18.163 0.3537 333.233  12.846  327.363   18.228  339.027   18.108  18.002 0.5063 18.324 0.4941 -0.3222847     0.7074113 
1 1 1 0  4  20 o 3.0849 0.7047 9.7451   4.9573  9.2836    6.9726  10.217    7.0495  3.0281 0.9952 3.1417 0.9981 -0.1135700     1.409485  
1 1 1 0  4  21 o 4.6488 0.6414 23.610   5.7793  31.183    8.1026  15.767    8.2457  5.5026 0.7363 3.7951 1.0506 1.707446       1.282886  
1 1 1 0  4  22 o 10.750 0.4085 118.025  8.7465  104.902   12.248  131.681   12.494  10.129 0.6046 11.370 0.5494 -1.241182      0.8169435 
1 1 1 0  4  23 o 8.8663 0.4538 80.182   8.0349  74.560    11.077  86.424    11.673  8.5370 0.6488 9.1956 0.6347 -0.6585865     0.9075854 
1 1 1 0  4  24 o 2.8147 0.6837 4.5703   5.9277  15.053    7.8747  -9.1355   9.0044  3.7128 1.0262 1.9166 0.9037 1.796177       1.367420  
1 1 1 0  4  25 o 20.940 0.3808 444.110  15.928  428.410   21.904  461.730   23.204  20.551 0.5329 21.329 0.5440 -0.7778854     0.7615196 
1 1 1 0  4  26 o 10.851 0.4940 122.379  10.557  102.243   15.319  140.589   14.568  9.9608 0.7690 11.741 0.6204 -1.780295      0.9880281 
1 1 1 0  4  27 o 9.8174 0.4938 99.526   9.5203  102.890   12.476  94.836    14.730  10.043 0.6212 9.5919 0.7678 0.4509354      0.9876173 
1 1 1 0  4  28 o 3.3386 0.8420 11.322   7.5108  15.924    8.7047  -2.0866   14.859  3.7889 1.0901 2.8884 1.2836 0.9004695      1.684020  
1 1 1 0  4  29 f 5.1437 0.8269 30.705   8.2169  32.915    10.249  26.727    13.748  5.5486 0.9235 4.7387 1.3719 0.8098540      1.653799  
1 1 1 0  4  30 o 9.6462 0.5546 98.653   10.347  96.487    13.031  102.349   17.022  9.5804 0.6801 9.7120 0.8763 -0.1316071     1.109266  
1 1 1 0  4  31 o 7.6326 0.7514 71.583   9.9603  80.133    12.328  55.512    16.902  8.6456 0.7130 6.6196 1.3230 2.025993       1.502842  
1 1 1 0  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  4  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  5  0  o 12.245 0.6764 153.170  16.328  149.246   23.028  157.137   23.155  12.081 0.9673 12.408 0.9457 -0.000000      0.000000  
1 1 1 0  5  1  o 31.477 0.5209 995.245  32.782  1025.26   46.518  965.636   46.206  31.951 0.7280 31.004 0.7452 0.9460964      1.041719  
1 1 1 0  5  2  o 6.4399 0.5089 41.686   6.5545  41.190    9.2499  42.186    9.2892  6.4013 0.7225 6.4785 0.7169 -0.7718229E-01 1.017832  
1 1 1 0  5  3  o 22.207 0.4813 495.030  21.377  497.174   30.266  492.896   30.198  22.255 0.6800 22.159 0.6814 0.9611893E-01  0.9626522 
1 1 1 0  5  4  o 12.226 0.4681 149.949  11.443  145.713   16.194  154.173   16.171  12.053 0.6718 12.399 0.6521 -0.3460178     0.9362385 
1 1 1 0  5  5  o 16.548 0.4689 274.702  15.520  275.156   21.933  274.246   21.963  16.561 0.6622 16.534 0.6642 0.2755356E-01  0.9378744 
1 1 1 0  5  6  o 12.206 0.4771 149.806  11.621  159.541   16.302  139.750   16.569  12.611 0.6463 11.800 0.7021 0.8113937      0.9542989 
1 1 1 0  5  7  o 4.6262 0.6668 22.379   5.9410  23.101    8.0732  21.526    8.7743  4.7165 0.8884 4.5358 0.9946 0.1806579      1.333636  
1 1 1 0  5  8  o 12.270 0.4813 151.154  11.808  151.031   16.513  151.284   16.892  12.265 0.6731 12.275 0.6881 -0.9197235E-02 0.9626083 
1 1 1 0  5  9  o 22.808 0.4859 522.070  22.160  507.270   31.251  537.035   31.427  22.482 0.6950 23.134 0.6792 -0.6520557     0.9718026 
1 1 1 0  5  10 o 8.7245 0.5343 76.722   9.2870  82.518    12.941  70.567    13.335  9.0675 0.7136 8.3815 0.7955 0.6859531      1.068674  
1 1 1 0  5  11 o 16.181 0.4871 262.518  15.730  239.719   21.984  286.437   22.517  15.460 0.7110 16.902 0.6661 -1.442508      0.9742594 
1 1 1 0  5  12 o 52.474 0.6341 2768.30  66.551  2767.20   93.940  2769.40   94.296  52.464 0.8953 52.484 0.8983 -0.1984406E-01 1.268283  
1 1 1 0  5  13 o 13.182 0.5006 174.490  13.183  174.360   18.214  174.632   19.104  13.178 0.6911 13.186 0.7244 -0.7691383E-02 1.001154  
1 1 1 0  5  14 o 17.975 0.4933 324.772  17.726  328.956   24.814  320.412   25.330  18.095 0.6857 17.856 0.7093 0.2394466      0.9865211 
1 1 1 0  5  15 o 7.0754 0.6167 50.349   8.6483  41.646    11.825  60.357    12.681  6.4168 0.9214 7.7340 0.8198 -1.317198      1.233326  
1 1 1 0  5  16 o 14.332 0.3551 206.376  10.176  208.764   14.556  204.093   14.232  14.413 0.5050 14.252 0.4993 0.1613903      0.7101362 
1 1 1 0  5  17 o 7.5206 0.4681 55.978   6.9509  46.345    9.0828  69.595    10.799  6.7571 0.6721 8.2840 0.6518 -1.526886      0.9362223 
1 1 1 0  5  18 o 10.304 0.3832 107.436  7.8791  104.594   11.451  109.992   10.858  10.170 0.5630 10.438 0.5201 -0.2676334     0.7664760 
1 1 1 0  5  19 o 6.7196 0.4632 46.421   6.1639  41.366    9.0188  50.852    8.4439  6.3627 0.7087 7.0766 0.5966 -0.7139411     0.9264071 
1 1 1 0  5  20 o 10.117 0.4013 103.976  8.1106  101.369   11.670  106.413   11.281  9.9900 0.5841 10.244 0.5506 -0.2543640     0.8026596 
1 1 1 0  5  21 o 12.045 0.3919 147.635  9.4334  142.512   13.454  152.589   13.231  11.834 0.5684 12.256 0.5398 -0.4216433     0.7838610 
1 1 1 0  5  22 o 5.6169 0.5706 32.801   6.4003  34.850    9.0541  30.754    9.0487  5.7991 0.7806 5.4347 0.8325 0.3644767      1.141250  
1 1 1 0  5  23 o 3.9901 0.7596 17.486   6.2030  16.506    8.8326  18.440    8.7135  3.8818 1.0919 4.0983 1.0564 -0.2164681     1.519251  
1 1 1 0  5  24 o 5.5202 0.7683 38.092   7.9792  17.316    12.945  50.823    10.133  4.0149 1.3569 7.0255 0.7212 -3.010573      1.536637  
1 1 1 0  5  25 o 8.9114 0.4850 81.429   8.6194  84.573    11.902  77.962    12.499  9.1018 0.6538 8.7209 0.7166 0.3808975      0.9700680 
1 1 1 0  5  26 o 9.7302 0.4754 97.904   9.1484  107.214   12.480  87.092    13.450  10.256 0.6085 9.2048 0.7306 1.050869       0.9507728 
1 1 1 0  5  27 o 11.351 0.4616 130.686  10.438  119.886   14.021  144.115   15.634  10.832 0.6472 11.871 0.6585 -1.039729      0.9232931 
1 1 1 0  5  28 o 7.7361 0.5895 61.411   9.0263  53.774    11.789  72.233    14.033  7.1712 0.8220 8.3010 0.8453 -1.129799      1.179008  
1 1 1 0  5  29 o 5.0032 0.8373 26.998   8.3218  17.688    10.613  41.857    13.408  3.9322 1.2212 6.0742 1.1457 -2.141979      1.674551  
1 1 1 0  5  30 o 5.2581 0.8240 36.723   8.8921  48.766    11.215  16.331    14.593  6.7301 0.8332 3.7861 1.4219 2.944001       1.648034  
1 1 1 0  5  31 o 8.3803 0.6407 79.726   10.214  82.899    12.864  74.314    16.800  8.7644 0.7339 7.9962 1.0505 0.7682071      1.281444  
1 1 1 0  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  5  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  6  0  o 6.3736 0.9707 52.153   10.109  76.515    13.854  24.413    14.784  8.6206 0.8207 4.1266 1.7593 -0.000000      0.000000  
1 1 1 0  6  1  o 33.695 0.5332 1140.37  35.934  1138.63   50.849  1142.10   50.789  33.669 0.7551 33.721 0.7531 -0.5169296E-01 1.066471  
1 1 1 0  6  2  o 10.310 0.4873 106.653  10.048  108.244   14.234  105.072   14.187  10.387 0.6852 10.233 0.6932 0.1537457      0.9746717 
1 1 1 0  6  3  o 22.927 0.4882 527.340  22.385  537.139   31.684  517.574   31.631  23.140 0.6846 22.714 0.6963 0.4265728      0.9764941 
1 1 1 0  6  4  o 34.147 0.5323 1170.86  36.352  1175.82   51.428  1165.92   51.390  34.220 0.7514 34.075 0.7541 0.1448555      1.064553  
1 1 1 0  6  5  o 16.181 0.4785 262.815  15.475  251.283   21.821  274.482   21.949  15.822 0.6896 16.539 0.6636 -0.7165098     0.9569762 
1 1 1 0  6  6  o 8.7977 0.5188 78.119   9.0700  87.219    12.725  68.722    12.931  9.3236 0.6824 8.2718 0.7817 1.051806       1.037623  
1 1 1 0  6  7  o 18.290 0.4800 335.816  17.554  344.583   24.839  327.070   24.810  18.529 0.6703 18.050 0.6873 0.4786682      0.9599934 
1 1 1 0  6  8  o 22.374 0.4892 502.774  21.888  496.438   30.908  509.148   31.001  22.232 0.6951 22.516 0.6884 -0.2837257     0.9783080 
1 1 1 0  6  9  f 26.113 0.4988 684.047  26.044  668.404   36.677  699.957   36.989  25.811 0.7105 26.415 0.7002 -0.6034489     0.9975000 
1 1 1 0  6  10 o 25.417 0.4995 648.182  25.392  649.134   35.745  647.212   36.076  25.436 0.7026 25.398 0.7102 0.3858948E-01  0.9990698 
1 1 1 0  6  11 o 13.585 0.5001 184.890  13.576  174.824   18.881  195.666   19.535  13.202 0.7151 13.968 0.6993 -0.7657595     1.000142  
1 1 1 0  6  12 o 4.3030 0.8029 19.250   6.9757  18.379    9.3365  20.352    10.495  4.1935 1.0997 4.4125 1.1701 -0.2189622     1.605772  
1 1 1 0  6  13 o 37.669 0.5520 1426.33  41.573  1374.09   58.279  1480.45   59.322  36.965 0.7883 38.373 0.7730 -1.408176      1.104029  
1 1 1 0  6  14 o 8.8989 0.5664 79.608   10.071  77.541    13.875  81.908    14.639  8.7778 0.7904 9.0201 0.8115 -0.2422523     1.132783  
1 1 1 0  6  15 o 9.9012 0.5543 98.855   10.956  96.572    14.982  101.480   16.063  9.7807 0.7659 10.022 0.8014 -0.2409744     1.108549  
1 1 1 0  6  16 o 9.6596 0.5682 94.372   10.943  91.905    14.827  97.323    16.218  9.5254 0.7783 9.7939 0.8280 -0.2685614     1.136360  
1 1 1 0  6  17 o 10.497 0.5681 112.864  11.863  116.456   16.136  108.639   17.501  10.693 0.7546 10.302 0.8494 0.3901758      1.136138  
1 1 1 0  6  18 f 3.2869 0.6393 11.781   4.3680  8.9312    6.9593  13.633    5.6109  2.9940 0.9948 3.5798 0.8034 -0.5858438     1.278680  
1 1 1 0  6  19 o 14.950 0.3713 226.914  11.068  214.284   15.988  238.535   15.336  14.541 0.5498 15.359 0.4993 -0.8187389     0.7426448 
1 1 1 0  6  20 o 2.3691 0.6749 2.9821   4.8560  3.5967    7.5307  2.5446    6.3533  2.4890 0.9966 2.2492 0.9102 0.2398205      1.349714  
1 1 1 0  6  21 o 4.5144 0.6594 22.297   5.7948  17.790    8.7415  25.829    7.7398  4.0253 1.0681 5.0034 0.7735 -0.9780693     1.318771  
1 1 1 0  6  22 o 5.4129 0.5724 30.599   6.1345  28.997    9.1971  31.882    8.2336  5.2682 0.8729 5.5575 0.7408 -0.2892647     1.144840  
1 1 1 0  6  23 o 5.3717 0.6382 30.721   6.6399  28.095    9.7444  32.997    9.0722  5.0940 0.9921 5.6493 0.8029 -0.5553188     1.276334  
1 1 1 0  6  24 o 7.7498 0.5240 62.718   7.9853  50.373    11.369  74.737    11.218  6.9622 0.8165 8.5374 0.6570 -1.575181      1.048007  
1 1 1 0  6  25 o 10.569 0.4533 114.532  9.4849  95.442    13.333  134.093   13.496  9.6560 0.6904 11.482 0.5877 -1.825921      0.9066625 
1 1 1 0  6  26 o 7.0660 0.5540 51.612   7.8196  52.501    10.849  50.650    11.281  7.1361 0.7601 6.9960 0.8063 0.1400738      1.108092  
1 1 1 0  6  27 o 8.8450 0.5192 80.154   9.1576  72.770    12.473  88.790    13.489  8.4025 0.7422 9.2874 0.7262 -0.8848495     1.038355  
1 1 1 0  6  28 o 4.0561 0.8138 17.470   7.2723  9.6759    9.7387  27.295    10.934  3.1865 1.1681 4.9257 1.1334 -1.739159      1.627589  
1 1 1 0  6  29 o 5.4684 0.7847 34.487   8.2804  38.980    10.903  28.363    12.728  6.0361 0.9032 4.9006 1.2834 1.135442       1.569343  
1 1 1 0  6  30 o 2.7159 0.8158 0.3132   7.8379  -6.2424   9.9936  10.790    12.634  2.1136 0.9820 3.3181 1.3029 -1.204434      1.631532  
1 1 1 0  6  31 o 9.0922 0.6073 91.867   10.839  92.069    14.115  91.578    16.923  9.1959 0.7675 8.9885 0.9414 0.2074642      1.214556  
1 1 1 0  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  6  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  7  0  o 4.4375 0.9976 24.592   8.4846  14.551    11.290  37.624    12.862  3.1341 1.5284 5.7409 1.2825 -0.000000      0.000000  
1 1 1 0  7  1  o 22.537 0.4933 509.587  22.234  508.998   31.520  510.171   31.368  22.524 0.6997 22.550 0.6955 -0.2637672E-01 0.9865832 
1 1 1 0  7  2  o 9.4698 0.4982 90.000   9.4338  87.773    13.318  92.243    13.365  9.3518 0.7121 9.5877 0.6970 -0.2359123     0.9963973 
1 1 1 0  7  3  o 11.738 0.4899 138.353  11.487  147.018   16.315  129.835   16.177  12.103 0.6740 11.372 0.7113 0.7315836      0.9798847 
1 1 1 0  7  4  o 32.522 0.5273 1062.08  34.296  1073.22   48.610  1051.04   48.395  32.692 0.7435 32.352 0.7479 0.3404274      1.054589  
1 1 1 0  7  5  o 14.408 0.4876 208.280  14.050  205.245   19.782  211.369   19.958  14.302 0.6916 14.514 0.6875 -0.2120991     0.9752012 
1 1 1 0  7  6  o 18.141 0.4867 330.488  17.637  351.544   25.046  309.779   24.839  18.716 0.6691 17.566 0.7070 1.150566       0.9734576 
1 1 1 0  7  7  o 13.067 0.4972 171.513  12.991  171.788   18.152  171.225   18.599  13.078 0.6940 13.055 0.7123 0.2299213E-01  0.9944804 
1 1 1 0  7  8  o 17.555 0.4875 309.323  17.111  317.040   24.094  301.470   24.305  17.777 0.6777 17.333 0.7011 0.4439659      0.9750761 
1 1 1 0  7  9  o 18.759 0.4914 353.190  18.431  358.833   25.935  347.431   26.199  18.911 0.6857 18.607 0.7040 0.3045788      0.9827770 
1 1 1 0  7  10 o 18.055 0.4949 326.845  17.870  318.564   25.040  335.440   25.510  17.822 0.7025 18.289 0.6974 -0.4663620     0.9898965 
1 1 1 0  7  11 o 37.045 0.5495 1377.66  40.711  1359.74   57.305  1395.91   57.846  36.802 0.7786 37.289 0.7757 -0.4868202     1.098997  
1 1 1 0  7  12 o 30.817 0.5237 953.603  32.277  941.184   45.381  966.317   45.917  30.614 0.7412 31.020 0.7401 -0.4062328     1.047446  
1 1 1 0  7  13 o 19.670 0.4994 388.478  19.606  355.015   27.303  424.104   28.172  18.794 0.7264 20.547 0.6855 -1.753187      0.9987952 
1 1 1 0  7  14 o 5.5447 0.7603 32.323   8.1804  38.046    11.240  25.878    11.928  6.1395 0.9154 4.9498 1.2141 1.189752       1.520528  
1 1 1 0  7  15 o 4.1504 0.8490 18.325   7.7902  24.190    10.339  10.624    11.848  4.7717 1.1051 3.5291 1.2892 1.242634       1.698020  
1 1 1 0  7  16 o 14.542 0.5210 213.994  15.119  195.159   20.864  234.818   21.938  13.866 0.7524 15.219 0.7208 -1.353022      1.041919  
1 1 1 0  7  17 o 4.9957 0.7744 29.121   8.4817  46.293    11.193  5.9662    12.998  6.7371 0.8307 3.2543 1.3071 3.482827       1.548764  
1 1 1 0  7  18 o 7.6363 0.6923 61.144   10.382  65.610    13.795  55.310    15.766  7.9911 0.8632 7.2815 1.0826 0.7095709      1.384611  
1 1 1 0  7  19 o 5.0293 0.8982 28.404   9.3652  37.851    13.013  18.254    13.489  5.9003 1.1440 4.1583 1.3851 1.742058       1.796442  
1 1 1 0  7  20 o 7.6551 0.5280 60.240   8.0208  59.490    10.674  61.212    12.156  7.6137 0.7010 7.6966 0.7897 -0.8296537E-01 1.055940  
1 1 1 0  7  21 o 4.3535 0.6956 20.395   6.5435  33.989    9.3939  7.5832    9.1199  5.7235 0.8206 2.9834 1.1234 2.740142       1.391189  
1 1 1 0  7  22 o 5.1174 0.6532 28.774   6.3211  23.936    9.8196  32.198    8.2600  4.6506 1.0769 5.5841 0.7396 -0.9335628     1.306455  
1 1 1 0  7  23 f 3.6555 0.7779 14.574   6.1641  12.584    9.5192  16.011    8.0890  3.4828 1.1637 3.8281 1.0327 -0.3452349     1.555837  
1 1 1 0  7  24 o 8.8847 0.4880 82.025   8.5677  71.556    12.526  91.228    11.745  8.3234 0.7525 9.4460 0.6217 -1.122517      0.9760605 
1 1 1 0  7  25 o 3.7647 0.7674 15.481   6.2989  10.432    9.1950  19.946    8.6464  3.2591 1.1420 4.2703 1.0253 -1.011197      1.534769  
1 1 1 0  7  26 o 5.6568 0.6879 34.539   7.4820  27.430    10.624  41.535    10.539  4.9890 1.0948 6.3246 0.8332 -1.335534      1.375767  
1 1 1 0  7  27 o 16.172 0.4182 267.052  13.522  256.976   18.945  277.514   19.306  15.858 0.5973 16.486 0.5855 -0.6284676     0.8364433 
1 1 1 0  7  28 o 13.539 0.4479 188.330  12.122  182.788   16.862  194.259   17.440  13.333 0.6323 13.744 0.6345 -0.4107447     0.8957568 
1 1 1 0  7  29 o 7.4710 0.6255 59.845   9.3178  59.259    12.675  60.535    13.745  7.4504 0.8506 7.4916 0.9174 -0.4120064E-01 1.251031  
1 1 1 0  7  30 f 4.1075 0.8854 19.152   8.5692  8.9152    11.454  32.168    12.915  3.1083 1.2342 5.1068 1.2699 -1.998505      1.770794  
1 1 1 0  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  8  0  o 24.023 0.7140 583.314  34.078  631.528   48.282  535.453   48.106  25.028 0.9679 23.018 1.0499 -0.000000      0.000000  
1 1 1 0  8  1  o 28.319 0.4227 804.350  23.925  843.092   33.992  766.316   33.680  28.996 0.5861 27.642 0.6092 1.354803       0.8454195 
1 1 1 0  8  2  o 22.618 0.4971 513.476  22.487  512.705   31.819  514.246   31.784  22.601 0.7039 22.635 0.7021 -0.3415680E-01 0.9941872 
1 1 1 0  8  3  o 12.919 0.4953 167.549  12.794  172.280   18.049  162.772   18.138  13.103 0.6887 12.735 0.7121 0.3681936      0.9906763 
1 1 1 0  8  4  o 20.621 0.4924 426.755  20.308  431.893   28.729  421.623   28.710  20.745 0.6924 20.496 0.7004 0.2489700      0.9848740 
1 1 1 0  8  5  o 25.683 0.5052 662.375  25.946  674.461   36.735  650.344   36.651  25.918 0.7087 25.449 0.7201 0.4692783      1.010327  
1 1 1 0  8  6  o 6.3877 0.6286 41.091   8.0295  41.008    11.282  41.177    11.430  6.3813 0.8840 6.3940 0.8938 -0.1269817E-01 1.257120  
1 1 1 0  8  7  o 2.8600 0.7331 4.5149   6.1772  12.673    8.4823  -4.6976   9.0135  3.5456 1.0902 2.1743 0.9803 1.371281       1.466159  
1 1 1 0  8  8  o 23.115 0.5009 536.312  23.151  549.125   32.673  523.393   32.809  23.394 0.6983 22.837 0.7183 0.5569420      1.001840  
1 1 1 0  8  9  f 41.554 0.5756 1734.04  47.833  1741.83   67.653  1726.25   67.641  41.648 0.8122 41.460 0.8157 0.1875191      1.151117  
1 1 1 0  8  10 o 20.745 0.5001 431.441  20.733  409.381   29.014  454.461   29.639  20.202 0.7181 21.288 0.6962 -1.085209      1.000134  
1 1 1 0  8  11 o 10.396 0.5462 108.558  11.316  96.808    15.803  120.924   16.212  9.8169 0.8049 10.976 0.7385 -1.158708      1.092382  
1 1 1 0  8  12 o 20.046 0.5039 403.497  20.195  390.774   28.284  416.729   28.845  19.723 0.7170 20.369 0.7081 -0.6456108     1.007717  
1 1 1 0  8  13 o 38.415 0.5622 1484.38  43.163  1408.57   60.383  1563.59   61.723  37.409 0.8071 39.421 0.7829 -2.012310      1.124384  
1 1 1 0  8  14 o 12.534 0.5409 157.564  13.513  141.243   18.415  176.606   19.891  11.833 0.7781 13.236 0.7514 -1.402523      1.081704  
1 1 1 0  8  15 o 9.2529 0.8700 86.884   16.100  0.0000    0.0000  86.884    16.100  ?      ?      9.2529 0.8700 ?              ?         
1 1 1 0  8  16 o 8.4002 0.6359 72.079   10.646  64.471    14.535  80.885    15.638  7.9199 0.9176 8.8805 0.8805 -0.9606352     1.271714  
1 1 1 0  8  17 o 8.2150 0.9469 69.548   15.557  0.0000    0.0000  69.548    15.557  ?      ?      8.2150 0.9469 ?              ?         
1 1 1 0  8  18 o 9.9432 0.8386 101.719  16.676  101.719   16.676  0.0000    0.0000  9.9432 0.8386 ?      ?      ?              ?         
1 1 1 0  8  19 o 10.445 0.6249 112.768  13.002  111.498   17.587  114.300   19.308  10.394 0.8460 10.495 0.9199 -0.1002111     1.249731  
1 1 1 0  8  20 o 6.6022 0.8543 48.135   10.878  50.631    14.481  44.903    16.480  6.9093 1.0479 6.2951 1.3495 0.6142464      1.708591  
1 1 1 0  8  21 f 3.9377 0.8034 12.265   9.6128  34.698    12.589  -19.1111  14.888  5.5768 1.1662 2.2987 1.1053 3.278040       1.606776  
1 1 1 0  8  22 o 6.1058 0.8781 42.687   9.3676  44.515    10.979  37.794    17.962  6.5417 0.8391 5.6700 1.5428 0.8716965      1.756276  
1 1 1 0  8  23 o 8.3642 0.4986 71.069   8.2896  78.898    12.613  65.116    10.999  8.7608 0.7199 7.9676 0.6902 0.7931213      0.9972814 
1 1 1 0  8  24 o 9.8356 0.4733 100.350  9.1771  88.883    13.653  109.802   12.395  9.2925 0.7346 10.379 0.5971 -1.086092      0.9466939 
1 1 1 0  8  25 o 12.129 0.4436 149.958  10.743  153.083   15.718  147.218   14.719  12.242 0.6419 12.017 0.6124 0.2254772      0.8872223 
1 1 1 0  8  26 o 4.4847 0.7578 21.572   6.8441  30.765    10.313  14.335    9.1493  5.3243 1.0053 3.6451 1.1342 1.679255       1.515597  
1 1 1 0  8  27 o 10.151 0.4933 106.550  9.9880  100.138   14.332  112.605   13.927  9.8399 0.7282 10.463 0.6655 -0.6231146     0.9865569 
1 1 1 0  8  28 o 3.1139 0.7584 6.4568   7.0106  -6.8367   10.088  18.873    9.7496  2.1444 0.9929 4.0834 1.1467 -1.939053      1.516792  
1 1 1 0  8  29 o 2.9595 0.7969 3.1709   7.8414  17.773    11.167  -11.0342  11.014  3.8650 1.2589 2.0539 0.9775 1.811154       1.593872  
1 1 1 0  8  30 o 3.5760 0.8890 14.771   8.3597  21.007    11.332  7.3254    12.382  4.1123 1.2594 3.0396 1.2551 1.072677       1.778020  
1 1 1 0  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  8  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  9  0  o 2.9476 1.0624 12.806   8.2248  15.918    10.549  7.9840    13.134  3.3049 1.4891 2.5903 1.5158 -0.000000      0.000000  
1 1 1 0  9  1  o 9.0648 0.5301 82.558   9.6047  79.729    13.647  85.334    13.520  8.9100 0.7658 9.2195 0.7332 -0.3095198     1.060238  
1 1 1 0  9  2  o 19.790 0.4971 393.083  19.676  393.244   27.872  392.923   27.780  19.793 0.7041 19.786 0.7020 0.7854462E-02  0.9942647 
1 1 1 0  9  3  o 20.020 0.4998 402.438  20.006  394.664   28.365  410.134   28.221  19.826 0.7153 20.213 0.6981 -0.3867626     0.9995281 
1 1 1 0  9  4  o 9.5413 0.5457 91.992   10.322  106.351   14.628  77.753    14.566  10.291 0.7107 8.7921 0.8284 1.498478       1.091497  
1 1 1 0  9  5  o 43.146 0.5863 1873.28  50.594  1876.68   71.636  1869.91   71.466  43.185 0.8294 43.107 0.8289 0.7779312E-01  1.172630  
1 1 1 0  9  6  o 21.122 0.5011 447.729  21.168  440.772   29.784  454.829   30.090  20.956 0.7106 21.288 0.7067 -0.3319740     1.002229  
1 1 1 0  9  7  o 17.400 0.5047 304.396  17.516  329.742   24.748  278.954   24.794  18.130 0.6825 16.670 0.7437 1.459557       1.009394  
1 1 1 0  9  8  o 15.771 0.5121 249.878  16.131  260.743   22.619  238.632   23.011  16.122 0.7015 15.420 0.7462 0.7019587      1.024156  
1 1 1 0  9  9  o 13.309 0.5295 177.466  14.084  169.152   19.527  186.482   20.334  12.985 0.7519 13.634 0.7457 -0.6492891     1.058981  
1 1 1 0  9  10 o 23.721 0.5121 564.711  24.264  527.300   34.032  603.392   34.605  22.920 0.7424 24.523 0.7056 -1.602474      1.024199  
1 1 1 0  9  11 o 38.816 0.5642 1514.29  43.794  1487.13   61.621  1542.00   62.252  38.463 0.8010 39.168 0.7947 -0.7047386     1.128348  
1 1 1 0  9  12 o 12.789 0.5322 164.413  13.607  162.639   18.950  166.302   19.552  12.719 0.7450 12.860 0.7602 -0.1409988     1.064377  
1 1 1 0  9  13 o 18.032 0.5140 326.467  18.506  300.663   25.642  354.519   26.736  17.287 0.7417 18.776 0.7120 -1.488985      1.028079  
1 1 1 0  9  14 o 15.308 0.5319 236.313  16.241  212.839   22.488  261.904   23.480  14.510 0.7749 16.106 0.7289 -1.595825      1.063880  
1 1 1 0  9  15 o 20.599 0.5239 429.983  21.583  425.128   30.366  434.939   30.681  20.482 0.7413 20.717 0.7405 -0.2353001     1.047777  
1 1 1 0  9  16 o 5.0417 1.1017 26.223   10.872  25.395    12.350  29.077    22.920  4.8319 1.2636 5.2514 1.8051 -0.4194627     2.203446  
1 1 1 0  9  17 o 9.5643 0.6404 95.654   12.067  106.617   16.426  82.798    17.787  10.199 0.8053 8.9300 0.9959 1.268726       1.280763  
1 1 1 0  9  18 o 12.141 0.6143 157.244  14.368  193.402   19.666  115.851   21.042  13.751 0.7151 10.531 0.9990 3.219587       1.228606  
1 1 1 0  9  19 o 5.9145 0.8750 41.467   10.502  61.222    14.214  17.715    15.585  7.6647 0.9272 4.1644 1.4841 3.500338       1.749953  
1 1 1 0  9  20 o 3.8275 0.9938 13.983   9.9560  11.785    13.435  16.660    14.828  3.6149 1.3630 4.0401 1.4468 -0.4251409     1.987700  
1 1 1 0  9  21 o 1.9044 0.6633 -24.3603 8.8389  -23.0946  11.681  -26.0559  13.520  1.8314 0.9018 1.9773 0.9730 -0.1458549     1.326617  
1 1 1 0  9  22 o 4.7962 1.0646 26.271   11.841  33.731    15.823  16.777    17.851  5.4197 1.4366 4.1727 1.5716 1.246958       2.129225  
1 1 1 0  9  23 o 3.2652 0.9777 3.8507   10.996  6.4552    14.191  -0.0637   17.397  3.3030 1.3514 3.2275 1.4132 0.7556319E-01  1.955343  
1 1 1 0  9  24 o 9.6355 0.6901 91.129   12.289  82.216    14.519  113.646   23.076  8.9229 0.8136 10.348 1.1150 -1.425249      1.380253  
1 1 1 0  9  25 o 5.5793 0.7295 34.945   7.6024  27.107    12.078  40.087    9.7833  4.9257 1.2298 6.2329 0.7848 -1.307226      1.458915  
1 1 1 0  9  26 o 9.8875 0.5164 101.709  10.060  91.125    15.063  110.230   13.516  9.3899 0.8021 10.385 0.6507 -0.9952507     1.032842  
1 1 1 0  9  27 o 15.667 0.4644 253.620  14.364  244.705   21.911  260.338   19.022  15.386 0.7120 15.948 0.5964 -0.5615625     0.9287790 
1 1 1 0  9  28 o 4.2481 0.8168 19.467   7.7911  32.780    11.564  8.3996    10.543  5.3886 1.1099 3.1077 1.1986 2.280955       1.633574  
1 1 1 0  9  29 o 2.2600 0.7230 -5.0218  7.1455  2.4815    10.713  -11.0349  9.5904  2.6448 1.1334 1.8753 0.8979 0.7694799      1.445952  
1 1 1 0  9  30 o 7.6131 0.6574 64.792   10.003  64.578    14.388  64.992    13.916  7.5845 0.9485 7.6416 0.9105 -0.5709457E-01 1.314843  
1 1 1 0  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  9  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  10 0  o 40.018 0.8153 1615.43  65.023  1729.76   92.377  1503.15   91.543  41.436 1.1165 38.601 1.1883 -0.000000      0.000000  
1 1 1 0  10 1  o 32.273 0.5361 1046.73  34.604  1033.93   48.906  1059.56   48.968  32.075 0.7624 32.472 0.7540 -0.3967667     1.072251  
1 1 1 0  10 2  f 30.278 0.5291 921.309  32.042  917.125   45.329  925.487   45.299  30.209 0.7503 30.347 0.7463 -0.1381741     1.058260  
1 1 1 0  10 3  o 26.591 0.5163 710.538  27.457  716.506   38.890  704.605   38.771  26.703 0.7282 26.479 0.7321 0.2233772      1.032589  
1 1 1 0  10 4  o 40.309 0.5741 1633.72  46.275  1668.50   65.688  1599.45   65.201  40.736 0.8063 39.882 0.8174 0.8548584      1.148150  
1 1 1 0  10 5  o 13.562 0.5163 184.604  14.003  186.709   19.737  182.471   19.870  13.641 0.7235 13.484 0.7368 0.1565475      1.032583  
1 1 1 0  10 6  o 12.811 0.5300 164.800  13.574  158.820   19.152  170.835   19.240  12.577 0.7614 13.045 0.7374 -0.4686689     1.059979  
1 1 1 0  10 7  o 29.953 0.5273 900.471  31.588  915.508   44.714  885.489   44.631  30.204 0.7402 29.703 0.7513 0.5009041      1.054683  
1 1 1 0  10 8  o 35.055 0.5502 1233.04  38.571  1208.40   54.340  1258.06   54.757  34.701 0.7830 35.408 0.7732 -0.7074280     1.100425  
1 1 1 0  10 9  o 14.316 0.5278 205.186  15.060  182.655   20.783  230.099   21.854  13.489 0.7704 15.143 0.7216 -1.654400      1.055578  
1 1 1 0  10 10 o 15.129 0.5221 229.695  15.793  223.072   22.038  236.685   22.642  14.905 0.7393 15.353 0.7374 -0.4481955     1.044186  
1 1 1 0  10 11 o 3.7263 0.8566 11.894   8.0392  21.912    11.469  2.2161    11.272  4.5711 1.2282 2.8815 1.1942 1.689685       1.713123  
1 1 1 0  10 12 o 14.535 0.6767 209.016  18.369  225.016   32.951  201.802   22.125  14.908 1.1052 14.162 0.7812 0.7460661      1.353395  
1 1 1 0  10 13 o 14.591 0.5406 214.739  15.772  210.889   22.058  218.765   22.559  14.457 0.7629 14.724 0.7660 -0.2669296     1.081123  
1 1 1 0  10 14 o 2.8168 0.8744 -1.5422  8.6719  -0.4651   10.212  -4.3272   16.421  2.5662 1.1034 3.0673 1.3569 -0.5011053     1.748856  
1 1 1 0  10 15 o 12.430 0.5794 157.185  14.358  140.753   19.643  176.036   21.040  11.730 0.8373 13.131 0.8012 -1.400504      1.158855  
1 1 1 0  10 16 o 12.774 0.5747 166.676  14.660  169.453   20.303  163.650   21.191  12.893 0.7874 12.654 0.8373 0.2384634      1.149368  
1 1 1 0  10 17 o 7.8301 0.7234 64.538   11.176  71.432    15.231  56.497    16.449  8.3188 0.9154 7.3414 1.1203 0.9774156      1.446735  
1 1 1 0  10 18 o 8.8172 0.7139 84.020   12.093  101.835   16.371  62.626    17.940  9.9455 0.8230 7.6888 1.1666 2.256766       1.427737  
1 1 1 0  10 19 o 10.525 0.6621 117.068  13.793  127.589   18.846  104.933   20.241  11.081 0.8504 9.9698 1.0151 1.111268       1.324240  
1 1 1 0  10 20 o 9.2875 0.7346 93.942   13.206  112.430   17.999  72.388    19.434  10.386 0.8665 8.1893 1.1866 2.196426       1.469298  
1 1 1 0  10 21 o 4.5294 1.0033 18.770   11.260  3.6448    14.648  40.616    17.604  3.1714 1.3409 5.8875 1.4929 -2.716115      2.006691  
1 1 1 0  10 22 o 9.5133 0.7757 94.556   14.627  82.169    19.250  111.475   22.498  8.7903 1.0950 10.236 1.0989 -1.446037      1.551336  
1 1 1 0  10 23 o 12.868 0.6902 175.983  17.531  183.469   23.356  166.323   26.533  13.246 0.8816 12.489 1.0622 0.7566910      1.380444  
1 1 1 0  10 24 o 8.2236 0.9434 72.751   15.032  62.255    19.590  87.780    23.443  7.4582 1.3636 8.9889 1.3040 -1.530655      1.886722  
1 1 1 0  10 25 o 3.7496 1.0871 3.1895   13.476  -9.0666   17.286  22.181    21.517  2.8704 1.3184 4.6288 1.7289 -1.758329      2.174276  
1 1 1 0  10 26 o 4.7905 0.8693 30.165   11.079  44.737    12.581  -20.1727  23.382  6.5219 0.9645 3.0591 1.4466 3.462839       1.738663  
1 1 1 0  10 27 o 18.797 0.4349 363.854  16.273  344.145   23.770  381.240   22.326  18.288 0.6499 19.306 0.5782 -1.017052      0.8698564 
1 1 1 0  10 28 o 10.400 0.5275 113.330  10.900  112.313   16.318  114.150   14.647  10.330 0.7898 10.471 0.6994 -0.1406641     1.055004  
1 1 1 0  10 29 o 8.3557 0.6117 74.515   10.129  89.951    15.300  62.471    13.514  9.1352 0.8374 7.5763 0.8919 1.558886       1.223415  
1 1 1 0  10 30 o 5.0727 0.9061 33.340   9.2336  29.649    13.808  36.326    12.419  4.7154 1.3777 5.4301 1.1774 -0.7147312     1.812299  
1 1 1 0  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  10 35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  11 0  o 8.9829 0.9965 85.502   15.051  53.787    19.747  129.469   23.250  6.7591 1.6884 11.207 1.0590 -0.000000      0.000000  
1 1 1 0  11 1  o 25.068 0.5154 630.952  25.842  637.174   36.663  624.810   36.429  25.191 0.7277 24.945 0.7302 0.2459526      1.030892  
1 1 1 0  11 2  o 22.225 0.4158 495.221  18.479  500.207   26.006  490.136   26.262  22.339 0.5821 22.111 0.5939 0.2271233      0.8315570 
1 1 1 0  11 3  o 30.786 0.5361 951.275  33.010  960.732   46.899  941.990   46.470  30.938 0.7580 30.635 0.7585 0.3033237      1.072263  
1 1 1 0  11 4  o 34.602 0.5489 1202.27  37.986  1197.68   53.716  1206.87   53.724  34.535 0.7777 34.668 0.7748 -0.1328506     1.097807  
1 1 1 0  11 5  o 18.521 0.5167 344.356  19.136  353.470   27.137  335.341   26.988  18.766 0.7230 18.277 0.7383 0.4890366      1.033391  
1 1 1 0  11 6  o 20.435 0.5118 418.924  20.912  408.341   29.431  429.717   29.720  20.174 0.7294 20.696 0.7180 -0.5223637     1.023516  
1 1 1 0  11 7  o 18.712 0.5153 351.161  19.278  338.157   27.070  364.542   27.461  18.360 0.7372 19.065 0.7202 -0.7041874     1.030594  
1 1 1 0  11 8  o 9.7194 0.5936 94.803   11.523  88.121    16.031  101.946   16.576  9.3645 0.8559 10.074 0.8227 -0.7097178     1.187184  
1 1 1 0  11 9  o 16.924 0.5209 287.525  17.629  281.032   24.749  294.211   25.116  16.730 0.7397 17.118 0.7336 -0.3883400     1.041774  
1 1 1 0  11 10 o 19.017 0.6295 367.777  22.851  352.189   38.112  376.526   28.553  18.678 1.0202 19.356 0.7376 -0.6781750     1.258919  
1 1 1 0  11 11 o 25.018 0.5265 629.301  26.323  597.460   36.960  662.075   37.498  24.373 0.7582 25.662 0.7306 -1.289385      1.052925  
1 1 1 0  11 12 o 10.526 0.6077 112.406  12.728  122.862   17.761  101.368   18.248  11.038 0.8045 10.015 0.9111 1.023654       1.215444  
1 1 1 0  11 13 o 7.0600 0.7741 51.308   10.604  43.165    14.432  60.865    15.633  6.3935 1.1718 7.7265 1.0117 -1.332998      1.548117  
1 1 1 0  11 14 o 14.081 0.5581 200.873  15.673  180.788   21.551  223.424   22.835  13.331 0.8083 14.831 0.7698 -1.500501      1.116248  
1 1 1 0  11 15 o 12.309 0.5871 154.722  14.417  155.696   19.738  153.608   21.109  12.360 0.7984 12.259 0.8610 0.1018562      1.174210  
1 1 1 0  11 16 o 15.402 0.8156 243.310  25.123  0.0000    0.0000  243.310   25.123  ?      ?      15.402 0.8156 ?              ?         
1 1 1 0  11 17 o 9.0725 0.6940 86.423   12.480  91.461    16.910  80.396    18.495  9.3947 0.9000 8.7503 1.0568 0.6444168      1.388100  
1 1 1 0  11 18 o 11.458 0.6402 137.495  14.527  154.692   20.212  119.119   20.893  12.241 0.8256 10.675 0.9787 1.566794       1.280360  
1 1 1 0  11 19 o 8.5285 1.0482 72.018   15.586  60.634    17.891  107.846   31.739  7.5016 1.1925 9.5553 1.7243 -2.053677      2.096463  
1 1 1 0  11 20 f 6.0449 0.9682 43.758   12.267  62.459    16.673  21.689    18.112  7.6303 1.0925 4.4595 1.5988 3.170828       1.936421  
1 1 1 0  11 21 o 10.365 0.7351 113.601  15.203  110.310   20.690  117.463   22.415  10.217 1.0125 10.513 1.0661 -0.2954521     1.470262  
1 1 1 0  11 22 o 3.7951 1.0773 10.782   12.434  12.792    16.214  7.9112    19.373  3.8361 1.4845 3.7540 1.5616 0.8207130E-01  2.154575  
1 1 1 0  11 23 o 6.4093 1.1353 47.953   14.349  45.584    18.676  51.366    22.418  6.2661 1.5084 6.5524 1.6971 -0.2863240     2.270558  
1 1 1 0  11 24 o 10.134 0.8772 115.367  16.879  133.681   22.091  89.678    26.163  11.283 0.9790 8.9850 1.4559 2.297808       1.754447  
1 1 1 0  11 25 o 5.7919 1.1842 36.984   15.175  20.611    19.751  60.570    23.706  4.4662 1.6588 7.1176 1.6904 -2.651427      2.368357  
1 1 1 0  11 26 o 7.3732 1.1120 70.029   16.447  94.308    21.542  36.094    25.467  9.3246 1.1551 5.4218 1.9006 3.902808       2.224041  
1 1 1 0  11 27 o 12.978 0.7920 184.555  20.267  191.330   26.915  175.685   30.798  13.357 1.0076 12.600 1.2222 0.7568455      1.583945  
1 1 1 0  11 28 o 2.9667 0.8486 6.7160   7.5024  3.6298    13.674  8.0451    8.9737  2.9930 1.2815 2.9404 1.1127 0.5263638E-01  1.697148  
1 1 1 0  11 29 o 3.4332 0.8309 13.780   7.6815  0.8662    13.678  19.729    9.2836  2.7945 1.2372 4.0720 1.1097 -1.277518      1.661897  
1 1 1 0  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  11 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  11 35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  12 0  o 9.6030 0.9679 103.727  15.806  126.588   21.008  73.907    23.994  11.110 0.9620 8.0956 1.6798 -0.000000      0.000000  
1 1 1 0  12 1  o 12.241 0.5347 150.467  13.088  146.837   18.463  154.133   18.555  12.093 0.7634 12.390 0.7488 -0.2977533     1.069322  
1 1 1 0  12 2  o 36.827 0.5610 1362.37  41.318  1350.88   58.468  1373.84   58.398  36.671 0.7972 36.983 0.7895 -0.3119888     1.122002  
1 1 1 0  12 3  o 8.9117 0.6178 80.087   10.951  70.320    15.451  89.948    15.525  8.3612 0.9240 9.4622 0.8203 -1.101027      1.235584  
1 1 1 0  12 4  o 35.312 0.5554 1251.76  39.221  1264.63   55.598  1239.00   55.337  35.493 0.7832 35.131 0.7876 0.3622360      1.110730  
1 1 1 0  12 5  o 41.951 0.5865 1766.88  49.211  1782.00   69.673  1751.83   69.518  42.131 0.8269 41.771 0.8321 0.3592033      1.173088  
1 1 1 0  12 6  o 12.972 0.5482 168.868  14.220  172.331   20.170  165.446   20.050  13.104 0.7696 12.839 0.7808 0.2651024      1.096364  
1 1 1 0  12 7  o 5.1744 1.0901 25.228   11.141  33.990    21.321  21.937    13.067  5.7396 1.7210 4.6092 1.3384 1.130366       2.180140  
1 1 1 0  12 8  o 3.0182 0.8673 3.6425   8.2121  4.9173    11.485  2.3089    11.747  3.0919 1.2333 2.9445 1.2197 0.1473842      1.734518  
1 1 1 0  12 9  o 15.192 0.7602 232.001  23.098  232.001   23.098  0.0000    0.0000  15.192 0.7602 ?      ?      ?              ?         
1 1 1 0  12 10 o 25.384 0.5282 647.922  26.814  638.508   37.850  657.407   37.993  25.198 0.7511 25.570 0.7429 -0.3717461     1.056415  
1 1 1 0  12 11 o 3.9700 0.9748 14.581   9.4625  14.544    13.245  14.619    13.524  3.9590 1.3716 3.9810 1.3856 -0.2206516E-01 1.949600  
1 1 1 0  12 12 o 15.178 0.5556 233.655  16.813  249.930   23.505  216.604   24.060  15.729 0.7472 14.628 0.8224 1.101755       1.111140  
1 1 1 0  12 13 o 17.696 0.5462 317.331  19.323  318.359   26.997  316.251   27.668  17.729 0.7614 17.663 0.7832 0.6531715E-01  1.092308  
1 1 1 0  12 14 o 4.9207 1.0020 26.625   10.408  28.375    14.086  24.521    15.445  5.0819 1.3594 4.7595 1.4724 0.3224263      2.003973  
1 1 1 0  12 15 o 5.5311 0.9439 34.168   10.424  40.486    14.253  26.904    15.283  6.1152 1.2082 4.9471 1.4506 1.168087       1.887865  
1 1 1 0  12 16 o 10.304 0.6782 109.333  13.746  84.776    18.661  138.464   20.325  9.0166 1.0348 11.590 0.8768 -2.573874      1.356310  
1 1 1 0  12 17 o 7.0964 0.8582 54.432   11.844  56.259    16.148  52.304    17.426  7.3083 1.1047 6.8844 1.3135 0.4238963      1.716350  
1 1 1 0  12 18 o 12.661 0.6254 166.803  15.824  158.522   21.917  175.820   22.870  12.331 0.8887 12.991 0.8802 -0.6604061     1.250849  
1 1 1 0  12 19 o 6.6146 0.9877 49.785   12.640  48.799    17.370  50.896    18.427  6.5586 1.3685 6.6706 1.4245 -0.1119804     1.975356  
1 1 1 0  12 20 o 3.0210 0.9473 -2.1200  11.375  -2.9381   15.728  -1.2226   16.472  2.9506 1.3153 3.0914 1.3637 -0.1408055     1.894630  
1 1 1 0  12 21 o 9.0164 0.8351 87.155   15.038  85.309    20.661  89.236    21.930  8.9272 1.1572 9.1055 1.2042 -0.1783190     1.670120  
1 1 1 0  12 22 o 3.0733 0.9766 -6.2454  12.695  -14.0875  17.307  2.8883    18.678  2.6950 1.2651 3.4517 1.4881 -0.7566776     1.953229  
1 1 1 0  12 23 o 4.5636 1.1179 19.239   14.356  37.506    19.364  -3.0567   21.392  5.6745 1.6239 3.4527 1.5369 2.221778       2.235884  
1 1 1 0  12 24 o 5.3030 1.0875 31.121   15.106  56.219    20.035  -1.9413   22.995  7.0093 1.4758 3.5966 1.5976 3.412674       2.174953  
1 1 1 0  12 25 o 7.5514 1.1199 65.659   16.225  62.672    21.343  69.748    24.972  7.4004 1.4935 7.7024 1.6693 -0.3020096     2.239866  
1 1 1 0  12 26 o 11.432 0.8548 145.736  19.010  157.988   25.013  128.981   29.251  12.150 1.0294 10.714 1.3650 1.435369       1.709659  
1 1 1 0  12 27 o 4.6690 1.2659 22.651   16.811  11.537    22.107  37.888    25.885  3.9536 1.6582 5.3843 1.9134 -1.430672      2.531885  
1 1 1 0  12 28 o 7.5720 1.2104 83.282   18.749  103.973   24.559  54.373    29.029  9.3109 1.3188 5.8331 2.0300 3.477829       2.420769  
1 1 1 0  12 29 o 4.8017 1.3260 34.133   18.123  25.733    23.261  47.110    28.911  4.3269 1.7449 5.2764 1.9970 -0.9495149     2.651905  
1 1 1 0  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  12 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  13 0  f 24.968 0.7424 628.912  36.892  632.392   51.170  625.145   53.236  25.045 1.0255 24.891 1.0739 -0.000000      0.000000  
1 1 1 0  13 1  o 9.1860 0.6026 84.972   10.997  72.926    15.417  97.448    15.690  8.5190 0.9049 9.8531 0.7962 -1.334058      1.205284  
1 1 1 0  13 2  o 19.335 0.5151 375.026  19.913  386.208   28.237  363.963   28.086  19.623 0.7195 19.048 0.7372 0.5749111      1.030151  
1 1 1 0  13 3  o 45.432 0.6081 2072.89  55.252  2054.62   78.141  2091.16   78.134  45.231 0.8638 45.633 0.8561 -0.4021759     1.216176  
1 1 1 0  13 4  o 22.793 0.5251 521.147  23.932  538.785   34.092  504.010   33.604  23.173 0.7356 22.412 0.7497 0.7617474      1.050289  
1 1 1 0  13 5  o 29.650 0.5409 883.013  32.054  851.970   45.468  913.684   45.196  29.129 0.7804 30.171 0.7490 -1.041403      1.081708  
1 1 1 0  13 6  o 5.3440 0.8873 29.901   9.3495  25.505    12.930  34.720    13.535  4.9318 1.2945 5.7562 1.2139 -0.8243718     1.774627  
1 1 1 0  13 7  o 17.165 0.5369 296.060  18.426  286.091   25.970  306.165   26.147  16.873 0.7696 17.458 0.7489 -0.5841656     1.073791  
1 1 1 0  13 8  o 17.893 0.5382 322.043  19.236  341.723   27.311  302.666   27.099  18.438 0.7406 17.348 0.7811 1.090664       1.076341  
1 1 1 0  13 9  o 10.644 0.6221 114.529  13.127  133.894   18.773  96.000    18.363  11.533 0.8139 9.7549 0.9412 1.778261       1.244285  
1 1 1 0  13 10 o 7.5120 0.7347 57.212   11.015  61.671    15.606  52.786    15.548  7.8075 0.9994 7.2165 1.0773 0.5910344      1.469472  
1 1 1 0  13 11 o 3.4924 0.9349 7.9528   9.4848  15.505    12.979  -0.7015   13.894  4.0031 1.3587 2.9817 1.2845 1.021447       1.869755  
1 1 1 0  13 12 o 10.351 0.6582 108.987  13.608  101.743   19.030  116.567   19.465  9.9945 0.9520 10.707 0.9090 -0.7120094     1.316322  
1 1 1 0  13 13 o 6.0527 0.9439 41.002   11.652  57.885    16.128  22.564    16.854  7.4660 1.0801 4.6395 1.5484 2.826559       1.887848  
1 1 1 0  13 14 o 11.061 0.6536 125.085  14.405  110.871   19.848  140.908   20.941  10.389 0.9552 11.732 0.8924 -1.342826      1.307232  
1 1 1 0  13 15 o 12.025 0.6313 149.676  15.089  161.962   20.868  136.214   21.844  12.568 0.8302 11.481 0.9513 1.086604       1.262631  
1 1 1 0  13 16 o 4.0631 0.9931 14.619   10.583  3.5674    14.511  27.177    15.469  3.2005 1.3429 4.9257 1.4634 -1.725201      1.986204  
1 1 1 0  13 17 o 11.507 0.6812 138.519  15.667  139.714   21.823  137.248   22.505  11.569 0.9432 11.446 0.9831 0.1233358      1.362407  
1 1 1 0  13 18 o 5.5003 1.0528 35.320   12.321  46.204    17.122  23.632    17.744  6.3768 1.3824 4.6238 1.5883 1.752964       2.105634  
1 1 1 0  13 19 o 4.7605 0.9637 22.411   12.331  48.314    17.086  -5.7534   17.816  6.5023 1.3576 3.0187 1.3680 3.483571       1.927364  
1 1 1 0  13 20 f 5.1539 1.1286 31.055   13.156  38.269    18.059  22.895    19.206  5.7125 1.5439 4.5953 1.6465 1.117228       2.257108  
1 1 1 0  13 21 o 3.6894 1.0384 5.3412   12.964  21.912    17.716  -13.7591  19.021  4.5035 1.5848 2.8752 1.3421 1.628266       2.076722  
1 1 1 0  13 22 o 7.1172 1.1257 59.105   15.582  54.093    21.043  65.192    23.186  6.7842 1.5803 7.4502 1.6036 -0.6660447     2.251369  
1 1 1 0  13 23 o 9.7121 0.9097 103.541  17.424  112.262   23.559  93.012    25.886  10.246 1.1496 9.1778 1.4103 1.068654       1.819488  
1 1 1 0  13 24 o 6.6692 1.2388 53.584   16.595  52.354    21.817  55.274    25.565  6.6370 1.6505 6.7014 1.8477 -0.6436825E-01 2.477566  
1 1 1 0  13 25 o 7.5114 1.1999 67.353   17.543  62.437    23.637  73.383    26.177  7.2191 1.6703 7.8036 1.7232 -0.5845466     2.399851  
1 1 1 0  13 26 o 4.7858 1.2565 25.688   16.825  35.972    22.286  12.057    25.658  5.3782 1.7798 4.1933 1.7740 1.184865       2.512912  
1 1 1 0  13 27 o 4.1043 1.1179 6.0941   16.728  38.795    22.215  -36.7236  25.420  5.4356 1.7759 2.7730 1.3583 2.662567       2.235844  
1 1 1 0  13 28 o 2.9056 0.9794 -19.2975 16.436  -3.7738   20.843  -44.8292  26.730  3.1503 1.4473 2.6610 1.3201 0.4892879      1.958862  
1 1 1 0  13 29 o 9.5959 1.1722 129.272  21.007  133.391   26.918  122.857   33.594  10.337 1.3021 8.8553 1.9496 1.481275       2.344458  
1 1 1 0  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  13 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  14 0  o 5.7460 1.3462 40.278   13.347  33.878    16.516  52.323    22.658  5.0551 1.7941 6.4369 2.0075 -0.000000      0.000000  
1 1 1 0  14 1  o 12.039 0.5627 145.494  13.542  151.363   19.331  139.838   18.977  12.278 0.7872 11.800 0.8041 0.4777298      1.125307  
1 1 1 0  14 2  f 15.210 0.6634 242.186  18.787  204.884   31.763  262.257   23.299  14.254 1.1142 16.166 0.7206 -1.911780      1.326887  
1 1 1 0  14 3  o 18.620 0.4814 346.633  17.619  354.040   27.725  341.615   22.819  18.781 0.7381 18.459 0.6181 0.3222065      0.9627382 
1 1 1 0  14 4  o 42.314 0.7176 1790.94  57.719  1762.98   71.055  1845.19   98.968  41.879 0.8483 42.749 1.1575 -0.8701210     1.435119  
1 1 1 0  14 5  o 30.608 0.5480 941.328  33.548  945.099   47.662  937.625   47.230  30.668 0.7771 30.548 0.7730 0.1207409      1.096092  
1 1 1 0  14 6  o 12.352 0.5782 153.487  14.283  153.249   20.271  153.722   20.128  12.342 0.8212 12.362 0.8141 -0.1967621E-01 1.156369  
1 1 1 0  14 7  f 21.570 0.5387 468.474  23.207  445.771   33.048  490.562   32.597  21.050 0.7850 22.090 0.7378 -1.039946      1.077307  
1 1 1 0  14 8  o 33.290 0.5631 1115.21  37.485  1132.82   53.403  1098.11   52.629  33.549 0.7959 33.031 0.7967 0.5182228      1.126112  
1 1 1 0  14 9  o 11.132 0.6443 125.273  14.338  122.990   20.485  127.466   20.075  11.030 0.9286 11.234 0.8935 -0.2033806     1.288655  
1 1 1 0  14 10 o 2.7097 0.8628 -7.5973  10.055  -1.4055   13.794  -14.6163  14.687  2.9340 1.2719 2.4855 1.1663 0.4484794      1.725679  
1 1 1 0  14 11 o 11.518 0.6528 135.384  14.975  140.630   20.515  129.400   21.909  11.768 0.8716 11.268 0.9722 0.5004721      1.305680  
1 1 1 0  14 12 o 7.0589 0.9203 54.975   12.420  66.659    16.916  41.309    18.294  8.0228 1.0543 6.0950 1.5088 1.927843       1.840654  
1 1 1 0  14 13 o 7.9155 0.8395 65.237   13.222  65.636    17.867  64.754    19.658  7.9586 1.1225 7.8723 1.2486 0.8626842E-01  1.678953  
1 1 1 0  14 14 o 10.335 0.7165 111.852  14.671  120.097   19.966  102.179   21.628  10.785 0.9257 9.8861 1.0938 0.8986006      1.432953  
1 1 1 0  14 15 o 4.5898 1.0843 22.167   11.709  17.388    15.614  28.307    17.698  4.1609 1.4852 5.0188 1.5800 -0.8578773     2.168506  
1 1 1 0  14 16 o 5.5300 1.0516 35.590   12.510  47.366    16.898  21.307    18.610  6.5238 1.3399 4.5362 1.6212 1.987600       2.103277  
1 1 1 0  14 17 o 14.345 0.8259 217.504  21.868  231.182   39.675  211.535   26.208  14.474 1.3706 14.215 0.9218 0.2587900      1.651723  
1 1 1 0  14 18 o 10.217 0.7525 110.736  15.337  102.305   20.852  120.674   22.638  9.7953 1.0644 10.639 1.0639 -0.8433666     1.504971  
1 1 1 0  14 19 o 8.3946 0.8637 76.657   14.470  70.446    20.185  83.223    20.754  8.0244 1.2577 8.7648 1.1839 -0.7403908     1.727305  
1 1 1 0  14 20 o 6.7056 1.0767 52.045   14.082  52.568    19.208  51.437    20.707  6.7771 1.4602 6.6341 1.5827 0.1429696      2.153410  
1 1 1 0  14 21 o 9.8843 0.9191 111.474  16.845  138.937   23.095  80.252    24.625  11.452 1.0084 8.3170 1.5370 3.134635       1.838251  
1 1 1 0  14 22 o 11.022 0.8360 132.427  17.970  153.394   24.435  107.726   26.522  12.087 1.0108 9.9568 1.3318 2.130556       1.671949  
1 1 1 0  14 23 o 4.9112 1.1708 20.785   15.180  1.1024    19.881  48.298    23.506  3.4903 1.5200 6.3321 1.7813 -2.841801      2.341630  
1 1 1 0  14 24 o 4.4267 1.1102 14.371   15.644  39.137    20.146  -23.2493  24.830  5.7485 1.6597 3.1049 1.4748 2.643595       2.220308  
1 1 1 0  14 25 o 7.5204 1.2267 68.670   17.796  64.927    22.934  74.333    28.213  7.3629 1.6029 7.6780 1.8575 -0.3151097     2.453446  
1 1 1 0  14 26 o 4.3066 1.2563 16.292   17.374  15.672    22.856  17.140    26.737  4.2020 1.7166 4.4112 1.8347 -0.2091775     2.512562  
1 1 1 0  14 27 o 5.8273 1.3419 50.904   18.677  60.032    24.570  38.411    28.744  6.5401 1.8146 5.1145 1.9773 1.425674       2.683720  
1 1 1 0  14 28 o 5.0150 1.3727 39.670   19.579  40.427    25.629  38.608    30.343  5.1052 1.8908 4.9247 1.9904 0.1804795      2.745351  
1 1 1 0  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  14 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  14 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  15 0  o 9.7173 0.9876 101.241  17.411  103.099   22.381  98.391    27.710  9.9281 1.1697 9.5064 1.5915 -0.000000      0.000000  
1 1 1 0  15 1  o 34.579 0.6866 1177.60  44.713  1127.37   54.186  1284.82   79.157  33.489 0.8090 35.669 1.1096 -2.180351      1.373212  
1 1 1 0  15 2  o 12.696 0.5666 162.057  14.381  168.286   20.403  155.907   20.273  12.939 0.7884 12.452 0.8140 0.4870729      1.133262  
1 1 1 0  15 3  o 11.802 0.5806 140.072  13.699  145.640   19.523  134.670   19.228  12.034 0.8112 11.570 0.8309 0.4637327      1.161243  
1 1 1 0  15 4  o 35.343 0.4625 1253.90  32.673  1201.98   45.910  1307.19   46.511  34.599 0.6635 36.086 0.6444 -1.486519      0.9249185 
1 1 1 0  15 5  o 35.592 0.5709 1274.56  40.632  1301.00   57.907  1248.91   57.029  35.956 0.8053 35.227 0.8094 0.7282982      1.141758  
1 1 1 0  15 6  o 5.3030 0.9881 29.684   10.819  22.070    15.344  37.211    15.255  4.6706 1.4713 5.9354 1.3193 -1.264872      1.976223  
1 1 1 0  15 7  o 15.363 0.5765 237.774  17.708  233.257   25.131  242.229   24.956  15.216 0.8258 15.509 0.8046 -0.2927933     1.152934  
1 1 1 0  15 8  o 22.916 0.5519 529.849  25.290  547.220   35.935  512.803   35.597  23.291 0.7714 22.542 0.7896 0.7489929      1.103886  
1 1 1 0  15 9  o 17.278 0.5775 302.213  19.949  312.903   28.450  291.873   27.979  17.581 0.8091 16.976 0.8241 0.6049652      1.154918  
1 1 1 0  15 10 o 6.9367 0.9554 51.951   12.825  59.762    17.343  42.523    19.053  7.6262 1.1371 6.2472 1.5357 1.378963       1.910842  
1 1 1 0  15 11 o 12.871 0.6591 171.589  16.814  193.724   23.498  148.364   24.070  13.757 0.8541 11.986 1.0041 1.770636       1.318192  
1 1 1 0  15 12 o 10.666 0.7295 117.321  15.537  118.639   21.462  115.868   22.522  10.739 0.9993 10.593 1.0631 0.1456633      1.458994  
1 1 1 0  15 13 o 11.127 0.6857 128.247  15.252  125.631   21.182  131.063   21.980  11.012 0.9617 11.241 0.9776 -0.2290392     1.371397  
1 1 1 0  15 14 o 7.4197 0.9268 60.160   13.256  46.547    18.400  74.852    19.115  6.4199 1.4653 8.4194 1.1352 -1.999503      1.853590  
1 1 1 0  15 15 o 19.484 0.5872 391.243  22.875  395.690   32.043  386.621   32.667  19.606 0.8172 19.362 0.8436 0.2441273      1.174487  
1 1 1 0  15 16 o 8.8199 0.8325 84.548   14.464  92.395    19.554  75.067    21.493  9.3414 1.0466 8.2985 1.2950 1.042921       1.665085  
1 1 1 0  15 17 o 3.3494 0.9673 -2.0250  11.616  -19.5046  15.663  19.340    17.317  2.3819 1.1423 4.3169 1.5613 -1.935071      1.934571  
1 1 1 0  15 18 f 7.7045 1.0063 69.840   14.719  86.749    19.957  49.671    21.796  8.9933 1.1096 6.4157 1.6791 2.577511       2.012610  
1 1 1 0  15 19 o 10.423 0.8515 121.589  16.819  154.567   23.028  83.880    24.624  12.143 0.9482 8.7031 1.4147 3.439875       1.703041  
1 1 1 0  15 20 o 11.997 0.8479 152.019  19.900  140.514   25.267  170.816   32.295  11.481 1.1004 12.514 1.2904 -1.033013      1.695855  
1 1 1 0  15 21 o 15.522 0.6894 253.279  21.326  226.036   29.643  282.510   30.705  14.627 1.0133 16.417 0.9351 -1.790747      1.378860  
1 1 1 0  15 22 o 5.1806 1.2561 30.774   15.705  28.311    21.910  33.378    22.524  5.0171 1.7626 5.3441 1.7900 -0.3270640     2.512116  
1 1 1 0  15 23 o 12.034 0.8382 155.163  20.117  144.086   27.261  168.407   29.809  11.570 1.1781 12.497 1.1926 -0.9274311     1.676370  
1 1 1 0  15 24 o 4.3963 1.1212 1.8719   16.293  -33.9870  21.815  47.114    24.503  2.6168 1.2767 6.1758 1.8434 -3.559075      2.242360  
1 1 1 0  15 25 o 16.913 0.7504 311.142  25.051  337.490   33.936  279.596   37.133  17.827 0.9518 16.000 1.1604 1.826393       1.500849  
1 1 1 0  15 26 o 13.227 0.8801 197.619  23.076  198.738   30.830  196.192   34.797  13.377 1.1523 13.076 1.3305 0.3010283      1.760157  
1 1 1 0  15 27 o 6.8356 1.3558 71.125   19.818  79.613    25.507  58.196    31.481  7.6998 1.7016 5.9713 2.1113 1.728488       2.711666  
1 1 1 0  15 28 o 6.1571 1.4251 62.354   20.050  50.085    25.899  80.707    31.675  5.5065 1.9174 6.8077 2.1090 -1.301223      2.850282  
1 1 1 0  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  15 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  16 0  o 11.412 0.8899 134.684  19.383  129.500   25.100  142.343   30.509  11.171 1.1514 11.652 1.3573 -0.000000      0.000000  
1 1 1 0  16 1  o 18.196 0.5429 332.817  19.752  341.495   28.340  324.619   27.545  18.426 0.7690 17.966 0.7666 0.4607105      1.085850  
1 1 1 0  16 2  o 26.428 0.6688 693.738  32.986  734.908   59.041  675.056   39.772  26.950 1.0954 25.907 0.7676 1.043350       1.337577  
1 1 1 0  16 3  o 20.468 0.5443 421.963  22.253  404.620   31.807  438.590   31.144  20.052 0.7931 20.885 0.7456 -0.8323708     1.088565  
1 1 1 0  16 4  o 6.6461 0.8224 45.491   10.700  46.653    15.001  44.288    15.266  6.7879 1.1050 6.5043 1.2183 0.2836728      1.644776  
1 1 1 0  16 5  o 20.441 0.5539 421.102  22.602  452.599   32.047  389.927   31.883  21.207 0.7556 19.675 0.8102 1.532280       1.107878  
1 1 1 0  16 6  o 5.0381 0.9833 25.527   11.459  7.6409    16.240  43.265    16.173  3.6845 1.4675 6.3917 1.3092 -2.707173      1.966586  
1 1 1 0  16 7  o 6.1850 0.9963 41.145   12.101  34.317    17.042  48.091    17.187  5.6470 1.4880 6.7230 1.3254 -1.076038      1.992678  
1 1 1 0  16 8  o 24.836 0.5606 624.211  27.840  645.287   39.653  603.723   39.097  25.252 0.7852 24.419 0.8005 0.8324909      1.121295  
1 1 1 0  16 9  o 3.7301 0.9908 7.8642   11.043  -5.3746   15.612  21.121    15.622  2.9253 1.3067 4.5349 1.4896 -1.609575      1.981562  
1 1 1 0  16 10 o 9.3976 0.7951 93.376   14.657  74.672    21.027  111.053   20.441  8.4243 1.2480 10.371 0.9855 -1.946505      1.590189  
1 1 1 0  16 11 o 10.057 0.7369 104.407  14.800  106.544   20.536  102.097   21.349  10.173 1.0093 9.9401 1.0739 0.2333212      1.473729  
1 1 1 0  16 12 o 14.775 0.6349 224.942  18.753  215.901   26.133  234.541   26.926  14.467 0.9032 15.084 0.8926 -0.6169834     1.269831  
1 1 1 0  16 13 o 3.4463 1.0144 3.6459   11.817  -3.4326   16.233  11.626    17.237  3.0205 1.3420 3.8722 1.5214 -0.8517203     2.028701  
1 1 1 0  16 14 o 15.358 0.6386 244.450  19.590  249.167   27.221  239.383   28.216  15.527 0.8766 15.189 0.9288 0.3381290      1.277155  
1 1 1 0  16 15 o 7.1235 1.0417 57.501   14.318  50.928    19.314  65.521    21.333  6.6556 1.4883 7.5913 1.4581 -0.9357696     2.083496  
1 1 1 0  16 16 o 4.9432 1.0100 20.635   13.180  -5.8620   17.630  54.213    19.846  3.0211 1.3657 6.8653 1.4883 -3.844206      2.019962  
1 1 1 0  16 17 f 4.0864 1.0820 12.813   12.683  0.3798    16.838  29.119    19.283  3.1877 1.3932 4.9850 1.6558 -1.797295      2.163983  
1 1 1 0  16 18 o 9.0362 0.9406 93.682   15.700  120.893   21.760  64.136    22.675  10.681 1.0187 7.3916 1.5816 3.289328       1.881285  
1 1 1 0  16 19 o 3.7792 1.0285 4.2531   13.238  26.889    18.160  -21.4196  19.340  4.8674 1.6064 2.6909 1.2847 2.176486       2.056971  
1 1 1 0  16 20 o 3.5303 1.0741 2.2292   13.787  -4.2078   18.568  10.138    20.582  3.1474 1.4142 3.9132 1.6171 -0.7658143     2.148260  
1 1 1 0  16 21 o 4.2310 1.1791 15.123   14.697  17.915    19.390  11.353    22.531  4.3284 1.6361 4.1336 1.6983 0.1948290      2.358222  
1 1 1 0  16 22 o 8.0412 1.0955 73.932   16.922  69.086    22.794  79.882    25.258  7.7597 1.5231 8.3228 1.5751 -0.5631280     2.191080  
1 1 1 0  16 23 o 7.5862 1.1903 67.819   17.453  66.992    23.095  68.920    26.650  7.6048 1.5705 7.5676 1.7890 0.3725672E-01  2.380552  
1 1 1 0  16 24 o 10.024 1.0346 119.271  19.144  141.586   25.502  90.462    28.976  11.443 1.1143 8.6042 1.7435 2.839046       2.069195  
1 1 1 0  16 25 o 9.5502 1.1340 110.775  20.565  121.613   27.357  96.695    31.182  10.386 1.3170 8.7143 1.8465 1.671786       2.268081  
1 1 1 0  16 26 o 11.093 0.9874 144.336  21.637  118.883   28.553  178.668   33.161  9.9086 1.4408 12.278 1.3504 -2.369154      1.974741  
1 1 1 0  16 27 o 6.9361 1.4343 73.333   20.967  58.904    26.953  95.446    33.366  6.1398 1.9517 7.7323 2.1023 -1.592457      2.868589  
1 1 1 0  16 28 o 4.2823 1.3170 26.481   20.540  19.278    26.224  37.914    33.040  3.9564 1.7337 4.6083 1.9830 -0.6519079     2.634010  
1 1 1 0  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  16 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  16 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  17 0  o 5.3198 1.5667 39.409   16.207  35.677    20.378  45.832    26.735  5.0052 2.0581 5.6345 2.3626 -0.000000      0.000000  
1 1 1 0  17 1  o 11.317 0.6338 129.291  14.344  129.979   20.139  128.583   20.436  11.349 0.8873 11.285 0.9054 0.6321049E-01  1.267699  
1 1 1 0  17 2  o 16.240 0.5741 265.866  18.615  246.047   26.058  286.521   26.601  15.618 0.8342 16.861 0.7888 -1.243389      1.148117  
1 1 1 0  17 3  o 9.9636 0.6662 100.696  13.203  87.825    18.517  114.006   18.830  9.3077 0.9947 10.620 0.8866 -1.311792      1.332471  
1 1 1 0  17 4  o 6.5052 0.9213 45.129   11.544  48.355    15.903  41.535    16.784  6.7767 1.2181 6.2336 1.3825 0.5430150      1.842590  
1 1 1 0  17 5  o 6.2692 0.7888 42.067   9.4094  48.456    12.560  33.893    14.206  6.9089 0.9089 5.6296 1.2894 1.279305       1.577592  
1 1 1 0  17 6  o 17.098 0.5932 296.339  20.284  297.579   28.574  295.080   28.800  17.135 0.8338 17.060 0.8441 0.7491493E-01  1.186421  
1 1 1 0  17 7  o 11.108 0.7093 126.094  15.722  137.765   22.520  114.998   21.958  11.617 0.9692 10.599 1.0359 1.018589       1.418600  
1 1 1 0  17 8  o 4.6754 1.1074 22.397   12.366  27.929    17.509  16.890    17.468  5.0731 1.5674 4.2777 1.5649 0.7954378      2.214880  
1 1 1 0  17 9  o 13.848 0.6582 197.214  18.222  193.867   26.006  200.442   25.540  13.725 0.9474 13.970 0.9141 -0.2444315     1.316486  
1 1 1 0  17 10 o 15.630 0.6297 250.301  19.681  258.680   28.079  242.210   27.592  15.890 0.8835 15.370 0.8976 0.5200386      1.259469  
1 1 1 0  17 11 o 8.5707 0.8721 77.796   14.905  83.870    21.013  71.644    21.146  8.9289 1.1767 8.2126 1.2874 0.7163057      1.744151  
1 1 1 0  17 12 o 7.3136 1.0699 60.490   15.123  60.474    20.955  60.507    21.846  7.3296 1.4805 7.2975 1.5449 0.3202486E-01  2.139772  
1 1 1 0  17 13 o 17.098 0.6321 302.522  21.607  301.430   30.104  303.681   31.032  17.074 0.8815 17.122 0.9062 -0.4771042E-01 1.264235  
1 1 1 0  17 14 o 4.6069 1.1613 22.703   13.640  26.784    18.391  17.714    20.335  4.8719 1.6170 4.3419 1.6672 0.5300117      2.322591  
1 1 1 0  17 15 o 3.5784 1.0646 5.7362   12.896  5.1004    17.393  6.5124    19.218  3.4798 1.4657 3.6770 1.5443 -0.1971998     2.129128  
1 1 1 0  17 16 o 10.450 0.8416 118.793  17.134  87.938    23.594  153.221   24.923  8.9114 1.3238 11.988 1.0395 -3.076469      1.683148  
1 1 1 0  17 17 o 9.8626 0.9099 110.996  16.676  135.473   22.654  82.048    24.636  11.308 1.0017 8.4176 1.5193 2.890007       1.819792  
1 1 1 0  17 18 o 5.5801 1.1914 34.714   14.969  20.971    19.880  52.709    22.748  4.5117 1.6664 6.6485 1.7031 -2.136788      2.382796  
1 1 1 0  17 19 o 9.3551 0.9423 98.741   16.804  113.939   23.043  81.478    24.557  10.309 1.1176 8.4014 1.5173 1.907398       1.884515  
1 1 1 0  17 20 o 5.0165 1.1935 28.272   14.760  37.434    19.898  17.064    22.008  5.6489 1.6548 4.3842 1.7203 1.264703       2.387015  
1 1 1 0  17 21 o 4.5071 1.2190 19.664   15.383  22.223    21.222  16.829    22.331  4.6357 1.7199 4.3784 1.7281 0.2573409      2.438088  
1 1 1 0  17 22 f 7.7862 1.1779 72.499   17.966  80.871    23.869  61.556    27.287  8.5381 1.3978 7.0342 1.8964 1.503904       2.355888  
1 1 1 0  17 23 o 4.0563 1.1969 5.4860   16.615  -8.4357   21.680  25.303    25.866  3.2429 1.4847 4.8698 1.8776 -1.626889      2.393720  
1 1 1 0  17 24 o 6.5100 1.3250 56.114   18.754  66.316    24.670  42.147    28.866  7.3258 1.7142 5.6942 2.0208 1.631541       2.649925  
1 1 1 0  17 25 o 9.5118 1.1368 109.090  20.974  91.728    28.074  131.021   31.552  8.5244 1.7062 10.499 1.5026 -1.974824      2.273557  
1 1 1 0  17 26 o 11.643 0.9801 163.965  22.652  161.132   30.258  167.577   34.168  11.654 1.2981 11.632 1.4687 0.2228451E-01  1.960171  
1 1 1 0  17 27 o 4.0942 1.1748 11.310   19.332  45.768    24.752  -42.5869  30.956  5.3305 1.8734 2.8579 1.4182 2.472665       2.349648  
1 1 1 0  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  17 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  17 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  18 0  o 14.007 0.8945 203.620  24.139  202.788   31.350  204.832   37.832  14.022 1.1350 13.991 1.3830 -0.000000      0.000000  
1 1 1 0  18 1  o 18.180 0.5692 334.781  20.679  347.365   29.140  322.015   29.351  18.529 0.7863 17.830 0.8231 0.6988163      1.138306  
1 1 1 0  18 2  o 12.157 0.6407 150.161  15.562  150.789   21.557  149.479   22.489  12.188 0.8843 12.126 0.9273 0.6202984E-01  1.281383  
1 1 1 0  18 3  o 4.5357 1.0027 19.838   10.833  8.3130    15.086  32.107    15.566  3.6114 1.4220 5.4601 1.4141 -1.848714      2.005435  
1 1 1 0  18 4  o 17.634 0.5803 315.470  20.439  296.438   28.862  334.618   28.950  17.093 0.8442 18.175 0.7964 -1.081821      1.160610  
1 1 1 0  18 5  o 13.147 0.6171 176.270  16.210  182.033   22.687  170.260   23.170  13.374 0.8482 12.921 0.8966 0.4529142      1.234234  
1 1 1 0  18 6  o 9.8249 0.7653 102.336  14.653  119.809   19.940  81.827    21.604  10.805 0.9228 8.8449 1.2213 1.960018       1.530678  
1 1 1 0  18 7  o 6.9280 1.0491 52.799   14.078  47.386    19.118  59.213    20.808  6.5292 1.4961 7.3267 1.4711 -0.7975206     2.098190  
1 1 1 0  18 8  o 13.643 0.6702 190.796  18.248  208.464   26.218  174.193   25.415  14.266 0.9189 13.021 0.9760 1.245044       1.340460  
1 1 1 0  18 9  o 5.8204 0.9795 36.277   13.599  66.824    19.105  4.9069    19.361  7.9596 1.2001 3.6813 1.5483 4.278305       1.958933  
1 1 1 0  18 10 f 10.507 0.7734 115.833  16.150  128.501   22.648  102.727   23.036  11.124 1.0180 9.8900 1.1646 1.234279       1.546779  
1 1 1 0  18 11 o 5.2845 1.1564 31.885   13.898  40.234    18.950  22.167    20.445  5.9152 1.5741 4.6539 1.6945 1.261251       2.312797  
1 1 1 0  18 12 o 2.9124 0.9495 -14.4987 12.977  -24.8353  17.359  -1.4024   19.539  2.4342 1.1762 3.3906 1.4908 -0.9563081     1.898955  
1 1 1 0  18 13 o 14.863 0.6827 231.615  20.274  245.143   28.928  218.555   28.423  15.304 0.9451 14.422 0.9854 0.8816833      1.365339  
1 1 1 0  18 14 f 10.309 0.8441 115.336  17.143  136.215   24.193  94.282    24.294  11.328 1.0679 9.2906 1.3075 2.036977       1.688151  
1 1 1 0  18 15 o 6.6159 1.1191 53.144   15.008  68.424    20.800  36.550    21.676  7.7449 1.3941 5.4868 1.7509 2.258111       2.238116  
1 1 1 0  18 16 o 3.8678 1.1172 9.4775   14.157  17.963    19.266  -0.4827   20.873  4.2688 1.6267 3.4668 1.5319 0.8019550      2.234466  
1 1 1 0  18 17 o 4.3643 1.1860 16.925   14.699  10.091    19.835  25.251    21.892  3.8995 1.5968 4.8292 1.7542 -0.9297211     2.372098  
1 1 1 0  18 18 o 13.417 0.8516 194.142  22.467  196.870   35.126  192.254   29.228  13.404 1.3103 13.429 1.0882 -0.2512455E-01 1.703225  
1 1 1 0  18 19 o 6.4944 1.2122 50.999   16.142  58.635    22.353  42.675    23.337  7.0580 1.6181 5.9308 1.8055 1.127275       2.424465  
1 1 1 0  18 20 o 3.4131 1.0801 -3.7504  15.115  -2.9893   20.506  -4.6561   22.368  3.3726 1.5027 3.4535 1.5519 -0.8085394E-01 2.160221  
1 1 1 0  18 21 o 7.2723 1.7058 63.052   24.381  63.052    24.381  0.0000    0.0000  7.2723 1.7058 ?      ?      ?              ?         
1 1 1 0  18 22 o 4.9104 1.2892 23.867   17.031  14.257    22.478  36.818    26.094  4.2502 1.7148 5.5706 1.9254 -1.320422      2.578327  
1 1 1 0  18 23 o 3.5153 1.0822 -3.8072  15.792  15.631    20.933  -29.4825  24.058  4.1662 1.6640 2.8643 1.3842 1.301874       2.164439  
1 1 1 0  18 24 o 18.197 0.7325 359.471  26.483  373.504   36.008  342.935   39.087  18.677 0.9639 17.717 1.1031 0.9607544      1.464936  
1 1 1 0  18 25 o 5.5593 1.2816 43.994   19.870  72.141    26.463  7.6179    30.084  7.1634 1.8380 3.9551 1.7864 3.208326       2.563102  
1 1 1 0  18 26 o 3.8128 1.2191 2.5562   19.883  -14.8817  25.811  28.006    31.181  3.1045 1.4827 4.5211 1.9355 -1.416592      2.438154  
1 1 1 0  18 27 o 8.1620 1.4240 109.030  23.070  98.957    31.260  121.078   34.188  7.7297 2.0050 8.5942 2.0227 -0.8644428     2.848057  
1 1 1 0  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  18 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  18 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  19 0  f 8.5336 1.4842 95.197   20.336  106.685   24.878  72.061    35.305  9.9769 1.3093 7.0904 2.6640 -0.000000      0.000000  
1 1 1 0  19 1  o 5.0285 1.0636 26.919   11.670  34.001    17.067  20.700    15.993  5.5599 1.5002 4.4971 1.5083 1.062790       2.127282  
1 1 1 0  19 2  o 3.7154 0.9934 7.1391   11.487  21.801    15.699  -9.7590   16.854  4.5648 1.4930 2.8659 1.3110 1.698992       1.986892  
1 1 1 0  19 3  o 9.3334 0.7651 90.571   14.218  92.062    19.327  88.812    20.990  9.4350 1.0242 9.2317 1.1368 0.2033272      1.530176  
1 1 1 0  19 4  o 3.3905 0.8944 4.5611   9.9589  19.762    12.976  -17.2234  15.534  4.3116 1.3522 2.4694 1.1711 1.842206       1.788825  
1 1 1 0  19 5  o 13.227 0.6476 179.994  17.034  157.566   23.976  202.854   24.205  12.373 0.9689 14.082 0.8595 -1.708682      1.295151  
1 1 1 0  19 6  o 4.7532 0.9527 23.980   10.490  37.604    14.409  8.6195    15.301  5.8946 1.2604 3.6118 1.4289 2.282838       1.905349  
1 1 1 0  19 7  o 2.5879 0.8657 -17.0321 11.743  -15.4685  15.475  -19.1546  18.030  2.5107 1.1841 2.6652 1.2633 -0.1545005     1.731433  
1 1 1 0  19 8  o 4.0838 1.0358 9.9509   12.892  30.788    17.787  -13.1068  18.711  5.2536 1.5712 2.9141 1.3503 2.339499       2.071690  
1 1 1 0  19 9  o 10.920 0.8274 127.960  17.746  105.099   25.684  148.845   24.549  9.9049 1.2965 11.936 1.0284 -2.030667      1.654868  
1 1 1 0  19 10 o 19.334 0.6283 387.203  24.257  403.733   33.950  369.965   34.670  19.778 0.8583 18.890 0.9177 0.8872166      1.256501  
1 1 1 0  19 11 o 9.4401 0.9064 95.826   16.902  78.121    23.437  115.011   24.397  8.4770 1.3824 10.403 1.1726 -1.926213      1.812701  
1 1 1 0  19 12 o 6.8967 1.0610 55.966   15.623  90.767    22.189  21.760    21.999  9.1733 1.2094 4.6201 1.7436 4.553289       2.122009  
1 1 1 0  19 13 f 8.6492 1.0089 84.404   16.735  67.120    23.600  101.886   23.735  7.5832 1.6060 9.7151 1.2215 -2.131834      2.017784  
1 1 1 0  19 14 o 7.8734 1.0577 71.539   16.241  74.643    22.211  67.973    23.808  8.1910 1.3558 7.5558 1.6238 0.6352272      2.115417  
1 1 1 0  19 15 o 4.9957 1.2214 28.741   15.244  36.395    20.880  20.005    22.308  5.4963 1.7139 4.4951 1.7407 1.001210       2.442886  
1 1 1 0  19 16 o 10.765 0.8755 124.872  18.786  111.724   25.907  139.452   27.280  10.143 1.2771 11.386 1.1980 -1.243207      1.750999  
1 1 1 0  19 17 o 7.4145 1.1325 63.915   16.358  50.512    22.277  79.600    24.099  6.4927 1.6967 8.3363 1.5006 -1.843614      2.265077  
1 1 1 0  19 18 o 4.7682 1.1760 23.377   15.626  40.456    20.691  0.7041    23.839  5.8091 1.6834 3.7272 1.6425 2.081945       2.351933  
1 1 1 0  19 19 o 9.5745 0.9755 100.871  18.490  103.211   24.715  97.896    27.864  9.7684 1.2650 9.3806 1.4852 0.3878384      1.950938  
1 1 1 0  19 20 o 3.5853 1.0989 -0.5185  15.282  11.668    20.531  -15.6599  22.885  4.0199 1.6329 3.1508 1.4712 0.8690755      2.197888  
1 1 1 0  19 21 o 11.826 0.8692 151.634  20.430  158.253   27.855  143.928   30.056  12.165 1.1449 11.487 1.3082 0.6770592      1.738454  
1 1 1 0  19 22 o 5.0057 1.2790 23.542   18.035  1.9253    24.177  50.659    27.079  3.7508 1.6535 6.2607 1.9517 -2.509842      2.557955  
1 1 1 0  19 23 o 3.3069 1.0851 -11.7059 17.300  -4.8434   23.072  -20.5207  26.148  3.4162 1.5515 3.1976 1.5173 0.2186029      2.170107  
1 1 1 0  19 24 o 7.4356 1.3837 75.738   20.682  71.741    27.240  81.177    31.780  7.3093 1.8590 7.5620 2.0499 -0.2526412     2.767352  
1 1 1 0  19 25 o 4.4419 1.2877 21.627   20.348  41.138    26.476  -6.5267   31.804  5.2449 1.9254 3.6388 1.7103 1.606122       2.575367  
1 1 1 0  19 26 o 5.9956 1.4415 61.235   21.316  41.369    28.161  87.888    32.618  4.9263 1.9418 7.0648 2.1310 -2.138543      2.882983  
1 1 1 0  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  19 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  19 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  20 0  o 4.8885 1.5660 37.970   17.551  43.959    21.155  24.743    31.436  5.6502 2.0414 4.1267 2.3754 -0.000000      0.000000  
1 1 1 0  20 1  o 4.6639 1.0642 19.959   12.348  36.899    18.199  5.5091    16.808  5.7763 1.5451 3.5515 1.4639 2.224844       2.128501  
1 1 1 0  20 2  o 6.7949 0.9845 50.245   12.916  48.671    17.775  52.006    18.799  6.6859 1.3752 6.9040 1.4092 -0.2181358     1.969000  
1 1 1 0  20 3  o 5.8202 1.0757 37.367   12.579  35.118    16.701  40.315    19.123  5.6329 1.4677 6.0075 1.5731 -0.3746066     2.151403  
1 1 1 0  20 4  o 7.2635 0.9737 57.911   13.613  57.967    18.816  57.850    19.720  7.2829 1.3412 7.2441 1.4119 0.3883266E-01  1.947351  
1 1 1 0  20 5  o 7.4192 0.9205 59.116   13.367  55.532    18.156  63.357    19.750  7.1200 1.3237 7.7184 1.2794 -0.5983996     1.841002  
1 1 1 0  20 6  o 8.8222 1.2427 114.449  19.394  37.095    38.404  140.928   22.469  5.9709 2.2916 11.673 0.9624 -5.702446      2.485466  
1 1 1 0  20 7  o 2.9988 0.8957 0.9794   9.6911  8.1003    12.422  -10.0970  15.492  3.3141 1.2946 2.6835 1.2383 0.6305323      1.791461  
1 1 1 0  20 8  o 7.8604 1.0171 68.770   15.446  52.831    21.580  85.513    22.117  6.7703 1.6161 8.9506 1.2355 -2.180283      2.034274  
1 1 1 0  20 9  o 20.866 0.6183 450.082  25.803  451.583   36.434  448.571   36.548  20.904 0.8715 20.829 0.8773 0.7436943E-01  1.236593  
1 1 1 0  20 10 o 12.148 0.7867 156.430  19.095  163.429   27.772  150.155   26.298  12.401 1.1198 11.895 1.1054 0.5053177      1.573425  
1 1 1 0  20 11 o 3.1503 1.0142 -10.3898 14.246  -20.6389  19.290  1.9067    21.129  2.7019 1.2881 3.5986 1.5670 -0.8966227     2.028473  
1 1 1 0  20 12 o 4.8206 1.1658 22.807   15.044  3.7833    21.108  42.444    21.446  3.6827 1.5849 5.9586 1.7101 -2.275904      2.331594  
1 1 1 0  20 13 o 6.7236 1.2527 55.594   17.090  51.191    23.621  60.431    24.758  6.4364 1.7767 7.0108 1.7664 -0.5744128     2.505408  
1 1 1 0  20 14 o 3.0230 0.9942 -18.1029 15.107  -0.5871   21.488  -35.2219  21.243  3.5068 1.5517 2.5392 1.2433 0.9676323      1.988357  
1 1 1 0  20 15 o 5.4603 1.0986 31.452   16.274  63.813    21.923  -8.2685   24.288  7.4463 1.5234 3.4744 1.5833 3.971872       2.197219  
1 1 1 0  20 16 o 3.4950 1.0859 -0.6860  14.812  5.4645    20.529  -7.3639   21.392  3.7124 1.5794 3.2775 1.4907 0.4348900      2.171754  
1 1 1 0  20 17 f 3.9335 1.1723 8.1456   15.860  12.888    21.040  1.9041    24.138  4.0811 1.6546 3.7860 1.6610 0.2951548      2.344533  
1 1 1 0  20 18 o 5.7292 1.3052 39.215   17.211  44.678    23.027  32.301    25.906  6.1173 1.7768 5.3411 1.9124 0.7762346      2.610398  
1 1 1 0  20 19 o 3.6655 1.1332 -0.0131  16.065  8.1822    22.081  -9.2287   23.416  3.9468 1.6564 3.3841 1.5470 0.5627582      2.266455  
1 1 1 0  20 20 o 5.8308 1.2802 40.153   17.518  22.608    24.509  58.478    25.048  4.7340 1.8270 6.9276 1.7937 -2.193586      2.560355  
1 1 1 0  20 21 o 4.0247 1.1992 6.1849   16.745  -5.4553   22.082  21.936    25.687  3.3643 1.5240 4.6852 1.8521 -1.320819      2.398497  
1 1 1 0  20 22 o 3.5883 1.1577 -5.9763  17.941  -9.4622   22.987  -0.5440   28.696  3.2751 1.5102 3.9014 1.7550 -0.6262660     2.315334  
1 1 1 0  20 23 o 6.6873 1.3969 60.649   19.886  51.762    26.233  72.654    30.490  6.1587 1.9212 7.2160 2.0283 -1.057249      2.793714  
1 1 1 0  20 24 o 4.9806 1.3743 36.708   19.650  34.500    26.097  39.599    29.859  4.8811 1.8849 5.0801 2.0004 -0.1990280     2.748531  
1 1 1 0  20 25 o 4.2431 1.2965 21.835   19.726  19.398    25.128  25.746    31.842  4.0845 1.7427 4.4017 1.9200 -0.3172112     2.593011  
1 1 1 0  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  20 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  20 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  21 0  o 14.364 0.9953 219.991  27.142  222.354   34.888  216.369   43.199  14.572 1.2166 14.157 1.5756 -0.000000      0.000000  
1 1 1 0  21 1  o 9.6492 0.8075 97.858   15.492  100.652   21.015  94.534    22.927  9.8277 1.0692 9.4706 1.2104 0.3571424      1.615014  
1 1 1 0  21 2  o 8.2886 0.8810 72.884   14.552  77.160    20.200  68.271    20.981  8.5657 1.1791 8.0116 1.3094 0.5541849      1.762055  
1 1 1 0  21 3  o 2.9799 0.9450 -6.9091  12.031  1.4129    16.057  -17.5590  18.165  3.2400 1.3880 2.7199 1.2828 0.5200846      1.890014  
1 1 1 0  21 4  o 9.6412 0.8355 100.877  15.655  117.132   21.155  81.200    23.276  10.599 0.9980 8.6833 1.3402 1.915759       1.670991  
1 1 1 0  21 5  o 3.7593 1.0334 8.0028   12.319  21.502    16.769  -7.8243   18.158  4.4976 1.5441 3.0211 1.3738 1.476454       2.066790  
1 1 1 0  21 6  o 5.7288 1.1203 37.458   13.296  33.352    18.351  41.996    19.292  5.4081 1.5906 6.0496 1.5780 -0.6414094     2.240547  
1 1 1 0  21 7  o 13.125 0.6831 178.702  17.841  155.365   24.489  205.099   26.045  12.195 1.0041 14.056 0.9265 -1.861316      1.366229  
1 1 1 0  21 8  f 10.948 0.7075 125.543  15.425  127.981   22.982  123.545   20.807  11.023 1.0425 10.874 0.9568 0.1492500      1.414987  
1 1 1 0  21 9  o 8.4132 1.0264 87.811   16.390  147.906   23.142  27.332    23.215  11.859 0.9757 4.9678 1.8061 6.890853       2.052813  
1 1 1 0  21 10 o 11.866 0.8296 152.261  19.391  180.950   27.468  123.756   27.379  13.069 1.0508 10.662 1.2839 2.407315       1.659140  
1 1 1 0  21 11 o 11.178 0.8464 135.939  18.718  157.886   26.547  114.243   26.395  12.152 1.0923 10.205 1.2932 1.946828       1.692790  
1 1 1 0  21 12 o 6.4663 1.2237 50.119   17.062  73.307    24.936  29.709    23.395  7.8606 1.6392 5.0719 1.8172 2.788739       2.447315  
1 1 1 0  21 13 o 13.730 0.7988 205.501  21.521  237.507   29.640  169.811   31.299  14.990 0.9887 12.471 1.2549 2.518919       1.597588  
1 1 1 0  21 14 o 8.0561 1.1458 74.685   18.122  61.701    25.004  89.052    26.303  7.1707 1.7572 8.9416 1.4708 -1.770945      2.291508  
1 1 1 0  21 15 o 3.6918 1.1394 0.5042   16.252  -9.8532   23.668  9.7452    22.356  3.3692 1.5458 4.0143 1.6743 -0.6450727     2.278758  
1 1 1 0  21 16 f 7.8055 1.1482 71.908   17.992  40.283    24.750  107.347   26.201  5.7353 1.8746 9.8757 1.3265 -4.140403      2.296441  
1 1 1 0  21 17 o 3.9235 1.1755 5.2772   16.403  14.518    22.383  -5.4423   24.108  4.2791 1.7165 3.5680 1.6065 0.7110724      2.350989  
1 1 1 0  21 18 o 12.151 0.8624 158.934  20.922  158.798   28.792  159.087   30.454  12.171 1.1829 12.130 1.2553 0.4024410E-01  1.724774  
1 1 1 0  21 19 o 9.3930 1.1881 99.982   21.428  137.978   33.231  72.939    28.034  11.070 1.5010 7.7163 1.8421 3.353322       2.376164  
1 1 1 0  21 20 o 6.9684 1.2973 59.445   18.273  52.636    24.445  68.069    27.510  6.5304 1.8093 7.4064 1.8598 -0.8760371     2.594658  
1 1 1 0  21 21 o 10.106 1.1041 119.588  20.971  83.851    28.750  160.227   30.658  8.1990 1.8024 12.014 1.2759 -3.814818      2.208274  
1 1 1 0  21 22 o 11.260 1.4504 122.302  27.227  84.558    30.151  289.046   63.374  8.0113 1.9090 14.508 2.1841 -6.497020      2.900723  
1 1 1 0  21 23 o 3.8776 1.2296 7.7947   19.710  10.419    26.058  4.2859    30.130  3.8977 1.7175 3.8575 1.7601 0.4024982E-01  2.459201  
1 1 1 0  21 24 o 2.9407 1.0091 -30.2965 19.475  -7.5095   25.066  -65.0019  30.934  3.2492 1.5244 2.6322 1.3227 0.6170413      2.018233  
1 1 1 0  21 25 o 5.2865 1.4525 53.999   22.254  56.104    28.352  50.621    35.914  5.5691 2.0000 5.0039 2.1068 0.5651627      2.904916  
1 1 1 0  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  21 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  21 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  22 0  o 8.7176 1.5303 95.975   21.892  98.842    26.967  90.432    37.491  9.3705 1.5718 8.0647 2.6261 -0.000000      0.000000  
1 1 1 0  22 1  o 10.090 0.8240 107.408  16.597  100.357   22.683  115.534   24.349  9.7347 1.1650 10.445 1.1656 -0.7098980     1.648040  
1 1 1 0  22 2  o 5.8188 1.1112 37.955   14.372  58.919    20.601  18.078    20.060  7.2380 1.4732 4.3996 1.6639 2.838409       2.222338  
1 1 1 0  22 3  o 2.6207 0.8613 -15.0822 11.427  -3.0706   15.366  -29.9466  17.093  2.9509 1.3086 2.2906 1.1203 0.6603382      1.722632  
1 1 1 0  22 4  o 7.0615 1.0696 56.779   14.950  68.258    20.712  44.294    21.600  7.9653 1.3001 6.1576 1.6987 1.807660       2.139138  
1 1 1 0  22 5  o 8.2452 0.9628 74.749   15.004  50.616    20.402  103.175   22.143  6.6244 1.5648 9.8660 1.1222 -3.241547      1.925597  
1 1 1 0  22 6  f 13.953 0.6935 204.679  19.307  220.475   27.313  188.904   27.295  14.519 0.9406 13.388 1.0194 1.130841       1.387063  
1 1 1 0  22 7  o 6.2571 1.0614 46.745   14.464  67.984    19.699  21.901    21.306  7.9154 1.2444 4.5987 1.7199 3.316786       2.122813  
1 1 1 0  22 8  o 11.414 0.7540 138.837  17.117  152.430   23.972  124.698   24.448  12.028 0.9965 10.800 1.1319 1.228475       1.508051  
1 1 1 0  22 9  o 7.1242 0.9859 57.676   13.537  53.009    19.151  62.336    19.137  6.7935 1.4535 7.4549 1.3324 -0.6613679     1.971792  
1 1 1 0  22 10 o 8.6605 1.0563 86.133   17.756  74.102    24.873  98.635    25.354  7.8961 1.6291 9.4248 1.3451 -1.528691      2.112627  
1 1 1 0  22 11 o 3.5389 1.1049 -1.2211  15.522  -8.6906   21.883  6.3416    22.020  3.2549 1.4908 3.8229 1.6312 -0.5679705     2.209830  
1 1 1 0  22 12 o 7.9137 1.1626 73.593   17.799  73.603    25.256  73.582    25.088  7.9101 1.6498 7.9172 1.6384 -0.7068634E-02 2.325132  
1 1 1 0  22 13 o 3.1867 1.0485 -16.2987 16.521  -5.7384   22.667  -28.2653  24.129  3.4362 1.5514 2.9372 1.4110 0.4990170      2.097093  
1 1 1 0  22 14 o 6.1836 1.2506 45.529   17.426  24.813    24.138  68.077    25.183  4.8298 1.8255 7.5374 1.7098 -2.707612      2.501203  
1 1 1 0  22 15 o 3.3260 1.0792 -9.9222  16.338  -12.9538  22.968  -6.8171   23.245  3.2215 1.4939 3.4305 1.5578 -0.2090564     2.158361  
1 1 1 0  22 16 o 4.3570 1.2470 14.731   16.874  16.762    22.866  12.303    25.004  4.4114 1.7463 4.3026 1.7806 0.1087775      2.493976  
1 1 1 0  22 17 o 8.8948 1.1483 91.030   19.913  94.289    27.339  87.347    29.062  9.2011 1.4857 8.5885 1.7513 0.6126289      2.296541  
1 1 1 0  22 18 o 11.304 0.9206 138.405  20.573  112.687   27.766  169.712   30.635  10.094 1.3753 12.513 1.2241 -2.418637      1.841155  
1 1 1 0  22 19 o 11.520 0.9553 148.875  21.493  172.588   29.407  121.686   31.489  12.663 1.1611 10.376 1.5174 2.287144       1.910678  
1 1 1 0  22 20 o 5.7708 1.4014 42.206   19.726  33.008    26.940  52.838    28.964  5.2263 1.9380 6.3154 2.0249 -1.089093      2.802889  
1 1 1 0  22 21 o 6.7350 1.3388 60.593   19.282  72.800    26.540  46.948    28.060  7.5681 1.7828 5.9019 1.9978 1.666245       2.677550  
1 1 1 0  22 22 o 3.6931 1.1849 1.1315   18.835  4.1804    24.361  -3.4000   29.699  3.6779 1.6384 3.7083 1.7123 -0.3045988E-01 2.369888  
1 1 1 0  22 23 o 4.0974 1.2922 12.801   20.818  8.5037    26.247  20.088    34.181  3.8093 1.6985 4.3855 1.9479 -0.5762317     2.584462  
1 1 1 0  22 24 o 4.9256 1.3298 39.507   21.547  63.274    27.833  3.9606    34.038  6.0943 1.9877 3.7568 1.7670 2.337476       2.659545  
1 1 1 0  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  22 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  22 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  22 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  23 0  o 11.805 1.4465 172.863  26.432  189.813   32.158  137.560   46.410  13.363 1.2270 10.246 2.6198 -0.000000      0.000000  
1 1 1 0  23 1  o 11.175 0.8205 133.663  18.321  126.062   25.646  141.585   26.182  10.836 1.1834 11.514 1.1370 -0.6782026     1.641053  
1 1 1 0  23 2  f 7.1229 1.1197 57.988   15.525  46.452    20.570  73.258    23.666  6.2710 1.6263 7.9747 1.5395 -1.703698      2.239458  
1 1 1 0  23 3  o 6.8207 1.1568 55.227   15.822  41.759    22.209  69.108    22.547  5.8883 1.7544 7.7530 1.5084 -1.864623      2.313695  
1 1 1 0  23 4  o 3.0095 0.9695 -9.2110  12.622  -15.6270  16.235  0.5950    20.070  2.5498 1.2056 3.4693 1.5185 -0.9195030     1.938948  
1 1 1 0  23 5  o 10.258 1.3258 135.911  22.055  106.075   43.872  146.002   25.513  8.8050 2.4176 11.711 1.0892 -2.906442      2.651611  
1 1 1 0  23 6  o 12.734 0.7311 171.368  18.617  169.969   26.071  172.823   26.593  12.686 1.0276 12.783 1.0402 -0.9767914E-01 1.462147  
1 1 1 0  23 7  o 7.1990 1.0862 60.253   15.096  57.692    20.261  63.449    22.634  7.0579 1.4825 7.3400 1.5880 -0.2821012     2.172393  
1 1 1 0  23 8  f 4.2693 1.1594 17.819   13.880  17.527    18.883  18.162    20.471  4.2205 1.6100 4.3181 1.6688 -0.9759235E-01 2.318837  
1 1 1 0  23 9  f 5.4918 1.1077 36.337   14.075  52.310    18.850  16.210    21.159  6.7327 1.4432 4.2509 1.6808 2.481823       2.215374  
1 1 1 0  23 10 o 13.201 0.6943 183.686  18.303  187.506   26.759  180.328   25.090  13.314 1.0049 13.089 0.9584 0.2249975      1.388698  
1 1 1 0  23 11 o 7.7935 1.1911 71.781   18.022  75.589    25.118  67.740    25.874  8.0602 1.6144 7.5268 1.7517 0.5334454      2.382174  
1 1 1 0  23 12 o 4.7407 1.2626 19.124   17.236  3.0155    23.139  39.200    25.832  3.7840 1.6438 5.6974 1.9169 -1.913372      2.525179  
1 1 1 0  23 13 o 7.3474 1.2284 67.954   19.097  92.121    25.811  38.722    28.388  9.0733 1.4224 5.6216 2.0031 3.451708       2.456708  
1 1 1 0  23 14 o 5.1966 1.3115 30.549   17.276  26.409    24.191  34.857    24.680  4.9490 1.8362 5.4441 1.8730 -0.4950986     2.622975  
1 1 1 0  23 15 o 7.2060 1.2542 62.142   18.461  83.471    26.752  42.754    25.507  8.4731 1.6379 5.9389 1.8998 2.534146       2.508387  
1 1 1 0  23 16 o 4.6162 1.3176 18.021   18.763  16.900    25.957  19.249    27.153  4.5386 1.8386 4.6938 1.8879 -0.1552215     2.635268  
1 1 1 0  23 17 f 7.6577 1.2092 71.950   19.185  102.280   26.736  39.755    27.545  9.6070 1.3915 5.7084 1.9779 3.898540       2.418346  
1 1 1 0  23 18 o 5.0923 1.3240 21.883   19.270  -0.4722   25.369  52.374    29.628  3.7828 1.6793 6.4018 2.0475 -2.618968      2.648046  
1 1 1 0  23 19 o 4.3256 1.2743 12.960   18.478  3.4956    25.054  24.248    27.362  3.8480 1.6902 4.8031 1.9074 -0.9551051     2.548503  
1 1 1 0  23 20 o 4.5417 1.3083 19.980   18.702  15.855    25.589  24.711    27.402  4.3182 1.7953 4.7652 1.9036 -0.4469686     2.616653  
1 1 1 0  23 21 o 3.3026 1.0932 -19.5551 18.481  -41.5210  24.933  7.2282    27.532  2.6448 1.3052 3.9604 1.7542 -1.315577      2.186488  
1 1 1 0  23 22 f 5.8222 1.3463 52.252   21.459  78.177    28.160  16.348    33.139  7.3643 1.8995 4.2801 1.9085 3.084266       2.692629  
1 1 1 0  23 23 o 3.9401 1.2173 10.110   20.757  34.902    26.503  -29.2210  33.383  4.7135 1.8755 3.1667 1.5523 1.546783       2.434611  
1 1 1 0  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  23 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  23 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 0  o 13.282 1.3192 209.048  29.771  235.477   38.037  167.260   47.830  14.856 1.3033 11.709 2.2941 -0.000000      0.000000  
1 1 1 0  24 1  f 3.6476 1.0595 3.5249   13.368  19.331    19.197  -11.3567  18.627  4.3799 1.6336 2.9152 1.3496 1.464658       2.118979  
1 1 1 0  24 2  o 5.3522 1.2329 34.105   15.438  40.151    20.520  26.219    23.435  5.8019 1.6750 4.9025 1.8096 0.8994541      2.465839  
1 1 1 0  24 3  o 6.8500 1.1999 56.474   16.358  54.361    22.895  58.678    23.379  6.7123 1.7028 6.9877 1.6911 -0.2754011     2.399855  
1 1 1 0  24 4  o 5.1298 1.2132 31.162   14.619  31.352    19.979  30.943    21.448  5.1420 1.6844 5.1175 1.7465 0.2454090E-01  2.426417  
1 1 1 0  24 5  o 7.3192 1.1661 64.454   16.644  68.122    22.740  60.221    24.427  7.6247 1.5441 7.0138 1.7477 0.6109033      2.332146  
1 1 1 0  24 6  o 3.0198 0.9778 -9.1170  13.196  -13.8658  17.504  -2.8636   20.086  2.7197 1.2753 3.3199 1.4827 -0.6002014     1.955670  
1 1 1 0  24 7  o 11.463 0.8276 142.195  18.944  143.896   26.193  140.328   27.430  11.562 1.1327 11.364 1.2069 0.1987057      1.655188  
1 1 1 0  24 8  o 12.494 0.8487 165.368  20.475  156.286   25.548  181.675   34.234  12.131 1.0530 12.857 1.3314 -0.7255764     1.697473  
1 1 1 0  24 9  o 19.053 0.6616 380.532  25.114  417.736   35.535  343.403   35.499  20.028 0.8871 18.079 0.9818 1.949755       1.323215  
1 1 1 0  24 10 o 5.0421 1.2398 28.298   15.898  38.369    21.914  17.109    23.099  5.6689 1.7539 4.4154 1.7528 1.253552       2.479629  
1 1 1 0  24 11 o 4.5863 1.1802 22.495   13.969  21.074    18.840  24.231    20.816  4.4612 1.6263 4.7114 1.7106 -0.2501855     2.360301  
1 1 1 0  24 12 o 6.3617 1.1948 45.642   14.335  40.989    16.926  57.447    26.960  5.9539 1.4377 6.7694 1.9088 -0.8155050     2.389672  
1 1 1 0  24 13 o 3.4330 1.1075 -9.1002  16.865  -3.9887   22.154  -16.1466  26.011  3.4761 1.5544 3.3900 1.5781 0.8608198E-01  2.215066  
1 1 1 0  24 14 o 8.2247 1.2680 81.079   20.269  81.142    28.739  81.017    28.591  8.2248 1.7973 8.2246 1.7890 0.2031326E-03  2.535931  
1 1 1 0  24 15 o 12.265 0.9292 164.540  22.720  172.429   31.514  156.000   32.786  12.622 1.2484 11.908 1.3766 0.7137470      1.858324  
1 1 1 0  24 16 o 8.3860 1.2618 87.151   21.000  112.009   28.662  58.339    30.857  10.034 1.4283 6.7384 2.0806 3.295073       2.523695  
1 1 1 0  24 17 o 4.7920 1.3052 16.918   19.446  44.574    28.601  -6.8576   26.518  5.9442 2.0169 3.6398 1.6571 2.304371       2.610312  
1 1 1 0  24 18 o 3.2708 1.0941 -21.7581 18.835  -31.8318  25.321  -9.2801   28.181  2.9104 1.4097 3.6311 1.6736 -0.7207377     2.188223  
1 1 1 0  24 19 o 12.511 0.9211 176.078  23.010  176.950   31.748  175.113   33.397  12.587 1.2612 12.435 1.3429 0.1522760      1.842248  
1 1 1 0  24 20 o 10.666 1.5481 139.885  28.878  229.066   57.858  110.297   33.326  12.239 2.4492 9.0926 1.8941 3.146586       3.096112  
1 1 1 0  24 21 o 4.7400 1.2328 20.879   20.231  60.548    26.963  -30.2265  30.603  6.3608 1.9417 3.1191 1.5197 3.241645       2.465692  
1 1 1 0  24 22 o 6.9696 1.4838 82.878   22.628  87.535    30.084  76.810    34.338  7.4748 1.9806 6.4644 2.2099 1.010378       2.967541  
1 1 1 0  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  24 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 0  o 5.4763 1.9050 45.092   24.834  26.871    30.311  82.299    43.313  4.0366 2.3285 6.9160 3.0155 -0.000000      0.000000  
1 1 1 0  25 1  o 4.5222 1.1464 16.341   15.061  -5.2085   20.752  40.328    21.894  3.2857 1.4839 5.7586 1.7478 -2.472951      2.292784  
1 1 1 0  25 2  o 4.2872 1.2171 15.660   16.009  19.178    22.007  11.704    23.333  4.4424 1.7266 4.1319 1.7158 0.3104525      2.434164  
1 1 1 0  25 3  f 5.0979 1.1412 27.997   16.078  52.350    21.174  -5.1607   24.707  6.6268 1.6129 3.5690 1.6148 3.057728       2.282314  
1 1 1 0  25 4  o 3.5759 1.1019 2.0695   14.802  3.5802    20.339  0.3687    21.581  3.5987 1.5522 3.5531 1.5644 0.4559684E-01  2.203822  
1 1 1 0  25 5  o 4.6026 1.2208 20.261   15.401  11.602    20.524  31.417    23.298  4.0009 1.6297 5.2042 1.8182 -1.203288      2.441666  
1 1 1 0  25 6  o 6.2070 1.0429 41.887   16.218  83.086    22.953  0.8170    22.918  8.7246 1.3154 3.6895 1.6186 5.035145       2.085718  
1 1 1 0  25 7  o 3.4896 1.0571 1.2186   13.898  11.839    17.781  -15.4589  22.282  3.8727 1.5377 3.1065 1.4509 0.7662072      2.114195  
1 1 1 0  25 8  o 12.783 0.7942 174.350  20.292  166.186   28.315  182.970   29.094  12.466 1.1356 13.099 1.1105 -0.6329603     1.588392  
1 1 1 0  25 9  f 13.503 0.7620 193.723  20.540  181.586   28.065  207.726   30.144  13.051 1.0752 13.955 1.0800 -0.9039068     1.523979  
1 1 1 0  25 10 o 10.077 0.9763 113.957  19.380  129.184   26.754  97.149    28.110  10.898 1.2274 9.2552 1.5186 1.643226       1.952643  
1 1 1 0  25 11 o 3.4097 1.0834 -4.8720  15.429  -1.5295   20.700  -9.0494   23.142  3.4482 1.5245 3.3712 1.5399 0.7694411E-01  2.166873  
1 1 1 0  25 12 o 13.803 0.7930 204.951  21.599  223.848   29.311  182.495   31.951  14.590 1.0045 13.017 1.2273 1.572905       1.586005  
1 1 1 0  25 13 o 7.9228 1.1249 72.428   17.186  67.864    23.574  77.607    25.109  7.6494 1.5927 8.1963 1.5891 -0.5469203     2.249817  
1 1 1 0  25 14 o 11.194 1.0097 140.497  22.125  170.058   31.250  110.784   31.330  12.519 1.2481 9.8681 1.5874 2.650764       2.019342  
1 1 1 0  25 15 o 5.3674 1.3405 31.382   19.714  50.529    26.610  8.0867    29.352  6.3986 1.9235 4.3362 1.8675 2.062414       2.680975  
1 1 1 0  25 16 o 5.4210 1.3728 34.685   19.835  49.488    27.519  18.681    28.614  6.2066 1.9721 4.6354 1.9103 1.571231       2.745591  
1 1 1 0  25 17 o 10.334 1.1167 125.954  22.368  138.770   31.273  112.530   32.005  11.056 1.4143 9.6112 1.7285 1.444913       2.233404  
1 1 1 0  25 18 o 5.3914 1.4273 37.581   20.736  38.720    27.745  36.141    31.210  5.4529 1.9757 5.3299 2.0604 0.1230230      2.854566  
1 1 1 0  25 19 o 6.7794 1.3971 65.893   20.697  78.466    28.397  51.647    30.227  7.6219 1.8756 5.9369 2.0712 1.684919       2.794216  
1 1 1 0  25 20 o 5.1407 1.4240 39.173   21.280  30.210    28.418  50.614    32.108  4.7047 1.9172 5.5767 2.1060 -0.8720407     2.847956  
1 1 1 0  25 21 o 5.5541 1.4425 54.088   21.759  61.273    28.158  43.439    34.280  6.1009 1.9997 5.0073 2.0796 1.093626       2.885059  
1 1 1 0  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  25 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 0  o 5.0646 1.5514 44.323   23.071  64.571    26.329  -22.6424  47.880  6.9144 2.1689 3.2149 2.2190 -0.000000      0.000000  
1 1 1 0  26 1  o 4.6062 1.2718 19.493   17.107  13.156    23.894  26.158    24.504  4.2672 1.7506 4.9452 1.8454 -0.6780181     2.543651  
1 1 1 0  26 2  o 4.7020 1.1582 19.393   15.776  42.733    21.658  -6.9878   23.026  5.9817 1.7191 3.4224 1.5527 2.559299       2.316479  
1 1 1 0  26 3  o 4.8372 1.2042 22.298   16.430  43.003    22.612  -0.8582   23.913  5.9798 1.7676 3.6947 1.6357 2.285077       2.408316  
1 1 1 0  26 4  o 4.7427 1.4667 8.8265   20.636  28.372    49.296  4.6735    22.723  5.6586 2.4283 3.8267 1.6456 1.831832       2.933365  
1 1 1 0  26 5  o 4.8714 1.2787 23.910   16.942  13.673    22.997  36.062    25.055  4.2369 1.7254 5.5058 1.8876 -1.268887      2.557358  
1 1 1 0  26 6  o 4.0622 1.1553 8.5781   14.995  -4.5974   19.825  26.192    22.922  3.2440 1.4590 4.8804 1.7916 -1.636441      2.310515  
1 1 1 0  26 7  o 13.941 0.7944 209.142  22.084  225.872   31.173  192.288   31.289  14.545 1.0716 13.337 1.1730 1.208359       1.588808  
1 1 1 0  26 8  o 18.194 0.6872 348.681  25.002  341.625   35.187  355.875   35.533  18.003 0.9772 18.385 0.9663 -0.3820839     1.374333  
1 1 1 0  26 9  o 7.3973 1.2380 66.077   18.241  78.949    25.175  51.851    26.467  8.2865 1.5766 6.5080 1.9091 1.778466       2.475962  
1 1 1 0  26 10 o 5.2639 1.3232 31.330   17.746  37.420    24.234  24.288    26.058  5.6209 1.8558 4.9070 1.8866 0.7139454      2.646353  
1 1 1 0  26 11 o 8.9782 1.0825 90.785   18.970  81.403    25.897  101.651   27.867  8.3868 1.6023 9.5697 1.4560 -1.182952      2.165038  
1 1 1 0  26 12 o 5.3363 1.3181 31.114   17.863  18.077    24.164  46.821    26.524  4.5100 1.7920 6.1625 1.9333 -1.652458      2.636130  
1 1 1 0  26 13 o 5.4962 1.2871 34.972   18.700  55.452    24.760  7.7812    28.529  6.7335 1.8027 4.2589 1.8377 2.474652       2.574267  
1 1 1 0  26 14 o 9.9430 0.9524 108.508  18.850  96.601    26.467  120.764   26.852  9.3423 1.4165 10.544 1.2734 -1.201354      1.904735  
1 1 1 0  26 15 o 4.1013 1.1801 10.825   14.654  3.6022    18.052  24.780    25.092  3.4146 1.4675 4.7879 1.8484 -1.373313      2.360118  
1 1 1 0  26 16 o 6.1286 1.4359 50.106   20.600  54.029    28.420  45.763    29.903  6.3777 2.0013 5.8795 2.0595 0.4981780      2.871741  
1 1 1 0  26 17 o 3.8560 1.1926 -2.3045  19.678  22.635    25.559  -38.6075  30.837  4.5913 1.8369 3.1208 1.5216 1.470540       2.385281  
1 1 1 0  26 18 o 5.0283 1.4306 32.723   21.848  24.857    28.656  43.643    33.764  4.6226 1.9091 5.4339 2.1312 -0.8113060     2.861217  
1 1 1 0  26 19 o 4.8536 1.3704 29.753   21.534  6.8392    29.930  54.347    31.008  3.9102 1.7725 5.7970 2.0904 -1.886772      2.740733  
1 1 1 0  26 20 f 2.9262 1.0131 -31.4453 20.235  -17.1413  26.599  -51.0950  31.176  3.0728 1.4775 2.7797 1.3865 0.2930815      2.026190  
1 1 1 0  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  26 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 0  o 7.0991 1.9398 81.142   25.856  82.960    29.729  75.496    52.385  8.0122 2.1469 6.1861 3.2314 -0.000000      0.000000  
1 1 1 0  27 1  o 13.071 0.8795 186.500  22.698  152.312   31.571  223.077   32.655  11.736 1.3450 14.405 1.1335 -2.668131      1.758937  
1 1 1 0  27 2  o 13.143 0.8206 186.199  21.479  165.053   29.850  208.905   30.931  12.327 1.2108 13.958 1.1080 -1.631563      1.641222  
1 1 1 0  27 3  o 6.7312 1.2825 56.303   18.002  68.315    25.274  43.934    25.646  7.5261 1.7170 5.9364 1.9056 1.589614       2.565078  
1 1 1 0  27 4  o 9.1346 1.0391 94.983   18.454  100.643   25.483  88.742    26.759  9.5524 1.3339 8.7169 1.5936 0.8354731      2.078185  
1 1 1 0  27 5  o 5.2402 1.2716 31.069   16.232  23.063    21.868  40.891    24.222  4.6821 1.7441 5.7984 1.8510 -1.116306      2.543245  
1 1 1 0  27 6  f 3.8979 1.1764 3.5536   16.692  -8.1382   23.678  15.104    23.535  3.4422 1.5666 4.3535 1.7553 -0.9112904     2.352715  
1 1 1 0  27 7  o 15.811 0.7522 265.383  23.608  294.160   32.925  234.933   33.869  16.760 0.9823 14.862 1.1394 1.897378       1.504368  
1 1 1 0  27 8  o 9.7652 1.1273 111.718  20.572  145.661   28.827  76.488    29.368  11.612 1.2413 7.9188 1.8820 3.692799       2.254525  
1 1 1 0  27 9  o 7.2806 1.1948 64.400   18.388  91.279    25.324  34.423    26.744  9.1111 1.3898 5.4501 1.9440 3.660987       2.389644  
1 1 1 0  27 10 o 5.6978 1.2974 36.257   18.348  14.587    25.371  60.021    26.568  4.3992 1.8042 6.9964 1.8648 -2.597217      2.594738  
1 1 1 0  27 11 o 3.0290 1.0174 -22.1464 16.710  -19.4942  22.875  -25.1807  24.468  3.0351 1.4339 3.0229 1.4437 0.1215911E-01  2.034802  
1 1 1 0  27 12 o 3.1748 1.0410 -15.7653 16.301  -2.7940   21.069  -35.1097  25.730  3.4248 1.5248 2.9247 1.4177 0.5001400      2.082088  
1 1 1 0  27 13 o 4.3641 1.3080 12.206   19.631  9.1779    26.074  16.169    29.830  4.1459 1.7722 4.5822 1.9242 -0.4362907     2.615986  
1 1 1 0  27 14 o 10.443 1.1544 130.899  22.581  168.567   31.974  93.415    31.896  12.310 1.2987 8.5758 1.9088 3.734032       2.308706  
1 1 1 0  27 15 o 7.0531 1.4185 65.893   22.328  39.915    30.755  94.842    32.466  5.5504 2.0682 8.5558 1.9418 -3.005410      2.836913  
1 1 1 0  27 16 o 4.2838 1.2752 15.765   18.665  19.112    25.573  11.949    27.306  4.3986 1.8085 4.1690 1.7984 0.2295494      2.550466  
1 1 1 0  27 17 o 8.5288 1.2380 97.498   20.779  77.561    28.998  118.537   29.790  7.3092 1.9483 9.7484 1.5279 -2.439164      2.475973  
1 1 1 0  27 18 o 4.0455 1.2561 13.491   19.021  10.784    24.050  18.014    31.083  3.8179 1.6669 4.2731 1.8796 -0.4552581     2.512249  
1 1 1 0  27 19 o 2.7932 0.9796 -40.8275 20.241  -46.5373  26.780  -33.2193  30.912  2.5855 1.2889 3.0009 1.4756 -0.4153531     1.959258  
1 1 1 0  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  27 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 0  o 6.2670 1.7600 68.784   27.380  89.071    32.435  18.483    51.072  8.3101 2.2576 4.2239 2.7008 -0.000000      0.000000  
1 1 1 0  28 1  o 9.1117 1.1154 94.662   19.480  71.746    27.176  118.879   27.936  7.7658 1.7868 10.458 1.3357 -2.691751      2.230896  
1 1 1 0  28 2  f 3.7152 1.1597 -3.4092  17.305  9.1298    24.688  -15.5225  24.265  4.1547 1.7479 3.2756 1.5246 0.8790810      2.319395  
1 1 1 0  28 3  o 10.090 0.9961 110.379  19.843  88.939    26.609  137.241   29.784  8.9485 1.4868 11.231 1.3260 -2.282542      1.992173  
1 1 1 0  28 4  o 8.6927 1.1855 91.074   19.830  121.347   27.451  58.035    28.678  10.564 1.2993 6.8215 1.9833 3.742420       2.371011  
1 1 1 0  28 5  o 5.6088 1.2403 33.448   17.302  9.7991    23.545  61.211    25.511  4.0981 1.7145 7.1194 1.7928 -3.021294      2.480642  
1 1 1 0  28 6  o 7.1367 1.3414 62.506   19.475  62.836    27.164  62.156    27.934  7.1718 1.8733 7.1015 1.9205 0.7028341E-01  2.682883  
1 1 1 0  28 7  o 7.6452 1.3143 71.174   19.900  69.943    28.584  72.331    27.720  7.5524 1.8954 7.7380 1.8214 -0.1856532     2.628696  
1 1 1 0  28 8  o 3.6366 1.1441 -7.3762  17.220  -22.7327  23.071  11.937    25.873  2.9749 1.4156 4.2983 1.7977 -1.323363      2.288124  
1 1 1 0  28 9  o 5.0606 1.2967 23.781   18.968  49.197    26.954  -1.1542   26.698  6.2735 1.9458 3.8476 1.7145 2.425870       2.593410  
1 1 1 0  28 10 o 11.266 0.9792 139.522  22.009  151.944   31.473  127.634   30.789  11.793 1.3344 10.739 1.4335 1.054345       1.958413  
1 1 1 0  28 11 o 9.7803 1.1476 111.707  21.923  120.072   31.246  103.596   30.767  10.261 1.5226 9.2999 1.7174 0.9608154      2.295171  
1 1 1 0  28 12 o 7.9109 1.3833 81.869   22.697  110.045   32.208  54.071    31.991  9.4911 1.7616 6.3308 2.1331 3.160259       2.766512  
1 1 1 0  28 13 o 4.8905 1.4176 24.112   22.316  30.807    31.184  17.083    31.950  5.1532 2.0395 4.6277 1.9696 0.5254741      2.835285  
1 1 1 0  28 14 o 7.2281 1.4235 71.505   22.658  45.551    31.762  98.400    32.333  5.7626 2.1099 8.6935 1.9116 -2.930938      2.847077  
1 1 1 0  28 15 o 6.5386 1.4756 60.776   23.044  37.420    31.463  87.802    33.846  5.2615 2.0590 7.8158 2.1141 -2.554285      2.951138  
1 1 1 0  28 16 o 5.3783 1.4459 45.437   21.810  33.298    29.825  59.389    31.975  4.7990 1.9608 5.9576 2.1255 -1.158622      2.891808  
1 1 1 0  28 17 o 3.1041 1.0651 -31.2542 19.778  -53.4572  25.645  1.3354    31.069  2.4570 1.2303 3.7512 1.7388 -1.294219      2.130102  
1 1 1 0  28 18 o 7.0764 1.3867 80.104   20.226  78.232    26.945  82.520    30.613  7.1464 1.8653 7.0065 2.0526 0.1399159      2.773500  
1 1 1 0  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  28 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 0  o 5.2422 1.6711 44.314   28.165  77.107    33.114  -41.4728  53.559  7.3457 2.5106 3.1388 2.2062 -0.000000      0.000000  
1 1 1 0  29 1  o 4.0739 1.1731 -3.0337  17.618  -34.3904  24.150  32.640    25.759  2.8145 1.3664 5.3333 1.9072 -2.518819      2.346199  
1 1 1 0  29 2  o 5.7669 1.2885 36.436   18.363  13.056    25.061  63.540    26.983  4.3207 1.7849 7.2131 1.8588 -2.892411      2.577013  
1 1 1 0  29 3  o 5.2721 1.5653 24.611   23.738  15.789    57.571  26.418    26.056  5.5515 2.4925 4.9927 1.8944 0.5588379      3.130685  
1 1 1 0  29 4  o 8.3924 1.2034 85.433   19.680  107.642   26.891  59.821    28.878  9.8914 1.3593 6.8934 1.9862 2.997990       2.406800  
1 1 1 0  29 5  f 6.1573 1.3901 47.131   19.401  53.859    28.041  40.953    26.871  6.5348 1.9768 5.7797 1.9550 0.7551374      2.780250  
1 1 1 0  29 6  o 11.397 0.9542 143.045  21.626  125.456   30.250  161.433   30.930  10.620 1.4242 12.173 1.2704 -1.553143      1.908474  
1 1 1 0  29 7  o 5.6108 1.3187 34.391   19.649  6.5631    28.362  60.079    27.249  4.2336 1.8295 6.9880 1.8998 -2.754378      2.637453  
1 1 1 0  29 8  o 6.5851 1.3813 53.758   20.484  74.456    29.366  34.143    28.587  7.7525 1.9071 5.4177 1.9989 2.334827       2.762697  
1 1 1 0  29 9  o 4.7876 1.2948 20.431   19.215  42.429    26.476  -4.0519   27.931  5.7895 1.9406 3.7857 1.7145 2.003723       2.589531  
1 1 1 0  29 10 o 7.3662 1.3800 72.278   22.117  43.409    32.067  98.469    30.544  5.7770 2.1193 8.9554 1.7681 -3.178434      2.759956  
1 1 1 0  29 11 o 9.2376 1.3223 106.784  23.991  130.098   34.842  85.764    33.083  10.448 1.6673 8.0267 2.0527 2.421819       2.644523  
1 1 1 0  29 12 o 5.9909 1.4868 49.510   22.649  60.362    30.970  37.032    33.209  6.5926 2.0917 5.3893 2.1136 1.203330       2.973687  
1 1 1 0  29 13 o 4.9271 1.3671 14.566   23.147  -26.0770  31.306  63.579    34.379  3.3485 1.6082 6.5058 2.2112 -3.157254      2.734219  
1 1 1 0  29 14 o 4.9712 1.4428 35.408   22.996  37.614    32.141  33.095    32.916  5.0600 2.0473 4.8825 2.0336 0.1775289      2.885688  
1 1 1 0  29 15 o 3.0531 1.0541 -31.4294 20.574  -38.6918  27.045  -21.4520  31.700  2.7753 1.3677 3.3309 1.6045 -0.5556326     2.108270  
1 1 1 0  29 16 o 4.0254 1.2513 2.7232   20.966  -28.7125  27.779  44.333    31.959  2.9327 1.4330 5.1181 2.0518 -2.185430      2.502688  
1 1 1 0  29 17 o 4.2955 1.3312 27.219   21.714  25.569    28.640  29.449    33.302  4.2255 1.8322 4.3656 1.9317 -0.1401205     2.662397  
1 1 1 0  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  29 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 0  o 3.7035 1.5732 11.982   25.933  35.793    28.687  -94.4635  60.654  4.5803 2.3916 2.8267 2.0444 -0.000000      0.000000  
1 1 1 0  30 1  f 8.8084 1.2825 92.871   21.841  92.757    30.961  92.984    30.815  8.7983 1.8196 8.8186 1.8079 -0.2032757E-01 2.565015  
1 1 1 0  30 2  o 7.1354 1.3762 62.373   20.381  49.873    27.708  77.110    30.086  6.3443 1.9737 7.9265 1.9184 -1.582230      2.752417  
1 1 1 0  30 3  o 5.5323 1.3201 32.839   19.772  4.3393    28.631  58.820    27.337  4.1654 1.8187 6.8992 1.9140 -2.733854      2.640260  
1 1 1 0  30 4  o 6.4754 1.4131 52.165   20.480  66.846    30.063  39.452    27.975  7.2574 2.0048 5.6933 1.9921 1.564085       2.826276  
1 1 1 0  30 5  o 5.0504 1.3246 24.123   19.149  3.8829    25.888  48.577    28.455  3.9456 1.7259 6.1552 2.0099 -2.209605      2.649203  
1 1 1 0  30 6  o 5.9445 1.4795 46.137   21.965  50.642    30.165  41.053    32.047  6.1996 2.0714 5.6894 2.1129 0.5102205      2.958956  
1 1 1 0  30 7  o 3.3447 1.1023 -15.7772 18.343  -3.9338   25.551  -28.3725  26.349  3.6309 1.6425 3.0585 1.4706 0.5723341      2.204680  
1 1 1 0  30 8  o 3.9570 1.2425 1.8461   19.913  -8.7657   30.277  9.9353    26.435  3.7616 1.7341 4.1524 1.7800 -0.3908036     2.485018  
1 1 1 0  30 9  o 3.1620 1.0769 -29.5404 20.000  -27.3773  29.992  -31.2727  26.840  3.3049 1.5838 3.0190 1.4597 0.2859075      2.153850  
1 1 1 0  30 10 o 7.8521 1.4076 84.196   22.611  66.065    32.947  100.338   31.086  6.8091 2.1572 8.8951 1.8090 -2.085962      2.815279  
1 1 1 0  30 11 o 5.1757 1.4875 34.308   24.119  32.283    33.704  36.433    34.530  5.0907 2.0827 5.2608 2.1243 -0.1700273     2.974982  
1 1 1 0  30 12 o 7.1370 1.5355 79.730   24.279  96.074    35.142  64.807    33.581  7.9299 2.1581 6.3440 2.1847 1.585906       3.070933  
1 1 1 0  30 13 o 6.5508 1.5592 71.741   24.577  56.299    33.522  89.689    36.139  5.7866 2.1587 7.3150 2.2505 -1.528363      3.118429  
1 1 1 0  30 14 f 4.5138 1.3496 27.447   21.074  31.097    27.142  21.908    33.438  4.6578 1.8825 4.3697 1.9345 0.2880492      2.699272  
1 1 1 0  30 15 o 3.2270 1.1042 -18.0982 21.668  -13.7253  28.140  -24.4675  33.961  3.1955 1.5321 3.2585 1.5905 -0.6303573E-01 2.208406  
1 1 1 0  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  30 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 0  o 2.7247 1.3913 -33.5223 25.617  -30.8795  28.127  -46.3761  62.030  2.1730 1.5412 3.2763 2.3169 -0.000000      0.000000  
1 1 1 0  31 1  o 9.1525 1.2950 104.042  22.873  107.068   32.800  101.177   31.913  9.2857 1.8312 9.0192 1.8317 0.2665424      2.590060  
1 1 1 0  31 2  o 5.1544 1.2989 18.393   20.626  64.759    30.707  -19.7243  27.842  6.9600 2.0605 3.3488 1.5821 3.611140       2.597796  
1 1 1 0  31 3  o 7.0798 1.4092 65.950   21.049  54.629    29.447  77.778    30.101  6.4023 2.0406 7.7573 1.9440 -1.354960      2.818351  
1 1 1 0  31 4  o 4.9142 1.3862 25.158   21.047  13.309    30.464  35.978    29.112  4.4469 1.9086 5.3815 2.0108 -0.9346557     2.772439  
1 1 1 0  31 5  o 4.4794 1.2765 4.3617   21.302  -39.4415  30.743  44.816    29.544  3.1340 1.5261 5.8247 2.0467 -2.690781      2.553072  
1 1 1 0  31 6  f 10.252 1.1766 126.813  23.472  136.286   32.866  116.952   33.532  10.816 1.5193 9.6870 1.7969 1.129074       2.353126  
1 1 1 0  31 7  o 6.9382 1.5079 67.088   22.896  77.991    34.464  58.472    30.635  7.3992 2.1808 6.4773 2.0831 0.9219069      3.015791  
1 1 1 0  31 8  o 5.0923 1.3496 25.357   21.565  60.513    30.803  -8.4378   30.200  6.5014 2.0886 3.6832 1.7098 2.818190       2.699178  
1 1 1 0  31 9  o 3.9991 1.2635 4.3209   21.000  -7.3944   30.089  15.447    29.323  3.6711 1.7050 4.3272 1.8651 -0.6561549     2.527000  
1 1 1 0  31 10 o 6.7059 1.5334 73.939   23.772  65.091    34.518  81.920    32.786  6.2014 2.2089 7.2104 2.1276 -1.009037      3.066849  
1 1 1 0  31 11 o 4.5510 1.3790 22.560   23.550  42.544    32.792  1.2740    33.843  5.2029 2.0810 3.8990 1.8100 1.303900       2.758014  
1 1 1 0  31 12 o 4.4166 1.3428 24.215   21.249  21.843    28.298  27.282    32.177  4.2963 1.8417 4.5368 1.9546 -0.2404761     2.685558  
1 1 1 0  31 13 o 4.7796 1.4336 37.746   23.712  36.826    31.643  38.925    35.812  4.7595 1.9891 4.7996 2.0650 -0.4009914E-01 2.867169  
1 1 1 0  31 14 o 4.1604 1.2863 9.2545   22.911  -33.1446  31.394  57.569    33.512  2.9639 1.4631 5.3569 2.1161 -2.393001      2.572658  
1 1 1 0  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  31 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 0  o 2.4378 1.2582 -50.3793 26.796  -40.3139  29.694  -94.5338  62.193  2.0949 1.5023 2.7807 2.0189 -0.000000      0.000000  
1 1 1 0  32 1  o 2.9397 1.0067 -34.3104 18.414  -52.9016  25.806  -15.0254  26.283  2.5667 1.2772 3.3128 1.5564 -0.7460752     2.013345  
1 1 1 0  32 2  o 5.5235 1.5050 42.761   26.388  -26.8248  62.966  57.586    29.064  4.6022 2.2277 6.4448 2.0241 -1.842599      3.009925  
1 1 1 0  32 3  o 4.9951 1.4112 30.161   21.636  21.214    32.675  37.146    28.873  4.6855 1.9929 5.3047 1.9985 -0.6191587     2.822391  
1 1 1 0  32 4  o 5.5804 1.4275 41.331   21.903  20.189    31.142  62.029    30.813  4.5894 1.9487 6.5713 2.0866 -1.981896      2.855019  
1 1 1 0  32 5  o 7.2885 1.4786 77.916   23.923  54.106    34.489  99.997    33.212  6.0059 2.1986 8.5711 1.9777 -2.565213      2.957242  
1 1 1 0  32 6  o 4.7209 1.3125 6.9734   22.264  64.265    33.274  -39.4705  29.959  6.4457 2.1755 2.9961 1.4691 3.449658       2.625040  
1 1 1 0  32 7  o 4.1002 1.2677 10.685   20.982  30.547    28.743  -11.9736  30.699  4.7251 1.9271 3.4753 1.6476 1.249809       2.535407  
1 1 1 0  32 8  o 3.7241 1.2247 -1.6678  22.127  -6.8457   32.475  2.8187    30.229  3.6511 1.7199 3.7971 1.7439 -0.1459229     2.449327  
1 1 1 0  32 9  o 3.1141 1.0706 -28.1258 21.200  -21.3697  28.417  -36.6047  31.835  3.1543 1.5193 3.0739 1.5087 0.8038378E-01  2.141136  
1 1 1 0  32 10 o 4.2515 1.3238 19.494   21.900  11.335    29.963  28.852    32.090  3.9534 1.7845 4.5495 1.9560 -0.5960755     2.647669  
1 1 1 0  32 11 o 4.3390 1.3674 24.430   23.992  16.964    32.746  33.083    35.253  4.0927 1.8547 4.5853 2.0096 -0.4926133     2.734710  
1 1 1 0  32 12 o 4.2914 1.3081 13.982   23.475  -31.0288  32.698  61.862    33.724  3.0516 1.5038 5.5312 2.1408 -2.479638      2.616199  
1 1 1 0  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  32 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 0  o 3.5195 1.6430 15.927   28.721  24.764    31.618  -25.7730  68.682  3.6577 2.2444 3.3814 2.4000 -0.000000      0.000000  
1 1 1 0  33 1  o 3.0477 1.0482 -31.0366 20.755  -52.4084  30.703  -13.0499  28.166  2.7868 1.3878 3.3085 1.5713 -0.5216837     2.096431  
1 1 1 0  33 2  o 4.6375 1.3729 27.942   21.895  41.317    31.016  14.655    30.913  5.1317 2.0330 4.1433 1.8457 0.9883933      2.745885  
1 1 1 0  33 3  o 6.4115 1.5275 68.003   23.429  82.271    34.420  55.686    31.981  7.0297 2.2019 5.7933 2.1178 1.236406       3.055045  
1 1 1 0  33 4  o 3.6823 1.2217 -6.7235  23.067  -19.6948  33.758  4.6368    31.592  3.4585 1.6634 3.9062 1.7898 -0.4476690     2.443411  
1 1 1 0  33 5  o 4.2948 1.2607 8.2428   20.943  49.011    29.779  -31.6550  29.459  5.5603 2.0419 3.0293 1.4793 2.530957       2.521402  
1 1 1 0  33 6  f 4.4871 1.3241 19.562   22.754  -18.7026  34.102  50.270    30.549  3.4532 1.6636 5.5210 2.0605 -2.067834      2.648218  
1 1 1 0  33 7  o 3.6640 1.2188 -7.2811  23.753  -32.5476  34.720  14.951    32.568  3.2184 1.5788 4.1096 1.8572 -0.8911395     2.437540  
1 1 1 0  33 8  o 5.2634 1.4770 50.030   23.185  49.644    32.463  50.432    33.123  5.2569 2.0808 5.2699 2.0968 -0.1295519E-01 2.954023  
1 1 1 0  33 9  o 4.1738 1.3275 21.800   23.464  31.698    32.904  11.559    33.470  4.4521 1.9466 3.8954 1.8054 0.5566738      2.654950  
1 1 1 0  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  33 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 0  o 3.2972 1.5485 8.8841   29.485  27.922    31.938  -100.9559 76.715  3.7118 2.2673 2.8826 2.1097 -0.000000      0.000000  
1 1 1 0  34 1  o 4.0906 1.3015 11.595   23.309  33.953    32.777  -11.2774  33.153  4.6855 1.9946 3.4957 1.6725 1.189816       2.603009  
1 1 1 0  34 2  f 4.2226 1.2988 16.312   21.692  -7.7561   30.078  42.401    31.315  3.4363 1.6296 5.0088 2.0229 -1.572530      2.597625  
1 1 1 0  34 3  o 3.3625 1.1373 -12.4575 21.691  -3.1593   30.955  -21.4272  30.403  3.5567 1.6766 3.1684 1.5371 0.3883343      2.274526  
1 1 1 0  34 4  o 4.8765 1.4528 42.289   24.102  44.393    35.836  40.551    32.568  4.9200 2.0898 4.8331 2.0188 0.8690119E-01  2.905588  
1 1 1 0  34 5  o 4.2636 1.3552 25.120   24.323  18.607    36.865  30.141    32.368  4.1215 1.9047 4.4057 1.9284 -0.2841473     2.710485  
1 1 1 0  34 6  o 2.9948 1.0441 -32.2081 22.465  -23.9128  30.575  -41.9410  33.119  3.0668 1.4996 2.9227 1.4532 0.1440566      2.088158  
1 1 1 0  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  34 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  35 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  36 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  37 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  38 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 0  39 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  3  o 28.960 0.5887 835.428  32.209  823.808   39.399  858.842   55.926  28.672 0.6871 29.248 0.9561 -0.5751228     1.177348  
1 1 1 1  1  4  o 16.662 0.4532 278.549  15.061  252.642   21.157  305.165   21.445  15.874 0.6664 17.450 0.6145 -1.575597      0.9064738 
1 1 1 1  1  5  o 38.224 0.4140 1464.94  31.305  1461.14   41.321  1470.08   47.962  38.174 0.5412 38.274 0.6266 -0.9939575E-01 0.8279554 
1 1 1 1  1  6  o 16.291 0.3471 267.145  11.148  274.137   14.691  257.654   17.116  16.546 0.4439 16.036 0.5336 0.5098019      0.6941615 
1 1 1 1  1  7  o 11.904 0.3282 141.308  7.5597  139.471   9.5242  144.437   12.428  11.802 0.4035 12.005 0.5176 -0.2032185     0.6563005 
1 1 1 1  1  8  o 22.857 0.3177 523.709  14.417  527.625   19.301  518.766   21.685  22.955 0.4204 22.758 0.4764 0.1976719      0.6353849 
1 1 1 1  1  9  o 26.686 0.3271 714.084  17.337  719.134   23.238  707.744   26.038  26.795 0.4336 26.576 0.4899 0.2189484      0.6542159 
1 1 1 1  1  10 o 19.165 0.2806 368.056  10.718  363.664   15.797  371.802   14.590  19.058 0.4144 19.272 0.3785 -0.2140541     0.5612891 
1 1 1 1  1  11 o 40.794 0.3216 1666.53  26.238  1653.59   37.008  1679.61   37.205  40.634 0.4554 40.953 0.4542 -0.3185120     0.6431976 
1 1 1 1  1  12 o 63.127 0.4236 3997.29  53.263  3947.75   78.758  4039.05   72.305  62.760 0.6275 63.494 0.5694 -0.7342529     0.8472859 
1 1 1 1  1  13 o 31.387 0.2958 986.532  18.565  1003.86   26.150  968.921   26.360  31.665 0.4129 31.108 0.4237 0.5569382      0.5916157 
1 1 1 1  1  14 o 20.672 0.2757 428.408  11.385  446.082   15.974  410.164   16.230  21.107 0.3784 20.238 0.4010 0.8691902      0.5513508 
1 1 1 1  1  15 o 17.510 0.2745 307.324  9.6052  314.988   13.423  299.284   13.750  17.735 0.3784 17.286 0.3977 0.4490585      0.5490055 
1 1 1 1  1  16 o 13.751 0.2813 190.731  7.6899  208.906   10.688  171.227   11.072  14.437 0.3702 13.065 0.4237 1.371349       0.5626465 
1 1 1 1  1  17 f 16.349 0.2831 269.887  9.2028  293.857   12.762  243.922   13.283  17.113 0.3729 15.584 0.4262 1.529714       0.5662694 
1 1 1 1  1  18 o 4.1819 0.4906 18.415   3.8752  19.959    5.0382  16.179    6.0639  4.4466 0.5665 3.9172 0.8010 0.5294111      0.9811227 
1 1 1 1  1  19 o 11.646 0.3045 137.345  7.0332  143.741   9.4932  129.562   10.472  11.954 0.3971 11.338 0.4618 0.6165075      0.6090222 
1 1 1 1  1  20 o 12.767 0.3053 165.151  7.7264  171.351   10.376  157.436   11.575  13.045 0.3977 12.489 0.4634 0.5561218      0.6106689 
1 1 1 1  1  21 o 5.9586 0.4273 36.026   4.9894  35.326    6.4153  37.098    7.9375  5.8966 0.5440 6.0206 0.6592 -0.1239586     0.8546680 
1 1 1 1  1  22 o 7.6912 0.3820 59.922   5.7771  58.833    7.4824  61.529    9.0905  7.6164 0.4912 7.7661 0.5853 -0.1497474     0.7640830 
1 1 1 1  1  23 o 6.7429 0.4325 44.238   5.6907  35.492    7.1889  58.915    9.3129  5.8935 0.6099 7.5922 0.6133 -1.698744      0.8649518 
1 1 1 1  1  24 o 10.356 0.3603 108.966  7.2976  109.849   9.4123  107.636   11.555  10.424 0.4515 10.288 0.5616 0.1359606      0.7205411 
1 1 1 1  1  25 o 10.051 0.3786 104.629  7.3191  111.027   9.3430  94.465    11.776  10.480 0.4458 9.6210 0.6120 0.8589869      0.7571016 
1 1 1 1  1  26 o 12.302 0.3546 153.072  8.4911  152.214   10.818  154.448   13.703  12.276 0.4406 12.329 0.5557 -0.5346966E-01 0.7092202 
1 1 1 1  1  27 o 4.9544 0.6488 24.697   5.8073  22.559    6.8883  29.952    10.798  4.6802 0.7359 5.2286 1.0687 -0.5484390     1.297524  
1 1 1 1  1  28 o 6.7815 0.5356 47.923   6.6426  48.262    7.9585  47.143    12.061  6.8722 0.5790 6.6908 0.9013 0.1814151      1.071263  
1 1 1 1  1  29 o 12.922 0.3881 170.599  9.5164  170.148   11.739  171.464   16.254  12.943 0.4535 12.901 0.6299 0.4209709E-01  0.7761835 
1 1 1 1  1  30 o 7.6233 0.5317 56.793   7.4857  49.453    8.8061  75.911    14.213  6.8725 0.6407 8.3741 0.8486 -1.501511      1.063305  
1 1 1 1  1  31 o 7.6673 0.6010 66.328   8.3129  69.595    10.031  59.166    14.853  8.1382 0.6163 7.1965 1.0320 0.9417715      1.201998  
1 1 1 1  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  2  o 47.803 0.5888 2292.96  56.290  2294.17   79.541  2291.75   79.671  47.816 0.8317 47.790 0.8335 0.2559662E-01  1.177537  
1 1 1 1  2  3  o 20.912 0.5624 443.374  22.094  452.934   27.116  424.495   38.106  21.262 0.6377 20.562 0.9266 0.6999836      1.124829  
1 1 1 1  2  4  o 18.837 0.5140 350.387  17.081  343.856   19.833  369.143   33.612  18.521 0.5354 19.152 0.8775 -0.6305218     1.027970  
1 1 1 1  2  5  o 32.473 0.5126 1058.77  33.292  1057.76   47.037  1059.79   47.126  32.457 0.7246 32.488 0.7253 -0.3096008E-01 1.025228  
1 1 1 1  2  6  o 33.281 0.5164 1111.69  34.374  1112.51   48.525  1110.86   48.700  33.294 0.7287 33.269 0.7319 0.2517700E-01  1.032840  
1 1 1 1  2  7  o 23.434 0.4365 550.962  20.035  551.646   25.848  549.932   31.711  23.459 0.5509 23.409 0.6773 0.5068970E-01  0.8730898 
1 1 1 1  2  8  o 35.111 0.4306 1236.31  30.234  1242.30   42.489  1230.16   43.030  35.199 0.6036 35.024 0.6143 0.1742020      0.8611834 
1 1 1 1  2  9  o 30.876 0.4144 956.131  25.590  950.025   35.892  962.442   36.494  30.776 0.5831 30.976 0.5891 -0.1995125     0.8288745 
1 1 1 1  2  10 o 38.673 0.4179 1499.23  31.979  1499.72   42.249  1498.58   48.935  38.688 0.5460 38.659 0.6329 0.2803802E-01  0.8358812 
1 1 1 1  2  11 o 17.743 0.3163 315.594  11.138  318.154   14.896  312.349   16.773  17.826 0.4178 17.660 0.4749 0.1664886      0.6325369 
1 1 1 1  2  12 o 26.178 0.3117 686.028  16.320  675.154   23.001  697.050   23.158  25.969 0.4429 26.387 0.4388 -0.4180241     0.6234474 
1 1 1 1  2  13 o 32.537 0.3285 1060.25  21.376  1050.25   30.151  1070.35   30.311  32.383 0.4655 32.691 0.4636 -0.3086243     0.6569930 
1 1 1 1  2  14 o 11.422 0.3059 130.767  6.9838  135.008   9.8192  126.426   9.9351  11.610 0.4229 11.234 0.4422 0.3758860      0.6118602 
1 1 1 1  2  15 o 42.281 0.3615 1792.62  30.566  1819.25   43.259  1766.08   43.194  42.595 0.5078 41.966 0.5146 0.6285400      0.7229820 
1 1 1 1  2  16 o 28.337 0.3212 806.311  18.195  836.728   25.698  775.732   25.766  28.875 0.4450 27.798 0.4634 1.076551       0.6424936 
1 1 1 1  2  17 o 11.841 0.3212 141.868  7.5548  155.932   10.492  126.723   10.888  12.459 0.4211 11.223 0.4851 1.235763       0.6423252 
1 1 1 1  2  18 o 15.656 0.3017 246.217  9.4418  251.374   13.625  241.454   13.096  15.813 0.4308 15.499 0.4225 0.3135738      0.6034161 
1 1 1 1  2  19 o 7.1358 0.3808 51.944   5.3830  57.765    7.4324  45.520    7.8068  7.5667 0.4911 6.7050 0.5822 0.8616967      0.7616521 
1 1 1 1  2  20 o 6.1486 0.4023 38.188   4.8593  37.550    6.2845  39.136    7.6630  6.0926 0.5157 6.2045 0.6175 -0.1118922     0.8045755 
1 1 1 1  2  21 o 17.858 0.2987 322.604  10.624  329.198   14.476  314.907   15.640  18.065 0.4007 17.651 0.4430 0.4135532      0.5973322 
1 1 1 1  2  22 o 8.8557 0.3665 81.401   6.2988  88.412    8.2145  71.396    9.8128  9.3484 0.4394 8.3631 0.5867 0.9853344      0.7329478 
1 1 1 1  2  23 o 2.8243 0.6403 8.4675   4.3377  11.314    5.3168  2.8022    7.5013  3.2399 0.8198 2.4087 0.9837 0.8311911      1.280523  
1 1 1 1  2  24 o 7.0766 0.4325 49.535   5.9715  44.505    7.5156  58.147    9.8346  6.6138 0.5682 7.5394 0.6522 -0.9255176     0.8649861 
1 1 1 1  2  25 o 12.535 0.3440 157.007  8.4963  147.619   10.974  171.057   13.425  12.084 0.4541 12.987 0.5169 -0.9030304     0.6879983 
1 1 1 1  2  26 o 10.525 0.3792 112.727  7.7216  113.665   9.7812  111.175   12.579  10.603 0.4612 10.447 0.6021 0.1566315      0.7584320 
1 1 1 1  2  27 o 11.327 0.3822 133.410  8.2451  141.706   10.398  119.361   13.532  11.842 0.4390 10.811 0.6258 1.031334       0.7644755 
1 1 1 1  2  28 o 10.034 0.4176 101.275  7.9815  97.541    9.8080  108.594   13.733  9.7961 0.5006 10.271 0.6685 -0.4752636     0.8351763 
1 1 1 1  2  29 o 8.1286 0.4911 65.933   7.3700  61.993    8.7565  75.507    13.648  7.7784 0.5629 8.4787 0.8048 -0.7003536     0.9821273 
1 1 1 1  2  30 o 2.8754 0.7645 8.2434   5.9523  10.781    6.7856  -0.2280   12.398  3.1025 0.9786 2.6484 1.1749 0.4540465      1.529040  
1 1 1 1  2  31 o 8.1128 0.6612 84.650   8.2151  98.143    9.7400  51.390    15.292  9.7423 0.4999 6.4832 1.2242 3.259058       1.322357  
1 1 1 1  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  2  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  3  0  o 18.729 0.6407 353.870  23.867  345.005   33.661  362.831   33.845  18.490 0.9154 18.968 0.8967 -0.000000      0.000000  
1 1 1 1  3  1  o 25.442 0.4730 648.617  24.066  660.075   34.041  637.169   34.027  25.667 0.6631 25.217 0.6747 0.4501381      0.9460124 
1 1 1 1  3  2  o 43.243 0.5645 1875.51  48.815  1904.44   69.138  1846.74   68.934  43.576 0.7933 42.909 0.8032 0.6666985      1.128954  
1 1 1 1  3  3  f 8.4593 0.4425 71.816   7.4552  63.616    10.431  80.378    10.659  7.9642 0.6549 8.9545 0.5952 -0.9902744     0.8849245 
1 1 1 1  3  4  o 12.962 0.5143 169.537  11.694  170.284   13.612  167.435   22.845  13.032 0.5223 12.891 0.8861 0.1409092      1.028523  
1 1 1 1  3  5  o 33.494 0.5189 1125.96  34.757  1136.64   49.144  1115.27   49.164  33.654 0.7301 33.334 0.7374 0.3191910      1.037748  
1 1 1 1  3  6  o 10.162 0.4707 103.593  9.5657  102.623   13.417  104.596   13.642  10.114 0.6633 10.210 0.6681 -0.9651279E-01 0.9414093 
1 1 1 1  3  7  o 9.6333 0.4826 93.273   9.2819  97.020    12.930  89.289    13.333  9.8345 0.6574 9.4322 0.7068 0.4022579      0.9652238 
1 1 1 1  3  8  o 27.373 0.4950 752.126  27.099  753.135   38.163  751.100   38.487  27.392 0.6966 27.354 0.7035 0.3804779E-01  0.9900477 
1 1 1 1  3  9  o 7.1783 0.5321 51.862   7.6258  53.142    10.557  50.465    11.027  7.2723 0.7258 7.0842 0.7783 0.1880708      1.064235  
1 1 1 1  3  10 o 30.551 0.4672 936.334  27.941  937.671   36.008  934.310   44.295  30.587 0.5886 30.514 0.7258 0.7267952E-01  0.9344855 
1 1 1 1  3  11 o 28.910 0.4139 837.195  23.923  801.692   33.442  874.405   34.237  28.282 0.5912 29.538 0.5795 -1.256062      0.8278880 
1 1 1 1  3  12 o 20.500 0.3924 420.391  16.074  395.474   22.299  447.344   23.192  19.868 0.5612 21.131 0.5487 -1.263660      0.7848895 
1 1 1 1  3  13 o 24.296 0.3482 591.276  16.914  569.941   23.761  613.192   24.082  23.852 0.4981 24.741 0.4867 -0.8894844     0.6963884 
1 1 1 1  3  14 o 28.376 0.3579 807.188  20.313  803.853   28.687  810.542   28.768  28.317 0.5065 28.435 0.5058 -0.1176739     0.7158598 
1 1 1 1  3  15 o 37.747 0.3884 1429.58  29.321  1450.79   41.536  1408.51   41.396  38.026 0.5462 37.467 0.5524 0.5596237      0.7768341 
1 1 1 1  3  16 o 4.7012 0.5013 22.838   4.5460  26.216    6.3478  19.282    6.5133  5.1016 0.6221 4.3009 0.7862 0.8006816      1.002571  
1 1 1 1  3  17 o 2.6506 0.6281 6.7949   3.9396  7.6551    5.3577  5.7824    5.8129  2.7529 0.8697 2.5482 0.9066 0.2047060      1.256252  
1 1 1 1  3  18 o 2.8184 0.6230 7.2368   4.1697  2.8690    5.6349  12.523    6.1992  2.2013 0.8683 3.4354 0.8937 -1.234136      1.246081  
1 1 1 1  3  19 o 6.4626 0.4375 42.291   5.6344  47.449    8.1617  37.594    7.7879  6.8417 0.5965 6.0836 0.6401 0.7580757      0.8749096 
1 1 1 1  3  20 f 8.9846 0.3873 81.662   6.9429  89.961    10.021  74.000    9.6284  9.4264 0.5315 8.5428 0.5635 0.8835545      0.7746639 
1 1 1 1  3  21 o 4.0633 0.6075 18.905   4.8632  25.183    6.4138  10.414    7.4591  4.9614 0.6464 3.1651 1.0288 1.796270       1.215024  
1 1 1 1  3  22 o 9.5873 0.3803 93.613   7.2571  94.257    9.8139  92.835    10.780  9.6323 0.5094 9.5423 0.5649 0.9005737E-01  0.7606478 
1 1 1 1  3  23 o 11.115 0.3708 125.544  8.1905  126.430   11.004  124.443   12.264  11.169 0.4926 11.061 0.5544 0.1077890      0.7416351 
1 1 1 1  3  24 o 12.045 0.3812 150.868  8.9548  171.431   12.007  125.093   13.443  13.018 0.4612 11.073 0.6070 1.944237       0.7623052 
1 1 1 1  3  25 o 23.396 0.3415 553.303  15.936  545.170   21.691  562.843   23.490  23.218 0.4671 23.573 0.4982 -0.3552341     0.6829509 
1 1 1 1  3  26 o 16.874 0.3596 290.846  11.988  306.284   16.033  271.274   18.053  17.406 0.4605 16.343 0.5523 1.063618       0.7191426 
1 1 1 1  3  27 o 2.7578 0.7405 6.1215   5.7135  8.7061    6.9744  0.8481    9.9623  2.9497 0.9960 2.5659 1.0961 0.3838422      1.481035  
1 1 1 1  3  28 o 11.451 0.4703 135.818  10.371  138.295   13.099  131.659   16.977  11.638 0.5628 11.264 0.7536 0.3741341      0.9405200 
1 1 1 1  3  29 o 10.636 0.4840 124.273  9.4836  140.266   11.878  96.148    15.751  11.723 0.5066 9.5486 0.8248 2.174798       0.9679299 
1 1 1 1  3  30 o 4.0322 0.7241 6.3005   7.0657  -7.2570   8.1983  45.451    13.932  1.8377 0.8652 6.2267 1.1614 -4.389091      1.448259  
1 1 1 1  3  31 o 9.0638 0.5584 89.643   9.3471  90.360    11.320  88.105    16.570  9.2671 0.6108 8.8604 0.9350 0.4067497      1.116849  
1 1 1 1  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  3  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  4  0  o 17.300 0.6459 302.444  22.204  297.074   31.269  307.905   31.535  17.143 0.9180 17.457 0.9088 -0.000000      0.000000  
1 1 1 1  4  1  o 20.560 0.4616 423.827  18.974  409.711   26.802  438.009   26.864  20.216 0.6629 20.904 0.6426 -0.6880779     0.9232202 
1 1 1 1  4  2  o 34.712 0.5221 1210.01  36.243  1199.91   51.120  1220.22   51.391  34.566 0.7395 34.858 0.7372 -0.2917557     1.044127  
1 1 1 1  4  3  o 32.116 0.5119 1036.73  32.878  1028.61   46.356  1044.95   46.637  31.989 0.7246 32.243 0.7232 -0.2534485     1.023729  
1 1 1 1  4  4  o 20.731 0.5344 432.306  19.475  433.179   22.679  429.854   38.001  20.791 0.5454 20.671 0.9192 0.1197109      1.068795  
1 1 1 1  4  5  o 12.556 0.4684 158.213  11.752  165.256   16.608  151.150   16.632  12.837 0.6469 12.275 0.6775 0.5618153      0.9367167 
1 1 1 1  4  6  o 7.0949 0.5184 50.565   7.3538  51.677    10.377  49.443    10.423  7.1737 0.7233 7.0161 0.7428 0.1575298      1.036746  
1 1 1 1  4  7  o 3.5829 0.7106 13.279   5.3940  16.415    7.5180  9.9515    7.7434  3.9600 0.9594 3.2059 1.0485 0.7540677      1.421209  
1 1 1 1  4  8  o 17.674 0.4754 313.760  16.793  322.897   23.599  304.387   23.901  17.936 0.6578 17.412 0.6864 0.5245266      0.9507070 
1 1 1 1  4  9  o 15.911 0.4771 254.135  15.179  254.630   21.290  253.624   21.647  15.927 0.6684 15.895 0.6810 0.3263855E-01  0.9541588 
1 1 1 1  4  10 o 17.552 0.4805 309.196  16.860  315.594   23.664  302.600   24.028  17.737 0.6671 17.366 0.6918 0.3710480      0.9610374 
1 1 1 1  4  11 o 24.983 0.4955 625.899  24.754  618.316   34.619  633.833   35.409  24.829 0.6971 25.138 0.7043 -0.3088341     0.9909804 
1 1 1 1  4  12 o 24.468 0.4954 600.466  24.235  595.552   33.838  605.642   34.727  24.366 0.6944 24.570 0.7067 -0.2041473     0.9907556 
1 1 1 1  4  13 o 18.023 0.3986 325.543  14.363  321.845   20.027  329.458   20.610  17.918 0.5589 18.128 0.5685 -0.2098961     0.7971823 
1 1 1 1  4  14 o 4.3923 0.6351 20.276   5.3422  21.167    7.0767  19.096    8.1455  4.5184 0.8130 4.2663 0.9758 0.2521696      1.270112  
1 1 1 1  4  15 o 32.859 0.4317 1085.01  28.360  1103.47   39.877  1066.11   40.341  33.144 0.6016 32.574 0.6192 0.5701714      0.8633189 
1 1 1 1  4  16 o 17.666 0.3492 313.657  12.330  300.648   17.403  326.770   17.471  17.297 0.5031 18.036 0.4844 -0.7389641     0.6983293 
1 1 1 1  4  17 o 6.1954 0.4932 39.660   5.9883  43.578    7.9887  34.634    9.0473  6.5622 0.6087 5.8287 0.7761 0.7335486      0.9863248 
1 1 1 1  4  18 o 9.6132 0.3914 93.357   7.5248  91.988    10.584  94.756    10.700  9.5418 0.5546 9.6847 0.5524 -0.1428680     0.7828068 
1 1 1 1  4  19 o 14.665 0.3611 217.452  10.584  206.538   14.894  228.586   15.044  14.290 0.5211 15.040 0.5001 -0.7501068     0.7222751 
1 1 1 1  4  20 o 9.1863 0.4102 85.607   7.5342  82.479    10.501  88.925    10.816  9.0130 0.5825 9.3597 0.5778 -0.3467112     0.8204889 
1 1 1 1  4  21 o 11.828 0.3901 142.130  9.2221  134.740   12.866  149.938   13.225  11.510 0.5589 12.147 0.5444 -0.6370087     0.7802394 
1 1 1 1  4  22 o 4.4606 0.6842 21.718   5.9193  21.375    8.1232  22.105    8.6434  4.4294 0.9457 4.4919 0.9889 -0.6241703E-01 1.368320  
1 1 1 1  4  23 o 2.0496 0.6430 -2.0092  5.1629  -2.5236   6.7083  -1.2619   8.0862  1.9062 0.8537 2.1929 0.9618 -0.2866880     1.285992  
1 1 1 1  4  24 o 5.9504 0.5814 36.367   6.8806  33.090    9.1600  40.609    10.423  5.6491 0.8108 6.2517 0.8336 -0.6026154     1.162862  
1 1 1 1  4  25 o 7.4638 0.5251 57.522   7.7275  59.191    10.206  55.280    11.829  7.6095 0.6706 7.3180 0.8082 0.2915244      1.050212  
1 1 1 1  4  26 o 12.811 0.4755 167.537  12.114  164.070   16.224  171.904   18.210  12.675 0.6400 12.946 0.7033 -0.2711124     0.9509140 
1 1 1 1  4  27 o 7.4279 0.5665 56.182   8.3224  51.756    10.840  62.537    12.988  7.0874 0.7648 7.7684 0.8360 -0.6810088     1.133008  
1 1 1 1  4  28 o 3.9373 0.8724 17.058   7.4476  16.627    9.3171  17.822    12.394  3.8637 1.1325 4.0110 1.3273 -0.1472645     1.744801  
1 1 1 1  4  29 o 17.970 0.4192 330.566  14.961  318.559   19.867  346.297   22.739  17.619 0.5638 18.321 0.6206 -0.7017040     0.8384350 
1 1 1 1  4  30 o 14.180 0.4659 212.701  12.909  221.676   16.815  199.819   20.144  14.625 0.5749 13.734 0.7333 0.8903103      0.9318121 
1 1 1 1  4  31 o 3.7950 0.9484 16.859   8.5919  13.088    10.512  24.449    14.913  3.3444 1.2154 4.2455 1.4562 -0.9011002     1.896815  
1 1 1 1  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  4  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  5  0  f 24.818 0.6841 621.582  33.829  601.540   47.620  642.002   48.067  24.410 0.9790 25.226 0.9558 -0.000000      0.000000  
1 1 1 1  5  1  o 16.704 0.4579 280.157  15.293  271.880   21.545  288.562   21.710  16.455 0.6547 16.954 0.6403 -0.4987926     0.9157258 
1 1 1 1  5  2  o 32.578 0.5158 1066.03  33.610  1062.96   47.482  1069.12   47.581  32.531 0.7298 32.625 0.7292 -0.9413528E-01 1.031672  
1 1 1 1  5  3  o 18.698 0.4658 350.678  17.416  354.091   24.598  347.247   24.663  18.790 0.6546 18.607 0.6628 0.1831760      0.9315013 
1 1 1 1  5  4  o 25.376 0.5650 655.496  25.020  665.027   29.120  628.617   48.903  25.760 0.5652 24.991 0.9784 0.7691822      1.129938  
1 1 1 1  5  5  o 36.161 0.4942 1318.14  35.013  1340.68   45.398  1285.05   55.006  36.559 0.6209 35.763 0.7690 0.7958450      0.9883949 
1 1 1 1  5  6  o 16.284 0.4749 266.052  15.464  260.603   21.847  271.524   21.892  16.117 0.6778 16.452 0.6653 -0.3352165     0.9497632 
1 1 1 1  5  7  o 38.435 0.5501 1484.15  42.286  1493.29   59.778  1475.00   59.825  38.554 0.7753 38.316 0.7807 0.2381058      1.100230  
1 1 1 1  5  8  o 3.9506 0.7516 16.000   6.1947  11.327    8.5026  21.286    9.0436  3.3972 1.0979 4.5039 1.0268 -1.106749      1.503247  
1 1 1 1  5  9  o 21.690 0.4878 471.959  21.157  473.476   29.736  470.405   30.110  21.726 0.6843 21.654 0.6952 0.7164764E-01  0.9755433 
1 1 1 1  5  10 o 18.188 0.4869 331.980  17.703  334.276   24.745  329.573   25.339  18.254 0.6778 18.123 0.6991 0.1307411      0.9737121 
1 1 1 1  5  11 o 34.267 0.5340 1177.92  36.594  1165.72   51.345  1190.52   52.168  34.087 0.7531 34.447 0.7572 -0.3599586     1.067981  
1 1 1 1  5  12 o 36.959 0.5471 1370.83  40.424  1314.15   56.504  1430.26   57.856  36.176 0.7810 37.743 0.7664 -1.567131      1.094233  
1 1 1 1  5  13 o 30.854 0.5224 955.857  32.222  917.175   44.999  996.562   46.160  30.212 0.7447 31.495 0.7328 -1.282785      1.044803  
1 1 1 1  5  14 o 16.764 0.5038 283.109  16.850  300.065   23.563  265.361   24.106  17.282 0.6817 16.245 0.7419 1.037025       1.007573  
1 1 1 1  5  15 o 10.275 0.5197 108.488  10.092  113.176   12.543  99.880    16.996  10.610 0.5911 9.9388 0.8550 0.6714334      1.039429  
1 1 1 1  5  16 o 10.688 0.4376 115.227  9.3230  116.512   12.722  113.736   13.702  10.756 0.5913 10.620 0.6451 0.1359615      0.8751260 
1 1 1 1  5  17 o 13.320 0.4712 183.862  12.125  197.355   15.630  163.473   19.213  13.975 0.5592 12.664 0.7586 1.311087       0.9424012 
1 1 1 1  5  18 o 22.340 0.3610 504.216  16.122  486.973   22.795  521.475   22.805  21.954 0.5192 22.726 0.5017 -0.7721024     0.7219974 
1 1 1 1  5  19 o 8.3014 0.4254 70.549   6.9964  60.288    9.9804  80.464    9.8106  7.6927 0.6487 8.9101 0.5505 -1.217460      0.8508179 
1 1 1 1  5  20 o 14.400 0.3724 210.318  10.698  228.547   15.208  192.459   15.053  15.026 0.5061 13.775 0.5464 1.251078       0.7447360 
1 1 1 1  5  21 o 2.9693 0.7252 8.6593   5.2352  8.9131    7.3286  8.3949    7.4810  2.9928 1.0209 2.9459 1.0302 0.4690051E-01  1.450387  
1 1 1 1  5  22 o 11.638 0.4357 136.869  10.071  152.493   15.385  125.154   13.323  12.207 0.6302 11.070 0.6018 1.137050       0.8713582 
1 1 1 1  5  23 o 5.5098 0.5950 31.536   6.5449  32.557    9.0918  30.437    9.4291  5.6097 0.8104 5.4098 0.8715 0.1999168      1.190028  
1 1 1 1  5  24 o 9.4859 0.4545 92.006   8.6105  85.210    11.946  99.355    12.422  9.1176 0.6551 9.8543 0.6303 -0.7367001     0.9090856 
1 1 1 1  5  25 o 5.8462 0.6562 36.328   7.3592  37.711    9.7005  34.452    11.296  6.0465 0.8022 5.6459 1.0386 0.4005761      1.312328  
1 1 1 1  5  26 o 3.2698 0.8085 10.167   6.4465  8.1939    8.3654  13.051    10.115  2.9875 1.0845 3.5521 1.1995 -0.5646052     1.617043  
1 1 1 1  5  27 o 5.2093 0.7269 28.340   7.3823  21.618    9.6862  37.657    11.403  4.4255 1.0993 5.9930 0.9514 -1.567546      1.453802  
1 1 1 1  5  28 o 5.6865 0.7368 35.643   7.9196  37.031    10.120  33.448    12.721  5.9399 0.8518 5.4330 1.2025 0.5069647      1.473686  
1 1 1 1  5  29 o 5.3699 0.7788 29.944   8.2112  17.986    10.399  49.747    13.382  3.9592 1.2052 6.7806 0.9868 -2.821370      1.557679  
1 1 1 1  5  30 o 8.1661 0.6052 71.219   9.7223  67.142    12.531  77.384    15.410  7.9214 0.7910 8.4107 0.9161 -0.4892983     1.210308  
1 1 1 1  5  31 o 3.5928 0.9313 13.789   8.6051  7.9921    10.669  24.576    14.555  2.9373 1.1827 4.2484 1.4388 -1.311053      1.862503  
1 1 1 1  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  5  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  6  0  o 5.9352 0.8325 39.268   8.7722  40.130    12.279  38.369    12.537  6.0299 1.1359 5.8406 1.2174 -0.000000      0.000000  
1 1 1 1  6  1  o 45.330 0.5862 2064.17  53.142  2046.95   74.955  2081.57   75.354  45.139 0.8303 45.520 0.8277 -0.3806915     1.172356  
1 1 1 1  6  2  o 22.947 0.4796 528.162  22.008  527.397   31.051  528.935   31.198  22.930 0.6771 22.963 0.6793 -0.3317451E-01 0.9591072 
1 1 1 1  6  3  o 11.999 0.4206 142.598  9.9753  133.693   12.991  155.392   15.572  11.550 0.5624 12.448 0.6255 -0.8987236     0.8411261 
1 1 1 1  6  4  o 31.393 0.5899 992.304  32.463  993.660   37.745  988.452   63.626  31.477 0.5996 31.310 1.0161 0.1669540      1.179778  
1 1 1 1  6  5  o 16.774 0.4368 282.045  14.340  281.735   18.468  282.516   22.758  16.767 0.5507 16.780 0.6781 -0.1377869E-01 0.8735875 
1 1 1 1  6  6  o 39.786 0.5588 1590.42  44.464  1618.14   63.029  1562.95   62.735  40.132 0.7853 39.440 0.7953 0.6927681      1.117671  
1 1 1 1  6  7  f 31.428 0.5222 992.416  32.820  1000.52   46.383  984.290   46.447  31.557 0.7349 31.299 0.7420 0.2584171      1.044340  
1 1 1 1  6  8  o 7.1065 0.5966 50.706   8.4543  45.550    11.707  56.326    12.222  6.7283 0.8700 7.4847 0.8165 -0.7564130     1.193108  
1 1 1 1  6  9  f 21.460 0.4925 462.060  21.136  459.940   29.712  464.231   30.074  21.410 0.6939 21.509 0.6991 -0.9910583E-01 0.9849756 
1 1 1 1  6  10 o 24.404 0.5000 597.485  24.403  601.527   34.286  593.336   34.739  24.489 0.7000 24.320 0.7142 0.1688232      1.000085  
1 1 1 1  6  11 o 38.509 0.5560 1488.24  42.820  1457.09   60.058  1520.45   61.067  38.098 0.7882 38.919 0.7845 -0.8202667     1.112093  
1 1 1 1  6  12 o 46.678 0.6028 2189.54  56.253  2111.86   78.756  2270.44   80.375  45.831 0.8592 47.525 0.8456 -1.693577      1.205526  
1 1 1 1  6  13 o 17.950 0.5032 323.228  18.049  306.973   24.993  340.943   26.091  17.478 0.7150 18.421 0.7082 -0.9425812     1.006342  
1 1 1 1  6  14 o 2.3444 0.7118 -3.0051  6.4799  4.2148    8.8578  -11.3175  9.5043  2.7488 1.0873 1.9399 0.9188 0.8088727      1.423523  
1 1 1 1  6  15 o 22.142 0.5079 494.254  22.443  450.696   31.220  540.839   32.286  21.128 0.7388 23.157 0.6971 -2.028776      1.015806  
1 1 1 1  6  16 o 3.2240 0.8227 8.1570   7.3074  14.490    9.8418  0.3763    10.909  3.7534 1.1777 2.6946 1.1490 1.058752       1.645318  
1 1 1 1  6  17 o 5.2618 0.8514 30.250   8.7681  33.452    11.907  26.458    12.960  5.5930 1.1036 4.9306 1.2969 0.6623478      1.702897  
1 1 1 1  6  18 o 18.478 0.4210 347.413  15.478  383.478   21.743  310.363   22.038  19.469 0.5584 17.487 0.6301 1.981697       0.8419551 
1 1 1 1  6  19 o 7.7115 0.5255 62.363   7.8994  72.994    10.742  49.843    11.657  8.4693 0.6342 6.9537 0.8382 1.515638       1.051062  
1 1 1 1  6  20 o 12.108 0.4659 149.902  11.282  150.870   15.951  148.932   15.959  12.148 0.6565 12.068 0.6612 0.8015060E-01  0.9318085 
1 1 1 1  6  21 o 11.264 0.4307 127.104  9.6126  148.342   14.851  111.789   12.611  12.057 0.6159 10.471 0.6022 1.585665       0.8613492 
1 1 1 1  6  22 o 11.880 0.4062 143.685  9.6451  149.945   13.952  137.955   13.348  12.127 0.5752 11.633 0.5737 0.4944000      0.8124393 
1 1 1 1  6  23 o 7.3853 0.4971 55.946   7.3405  56.777    10.536  55.162    10.233  7.4372 0.7083 7.3335 0.6977 0.1036816      0.9942201 
1 1 1 1  6  24 o 11.739 0.4258 140.747  9.9938  135.700   14.077  145.876   14.191  11.523 0.6108 11.955 0.5935 -0.4314175     0.8516597 
1 1 1 1  6  25 o 6.8687 0.5596 48.735   7.5756  38.588    10.464  59.910    10.981  6.0979 0.8580 7.6396 0.7187 -1.541752      1.119278  
1 1 1 1  6  26 o 8.3139 0.5184 71.574   8.5636  78.294    11.884  64.317    12.351  8.7388 0.6799 7.8890 0.7828 0.8498640      1.036876  
1 1 1 1  6  27 o 8.1727 0.5527 70.666   8.8213  80.244    11.873  58.864    13.179  8.8414 0.6714 7.5039 0.8782 1.337464       1.105453  
1 1 1 1  6  28 o 10.703 0.4863 117.359  10.365  105.253   13.975  132.163   15.454  10.092 0.6924 11.314 0.6830 -1.221713      0.9725162 
1 1 1 1  6  29 o 4.8404 0.8387 28.201   8.1261  32.897    10.576  21.434    12.696  5.4264 1.0118 4.2545 1.3380 1.171862       1.677493  
1 1 1 1  6  30 o 6.5576 0.7315 47.055   9.1510  35.395    11.850  64.278    14.403  5.4900 1.1173 7.6253 0.9444 -2.135250      1.462941  
1 1 1 1  6  31 o 4.7258 0.9005 27.064   8.8731  17.811    11.371  41.469    14.188  3.7458 1.2717 5.7058 1.2754 -1.960031      1.801059  
1 1 1 1  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  6  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  7  0  o 47.060 0.8499 2230.39  79.864  2176.15   112.035 2286.43   113.878 46.475 1.2072 47.644 1.1968 -0.000000      0.000000  
1 1 1 1  7  1  o 33.972 0.5280 1159.09  35.873  1169.76   50.788  1148.47   50.677  34.129 0.7441 33.816 0.7493 0.3131065      1.055974  
1 1 1 1  7  2  o 5.1448 0.5618 26.606   5.7716  24.726    8.0968  28.547    8.2293  4.9593 0.8163 5.3302 0.7719 -0.3709211     1.123516  
1 1 1 1  7  3  o 13.508 0.5614 190.116  13.087  197.375   15.244  169.776   25.517  14.033 0.5431 12.982 0.9828 1.051272       1.122871  
1 1 1 1  7  4  o 26.781 0.5683 717.314  26.727  713.857   31.056  727.186   52.481  26.686 0.5819 26.875 0.9764 -0.1892986     1.136620  
1 1 1 1  7  5  o 14.207 0.5561 204.899  13.858  207.242   16.160  198.389   26.941  14.379 0.5620 14.036 0.9597 0.3427515      1.112131  
1 1 1 1  7  6  o 41.612 0.5722 1741.25  47.618  1765.53   67.508  1717.20   67.177  41.902 0.8055 41.323 0.8128 0.5796318      1.144376  
1 1 1 1  7  7  o 15.126 0.4971 229.808  15.036  231.944   21.160  227.630   21.369  15.197 0.6962 15.054 0.7097 0.1432257      0.9941714 
1 1 1 1  7  8  o 19.657 0.4947 387.633  19.448  382.693   27.424  392.632   27.584  19.531 0.7021 19.784 0.6971 -0.2524433     0.9893906 
1 1 1 1  7  9  o 32.556 0.5299 1063.93  34.504  1060.61   48.620  1067.29   48.975  32.505 0.7479 32.606 0.7510 -0.1015472     1.059876  
1 1 1 1  7  10 o 14.677 0.5022 216.112  14.732  219.189   20.585  212.881   21.093  14.784 0.6962 14.569 0.7239 0.2159615      1.004362  
1 1 1 1  7  11 o 23.353 0.5027 547.097  23.474  538.679   32.855  555.875   33.550  23.170 0.7090 23.536 0.7127 -0.3664875     1.005318  
1 1 1 1  7  12 o 32.682 0.5335 1073.11  34.867  1056.40   48.992  1090.26   49.634  32.424 0.7555 32.940 0.7534 -0.5159950     1.066936  
1 1 1 1  7  13 o 23.572 0.5079 558.102  23.922  526.390   33.395  591.527   34.285  22.883 0.7297 24.261 0.7066 -1.378475      1.015721  
1 1 1 1  7  14 o 17.856 0.5082 320.504  18.101  290.018   25.132  353.366   26.093  16.971 0.7404 18.741 0.6962 -1.769501      1.016322  
1 1 1 1  7  15 o 22.235 0.6547 512.020  27.123  475.461   47.028  530.241   33.201  21.559 1.0907 22.911 0.7246 -1.352345      1.309425  
1 1 1 1  7  16 o 18.732 0.5142 356.379  19.260  347.960   26.871  365.274   27.619  18.505 0.7261 18.959 0.7284 -0.4538460     1.028451  
1 1 1 1  7  17 o 11.540 0.5678 135.882  13.090  139.534   18.261  132.020   18.775  11.706 0.7800 11.374 0.8254 0.3317947      1.135598  
1 1 1 1  7  18 o 11.954 0.8195 158.875  16.634  168.576   19.433  132.294   32.169  12.844 0.7565 11.063 1.4538 1.780563       1.638901  
1 1 1 1  7  19 o 7.5961 1.0821 77.277   14.110  90.764    16.433  39.433    27.526  9.3709 0.8768 5.8212 1.9786 3.549699       2.164174  
1 1 1 1  7  20 o 11.179 0.4862 128.142  10.832  114.310   15.090  142.842   15.557  10.545 0.7155 11.812 0.6585 -1.267442      0.9724378 
1 1 1 1  7  21 o 3.9445 0.8115 16.665   6.8363  12.617    9.0670  21.998    10.407  3.4550 1.1349 4.4339 1.1602 -0.9789047     1.622926  
1 1 1 1  7  22 o 10.387 0.4977 114.052  10.004  127.746   13.166  95.341    15.390  11.189 0.5883 9.5842 0.8029 1.604890       0.9953538 
1 1 1 1  7  23 o 9.3227 0.4638 89.440   8.5931  81.511    12.471  96.607    11.857  8.9125 0.6996 9.7328 0.6091 -0.8203382     0.9276490 
1 1 1 1  7  24 o 9.4002 0.4744 90.749   8.9014  87.270    12.828  93.980    12.362  9.2174 0.6959 9.5831 0.6450 -0.3657112     0.9487995 
1 1 1 1  7  25 o 4.8250 0.7399 25.461   6.9334  24.956    9.9119  25.945    9.7020  4.7709 1.0657 4.8792 1.0267 -0.1083260     1.479818  
1 1 1 1  7  26 o 12.126 0.4408 150.422  10.675  142.450   15.173  158.234   15.021  11.800 0.6430 12.453 0.6031 -0.6534529     0.8815451 
1 1 1 1  7  27 o 10.934 0.4831 123.064  10.562  121.237   14.746  124.990   15.136  10.853 0.6793 11.016 0.6870 -0.1631508     0.9661449 
1 1 1 1  7  28 o 6.8336 0.6270 49.114   8.5415  44.007    11.692  54.958    12.508  6.4460 0.9069 7.2212 0.8661 -0.7752447     1.254035  
1 1 1 1  7  29 o 8.3946 0.6294 72.700   10.312  60.000    12.984  94.398    16.971  7.4614 0.8701 9.3277 0.9097 -1.866291      1.258788  
1 1 1 1  7  30 o 3.0752 0.8475 8.4440   7.4023  5.4408    9.4686  13.165    11.871  2.7155 1.1066 3.4349 1.2840 -0.7194757     1.695028  
1 1 1 1  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  8  0  o 9.6536 0.7263 97.023   13.544  104.856   18.935  88.816    19.381  10.090 0.9582 9.2174 1.0917 -0.000000      0.000000  
1 1 1 1  8  1  o 7.9337 0.5075 63.183   8.0499  65.234    11.411  61.152    11.358  8.0623 0.7077 7.8052 0.7276 0.2571440      1.014974  
1 1 1 1  8  2  o 31.553 0.5195 999.410  32.782  995.674   46.321  1003.16   46.400  31.494 0.7354 31.612 0.7339 -0.1183968     1.038946  
1 1 1 1  8  3  o 23.626 0.5542 551.515  23.065  541.544   26.763  580.305   45.476  23.243 0.5757 24.010 0.9470 -0.7672482     1.108311  
1 1 1 1  8  4  o 9.6440 0.5993 96.005   9.9354  98.522    11.514  88.667    19.660  9.9125 0.5808 9.3755 1.0485 0.5370617      1.198594  
1 1 1 1  8  5  o 21.311 0.5563 454.298  20.843  451.744   24.231  461.563   40.869  21.224 0.5708 21.399 0.9549 -0.1747532     1.112539  
1 1 1 1  8  6  o 20.522 0.4966 423.012  20.376  410.984   28.761  435.132   28.870  20.228 0.7109 20.816 0.6935 -0.5880013     0.9931243 
1 1 1 1  8  7  o 51.635 0.6335 2680.13  65.426  2700.90   92.617  2659.44   92.436  51.836 0.8934 51.435 0.8986 0.4009628      1.267094  
1 1 1 1  8  8  o 20.688 0.4993 429.554  20.656  435.560   29.138  423.486   29.288  20.834 0.6993 20.542 0.7129 0.2922115      0.9986174 
1 1 1 1  8  9  o 16.509 0.5075 273.526  16.749  279.957   23.494  266.881   23.883  16.708 0.7031 16.311 0.7321 0.3968391      1.015057  
1 1 1 1  8  10 o 21.485 0.5045 463.108  21.678  461.906   30.472  464.340   30.846  21.457 0.7101 21.513 0.7169 -0.5577660E-01 1.009055  
1 1 1 1  8  11 o 32.904 0.5367 1087.06  35.308  1054.64   49.505  1120.62   50.373  32.404 0.7639 33.405 0.7540 -1.000172      1.073308  
1 1 1 1  8  12 o 20.680 0.5099 430.197  21.067  443.538   29.435  416.187   30.164  21.012 0.7004 20.348 0.7412 0.6637821      1.019799  
1 1 1 1  8  13 o 19.592 0.5108 385.455  19.996  363.701   27.785  408.828   28.800  19.018 0.7305 20.166 0.7141 -1.147861      1.021515  
1 1 1 1  8  14 o 3.8642 0.9257 14.416   8.5266  15.732    11.445  12.774    12.783  3.9564 1.2733 3.7720 1.3441 0.1844420      1.851469  
1 1 1 1  8  15 o 18.706 0.6441 361.221  22.778  339.555   38.523  372.867   28.245  18.212 1.0576 19.200 0.7355 -0.9876137     1.288240  
1 1 1 1  8  16 o 4.5715 0.9512 22.378   9.5826  14.984    13.574  29.725    13.530  3.9342 1.3869 5.2088 1.3023 -1.274679      1.902433  
1 1 1 1  8  17 o 11.935 0.8681 166.876  17.250  186.368   20.374  117.526   32.419  13.505 0.7543 10.365 1.5639 3.139956       1.736288  
1 1 1 1  8  18 o 16.110 0.6666 271.074  20.261  274.023   24.956  265.371   34.702  16.344 0.7635 15.876 1.0929 0.4682112      1.333154  
1 1 1 1  8  19 o 9.6580 0.7035 100.880  13.038  124.646   17.808  73.416    19.143  10.999 0.8095 8.3171 1.1508 2.681750       1.407035  
1 1 1 1  8  20 o 3.9612 0.9929 15.651   10.149  21.612    14.138  9.3120    14.579  4.4075 1.4149 3.5148 1.3934 0.8927240      1.985824  
1 1 1 1  8  21 o 3.3477 0.9243 5.5591   10.137  17.944    13.641  -9.7124   15.148  4.0719 1.3928 2.6236 1.2154 1.448334       1.848593  
1 1 1 1  8  22 o 3.6047 0.8761 12.725   7.6999  8.8767    10.265  17.675    11.643  3.1835 1.1932 4.0259 1.2831 -0.8423717     1.752132  
1 1 1 1  8  23 o 3.6228 0.8382 13.667   7.5990  20.153    9.9152  4.4328    11.830  4.2626 1.1406 2.9829 1.2287 1.279691       1.676498  
1 1 1 1  8  24 o 5.7061 0.7724 34.847   8.4073  33.970    10.694  36.266    13.604  5.7007 0.9379 5.7114 1.2275 -0.1077557E-01 1.544832  
1 1 1 1  8  25 o 10.494 0.4726 113.065  9.8785  106.652   14.364  118.822   13.608  10.198 0.7042 10.791 0.6305 -0.5927992     0.9452643 
1 1 1 1  8  26 o 9.3691 0.5145 90.520   9.6101  86.172    13.924  94.476    13.280  9.1413 0.7616 9.5970 0.6919 -0.4557590     1.028966  
1 1 1 1  8  27 o 3.7584 0.8471 15.330   7.0856  14.524    9.2028  16.504    11.104  3.6437 1.1381 3.8731 1.2550 -0.2293870     1.694201  
1 1 1 1  8  28 o 5.9559 0.7306 39.034   8.4532  42.865    11.783  34.972    12.134  6.3413 0.9290 5.5704 1.1279 0.7708912      1.461234  
1 1 1 1  8  29 o 5.7364 0.7537 37.408   8.4236  31.212    11.520  44.528    12.349  5.1349 1.1503 6.3379 0.9742 -1.202903      1.507386  
1 1 1 1  8  30 o 4.9618 0.8748 30.383   8.7528  24.047    12.046  37.470    12.740  4.3611 1.2904 5.5625 1.1816 -1.201399      1.749683  
1 1 1 1  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  8  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  9  0  o 25.133 0.7074 636.875  35.423  624.240   49.564  650.069   50.646  24.877 0.9999 25.388 1.0010 -0.000000      0.000000  
1 1 1 1  9  1  o 27.955 0.5074 784.689  28.370  789.557   40.145  779.832   40.098  28.042 0.7158 27.868 0.7194 0.1737919      1.014852  
1 1 1 1  9  2  o 33.766 0.5329 1145.48  35.991  1146.16   50.895  1144.80   50.903  33.776 0.7534 33.756 0.7540 0.2029800E-01  1.065884  
1 1 1 1  9  3  o 34.695 0.6245 1225.80  37.728  1240.72   43.838  1183.18   74.087  35.165 0.6233 34.225 1.0824 0.9401283      1.249004  
1 1 1 1  9  4  o 21.297 0.5673 459.577  21.184  463.268   24.675  449.233   41.308  21.491 0.5741 21.103 0.9787 0.3885098      1.134688  
1 1 1 1  9  5  o 26.140 0.5857 694.596  26.706  702.719   31.052  671.518   52.341  26.472 0.5865 25.808 1.0141 0.6647358      1.171443  
1 1 1 1  9  6  o 21.365 0.4577 457.198  19.139  455.293   24.630  460.100   30.409  21.314 0.5778 21.415 0.7100 -0.1003628     0.9153861 
1 1 1 1  9  7  o 32.723 0.5358 1075.20  35.051  1033.74   49.336  1117.46   49.807  32.084 0.7689 33.362 0.7465 -1.277935      1.071616  
1 1 1 1  9  8  o 37.813 0.5585 1435.17  42.238  1426.02   59.598  1444.41   59.870  37.691 0.7906 37.934 0.7891 -0.2424164     1.117049  
1 1 1 1  9  9  o 30.343 0.5268 923.752  31.968  911.203   44.980  936.561   45.441  30.134 0.7463 30.551 0.7437 -0.4167995     1.053604  
1 1 1 1  9  10 o 39.550 0.5675 1571.26  44.884  1551.15   63.198  1591.72   63.757  39.295 0.8042 39.806 0.8008 -0.5113983     1.134912  
1 1 1 1  9  11 o 22.850 0.5114 524.563  23.368  525.419   32.816  523.683   33.284  22.870 0.7174 22.831 0.7289 0.3946877E-01  1.022776  
1 1 1 1  9  12 o 11.182 0.5718 125.805  12.784  121.075   17.899  130.732   18.265  10.967 0.8160 11.397 0.8013 -0.4303493     1.143652  
1 1 1 1  9  13 o 26.068 0.6596 697.021  32.037  659.500   55.883  715.390   39.101  25.482 1.0965 26.654 0.7335 -1.171438      1.319216  
1 1 1 1  9  14 o 13.138 0.5812 176.650  14.809  125.307   20.525  232.399   21.387  11.103 0.9243 15.172 0.7048 -4.069121      1.162353  
1 1 1 1  9  15 o 6.0922 0.8511 39.723   9.9932  34.958    13.749  45.058    14.550  5.6850 1.2438 6.4993 1.1620 -0.8142385     1.702151  
1 1 1 1  9  16 o 7.1004 0.7749 53.295   10.630  58.339    14.557  47.533    15.560  7.5375 0.9656 6.6633 1.2122 0.8741641      1.549804  
1 1 1 1  9  17 o 16.762 0.5479 287.978  18.310  302.220   25.367  272.490   26.455  17.213 0.7369 16.311 0.8110 0.9023170      1.095728  
1 1 1 1  9  18 o 11.727 0.6160 142.855  14.361  154.013   19.836  130.565   20.818  12.236 0.8105 11.218 0.9279 1.018254       1.232031  
1 1 1 1  9  19 o 2.7615 0.8534 -2.6370  9.2813  4.7440    12.899  -10.5611  13.365  3.1054 1.2815 2.4176 1.1273 0.6878128      1.706784  
1 1 1 1  9  20 o 10.429 0.6787 116.176  13.822  139.719   19.205  90.879    19.908  11.609 0.8272 9.2494 1.0762 2.359269       1.357352  
1 1 1 1  9  21 o 5.6409 0.9396 38.260   11.900  58.580    15.868  12.143    17.989  7.4079 1.0710 3.8739 1.5440 3.533971       1.879101  
1 1 1 1  9  22 o 8.6184 0.8385 80.223   14.301  83.836    19.222  75.743    21.404  8.8870 1.0815 8.3499 1.2817 0.5371361      1.676977  
1 1 1 1  9  23 o 9.5788 0.8460 102.724  15.516  117.989   20.439  81.961    23.838  10.577 0.9662 8.5809 1.3890 1.995752       1.692009  
1 1 1 1  9  24 o 9.7571 0.6156 99.994   11.839  110.454   16.074  87.591    17.503  10.358 0.7759 9.1562 0.9558 1.201772       1.231117  
1 1 1 1  9  25 f 19.629 0.5724 398.626  21.325  398.706   26.348  398.475   36.309  19.737 0.6675 19.521 0.9300 0.2155590      1.144710  
1 1 1 1  9  26 o 11.022 0.5623 126.032  12.134  128.206   15.732  122.840   19.063  11.178 0.7037 10.866 0.8772 0.3123932      1.124546  
1 1 1 1  9  27 o 5.0513 0.7757 28.381   7.6155  31.746    11.043  25.330    10.516  5.3539 1.0687 4.7488 1.1246 0.6051145      1.551424  
1 1 1 1  9  28 o 7.4579 0.6513 60.016   9.5865  55.415    14.379  63.698    12.862  7.1517 1.0053 7.7642 0.8283 -0.6125407     1.302575  
1 1 1 1  9  29 o 2.4592 0.7457 -1.1393  7.0992  7.4981    10.007  -9.8917   10.073  2.9378 1.1577 1.9806 0.9404 0.9571875      1.491465  
1 1 1 1  9  30 o 3.3775 0.7841 11.444   7.4446  23.895    10.266  -2.3680   10.812  4.4082 1.1517 2.3467 1.0644 2.061467       1.568231  
1 1 1 1  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  9  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  10 0  o 2.4544 0.9942 7.3024   7.7799  4.6328    10.501  10.551    11.583  2.1797 1.3162 2.7290 1.4905 -0.000000      0.000000  
1 1 1 1  10 1  o 8.9579 0.5169 80.667   9.2517  85.269    13.131  76.131    13.037  9.2128 0.7127 8.7030 0.7490 0.5097437      1.033867  
1 1 1 1  10 2  o 28.708 0.4726 830.854  26.617  845.706   34.603  809.331   41.655  29.035 0.5959 28.381 0.7338 0.6542473      0.9452999 
1 1 1 1  10 3  o 32.823 0.6153 1095.94  35.272  1109.19   41.046  1058.51   68.971  33.255 0.6171 32.391 1.0646 0.8635521      1.230583  
1 1 1 1  10 4  o 14.326 0.5803 206.849  14.502  207.611   16.828  204.647   28.592  14.393 0.5846 14.259 1.0026 0.1340284      1.160614  
1 1 1 1  10 5  o 12.940 0.5732 165.989  13.123  163.497   15.274  173.013   25.647  12.771 0.5980 13.110 0.9782 -0.3390980     1.146472  
1 1 1 1  10 6  o 12.221 0.5717 145.718  12.420  140.890   14.437  159.471   24.367  11.855 0.6089 12.588 0.9679 -0.7330790     1.143498  
1 1 1 1  10 7  o 19.431 0.5104 378.794  19.831  386.265   27.957  371.228   28.135  19.624 0.7123 19.237 0.7313 0.3873062      1.020860  
1 1 1 1  10 8  o 30.812 0.5317 952.618  32.759  928.552   46.143  977.073   46.515  30.419 0.7585 31.205 0.7453 -0.7865314     1.063373  
1 1 1 1  10 9  o 13.327 0.5370 178.271  14.307  171.310   20.063  185.474   20.408  13.062 0.7680 13.592 0.7507 -0.5304766     1.073968  
1 1 1 1  10 10 o 6.3178 0.7532 41.209   9.2346  44.897    12.757  37.149    13.385  6.6746 0.9556 5.9609 1.1645 0.7137008      1.506413  
1 1 1 1  10 11 o 28.295 0.5297 805.008  29.968  832.811   42.574  777.706   42.190  28.781 0.7396 27.809 0.7586 0.9723434      1.059456  
1 1 1 1  10 12 o 26.205 0.5285 690.915  27.626  626.923   38.612  758.031   39.543  24.956 0.7736 27.454 0.7202 -2.497749      1.056938  
1 1 1 1  10 13 o 13.170 0.6361 169.266  16.184  152.043   20.033  201.633   27.462  12.258 0.8171 14.082 0.9751 -1.823343      1.272200  
1 1 1 1  10 14 o 23.885 0.5266 576.852  25.116  533.953   34.933  622.760   36.138  22.961 0.7607 24.810 0.7283 -1.849102      1.053130  
1 1 1 1  10 15 o 10.834 0.6109 120.727  13.167  125.739   17.975  114.924   19.343  11.093 0.8102 10.574 0.9146 0.5187025      1.221852  
1 1 1 1  10 16 o 6.1337 1.1117 40.127   13.026  50.941    23.067  35.064    15.784  6.6554 1.7204 5.6120 1.4085 1.043375       2.223403  
1 1 1 1  10 17 o 5.3157 0.9498 31.492   10.081  30.660    13.746  32.461    14.829  5.2480 1.3129 5.3834 1.3730 -0.1353617     1.899686  
1 1 1 1  10 18 o 5.9082 0.9598 39.469   11.115  43.841    15.130  34.345    16.382  6.3145 1.2423 5.5019 1.4633 0.8126087      1.919545  
1 1 1 1  10 19 o 7.0448 1.1577 62.908   14.813  68.466    17.083  46.068    29.736  8.0275 1.0640 6.0622 2.0565 1.965239       2.315475  
1 1 1 1  10 20 o 5.2135 1.0562 32.181   11.691  36.215    15.679  27.130    17.544  5.5904 1.4042 4.8366 1.5781 0.7537403      2.112401  
1 1 1 1  10 21 f 10.367 0.7416 115.859  15.106  125.870   20.235  103.258   22.704  10.949 0.9241 9.7839 1.1603 1.165313       1.483264  
1 1 1 1  10 22 o 8.7189 0.8565 82.793   14.725  89.235    19.846  74.901    21.964  9.1638 1.0829 8.2739 1.3273 0.8898411      1.712998  
1 1 1 1  10 23 o 3.9360 1.0904 13.188   12.686  17.899    16.474  6.3224    19.886  4.1735 1.5208 3.6986 1.5630 0.4749420      2.180823  
1 1 1 1  10 24 o 4.2607 1.1591 16.428   13.757  13.591    17.967  20.449    21.387  3.9870 1.5571 4.5344 1.7173 -0.5474677     2.318133  
1 1 1 1  10 25 o 11.438 0.7988 140.833  18.060  146.460   24.146  133.687   27.209  11.764 1.0262 11.111 1.2245 0.6535206      1.597629  
1 1 1 1  10 26 o 5.0182 0.9209 29.916   9.6621  37.586    12.652  19.184    14.966  5.8316 1.1256 4.2049 1.4579 1.626723       1.841835  
1 1 1 1  10 27 o 3.6395 0.9805 12.452   9.7117  12.608    12.318  12.195    15.788  3.5663 1.3127 3.7128 1.4570 -0.1464651     1.961098  
1 1 1 1  10 28 f 9.7922 0.5664 102.061  10.995  92.566    16.086  110.387   15.064  9.3192 0.8631 10.265 0.7337 -0.9459133     1.132816  
1 1 1 1  10 29 o 3.5721 0.8485 10.839   8.4628  27.677    12.618  -2.9271   11.409  4.7259 1.2961 2.4182 1.0954 2.307741       1.697013  
1 1 1 1  10 30 o 3.1666 0.7831 7.6940   7.8214  -9.7334   11.538  22.509    10.639  2.1122 1.0039 4.2209 1.2022 -2.108766      1.566229  
1 1 1 1  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  10 35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  11 0  o 2.9204 1.0117 10.643   8.2941  20.420    11.647  0.5843    11.814  3.8162 1.5538 2.0245 1.2962 -0.000000      0.000000  
1 1 1 1  11 1  o 39.003 0.5624 1527.48  43.868  1548.12   62.177  1507.02   61.902  39.266 0.7917 38.740 0.7989 0.5261993      1.124789  
1 1 1 1  11 2  o 24.896 0.5848 630.425  25.440  638.943   29.620  606.469   49.673  25.248 0.5866 24.543 1.0120 0.7052917      1.169658  
1 1 1 1  11 3  o 21.228 0.5909 467.701  21.754  483.946   25.379  422.701   42.240  21.973 0.5775 20.483 1.0311 1.490210       1.181822  
1 1 1 1  11 4  f 7.6489 0.6326 55.284   8.7468  51.027    10.188  67.215    17.057  7.1306 0.7144 8.1673 1.0442 -1.036708      1.265239  
1 1 1 1  11 5  o 12.592 0.5817 158.142  12.934  156.917   15.064  161.580   25.229  12.512 0.6020 12.672 0.9955 -0.1596146     1.163319  
1 1 1 1  11 6  o 7.0811 0.8080 56.698   9.2442  61.962    10.752  41.778    18.101  7.8611 0.6839 6.3010 1.4642 1.560050       1.616082  
1 1 1 1  11 7  o 11.993 0.4956 144.680  11.477  145.838   14.491  142.731   18.801  12.063 0.6007 11.924 0.7884 0.1390257      0.9911373 
1 1 1 1  11 8  o 24.388 0.6547 602.530  29.713  586.835   52.396  609.970   36.075  24.125 1.0859 24.651 0.7317 -0.5260429     1.309427  
1 1 1 1  11 9  o 16.002 0.5283 257.692  16.880  271.044   23.664  243.858   24.086  16.428 0.7203 15.577 0.7732 0.8507624      1.056657  
1 1 1 1  11 10 o 12.846 0.7121 157.540  16.932  144.128   20.050  190.887   31.616  11.965 0.8379 13.728 1.1515 -1.763349      1.424111  
1 1 1 1  11 11 o 16.573 0.5320 276.324  17.629  281.755   24.906  270.871   24.957  16.737 0.7441 16.408 0.7605 0.3285770      1.063947  
1 1 1 1  11 12 o 3.7392 0.8909 12.307   8.4814  20.619    11.838  3.5399    12.157  4.4298 1.2703 3.0487 1.2495 1.381168       1.781818  
1 1 1 1  11 13 o 22.526 0.5300 512.750  23.864  487.829   33.354  538.884   34.157  21.962 0.7594 23.090 0.7397 -1.127317      1.060046  
1 1 1 1  11 14 o 8.3169 0.7110 70.909   11.725  59.067    15.937  84.885    17.313  7.5519 1.0551 9.0819 0.9531 -1.530046      1.421911  
1 1 1 1  11 15 o 11.934 0.6064 144.848  14.424  138.040   19.452  153.164   21.498  11.630 0.8363 12.238 0.8784 -0.6078148     1.212821  
1 1 1 1  11 16 o 9.7485 0.8234 104.843  15.133  77.379    23.439  124.476   19.817  8.5036 1.3782 10.993 0.9013 -2.489708      1.646732  
1 1 1 1  11 17 o 14.571 0.5869 219.339  17.026  227.220   23.286  210.286   24.959  14.877 0.7827 14.265 0.8748 0.6112413      1.173813  
1 1 1 1  11 18 o 14.741 0.5922 225.684  17.407  235.624   24.075  214.796   25.197  15.106 0.7969 14.376 0.8764 0.7305136      1.184491  
1 1 1 1  11 19 o 3.7055 1.0296 11.067   11.073  11.859    14.429  9.9312    17.271  3.6788 1.4064 3.7322 1.5041 -0.5347109E-01 2.059135  
1 1 1 1  11 20 o 7.0555 0.9382 55.143   12.910  46.014    17.468  66.134    19.166  6.3186 1.4172 7.7923 1.2298 -1.473771      1.876370  
1 1 1 1  11 21 o 8.0830 0.8755 70.391   14.119  67.149    19.167  74.238    20.877  7.8918 1.2144 8.2742 1.2616 -0.3823752     1.751078  
1 1 1 1  11 22 o 9.6784 0.8161 100.867  15.648  102.173   20.876  99.192    23.640  9.8001 1.0651 9.5567 1.2368 0.2434587      1.632228  
1 1 1 1  11 23 o 7.2336 1.0577 61.036   14.923  73.297    20.078  45.903    22.306  8.2591 1.2155 6.2080 1.7313 2.051098       2.115381  
1 1 1 1  11 24 o 5.5800 1.1732 33.196   14.871  16.746    19.403  56.615    23.150  4.2464 1.6291 6.9137 1.6888 -2.667298      2.346426  
1 1 1 1  11 25 o 4.2593 1.1506 15.369   14.941  28.067    19.202  -4.1136   23.786  4.9534 1.6527 3.5652 1.6013 1.388258       2.301202  
1 1 1 1  11 26 o 4.8570 1.2750 25.146   16.122  18.805    20.364  35.793    26.389  4.3245 1.6664 5.3894 1.9301 -1.064936      2.549915  
1 1 1 1  11 27 o 4.8452 1.2811 26.411   16.098  21.896    19.952  34.830    27.247  4.4391 1.6635 5.2513 1.9487 -0.8121929     2.562143  
1 1 1 1  11 28 o 5.6299 1.0206 39.684   11.527  34.333    15.411  46.478    17.365  5.1983 1.4352 6.0616 1.4516 -0.8632970     2.041286  
1 1 1 1  11 29 o 3.6381 1.0121 11.517   11.015  2.3035    14.080  26.052    17.685  2.8810 1.2662 4.3951 1.5794 -1.514111      2.024288  
1 1 1 1  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  11 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  12 0  o 6.2419 1.0951 45.773   11.824  44.006    16.998  47.429    16.459  6.0597 1.6230 6.4241 1.4707 -0.000000      0.000000  
1 1 1 1  12 1  o 6.6070 0.6325 44.323   8.2467  52.156    11.600  36.317    11.726  7.2066 0.8048 6.0075 0.9760 1.199033       1.265012  
1 1 1 1  12 2  o 28.713 0.6068 842.594  30.333  857.979   35.295  799.130   59.326  29.257 0.6032 28.169 1.0530 1.087896       1.213533  
1 1 1 1  12 3  o 27.380 0.6007 764.948  28.659  777.911   33.350  728.349   56.037  27.861 0.5985 26.899 1.0416 0.9615784      1.201327  
1 1 1 1  12 4  o 19.742 0.5626 383.727  19.740  375.277   22.997  407.376   38.474  19.352 0.5942 20.131 0.9556 -0.7783966     1.125254  
1 1 1 1  12 5  o 12.339 0.5892 146.159  12.966  138.653   15.045  167.832   25.565  11.761 0.6396 12.917 0.9896 -1.156350      1.178302  
1 1 1 1  12 6  o 24.440 0.6238 604.239  28.772  612.183   35.399  588.776   49.391  24.700 0.7166 24.180 1.0213 0.5196476      1.247639  
1 1 1 1  12 7  o 10.240 0.6403 100.444  11.456  95.527    13.147  115.959   23.353  9.7577 0.6737 10.722 1.0890 -0.9645605     1.280515  
1 1 1 1  12 8  o 2.5686 0.7511 -16.4878 7.5938  -33.4643  9.5622  12.501    12.495  1.3802 0.6986 3.7569 1.3300 -2.376725      1.502292  
1 1 1 1  12 9  o 22.272 0.5255 498.780  23.403  512.636   33.131  484.982   33.064  22.582 0.7336 21.962 0.7528 0.6205826      1.051083  
1 1 1 1  12 10 o 30.077 0.5429 910.236  32.643  945.393   46.350  875.635   45.981  30.656 0.7560 29.498 0.7794 1.158176       1.085790  
1 1 1 1  12 11 o 13.017 0.5775 171.219  15.024  178.940   21.278  163.542   21.217  13.312 0.7992 12.721 0.8339 0.5910988      1.155038  
1 1 1 1  12 12 f 16.296 0.5552 269.152  18.066  281.600   25.291  256.183   25.815  16.688 0.7577 15.905 0.8116 0.7838144      1.110307  
1 1 1 1  12 13 o 2.7621 0.8650 -3.6730  9.4032  -5.3491   12.567  -1.5411   14.173  2.5814 1.1613 2.9427 1.2824 -0.3612883     1.730067  
1 1 1 1  12 14 o 10.729 0.6444 117.445  13.779  112.416   18.581  123.590   20.539  10.482 0.8864 10.976 0.9356 -0.4943762     1.288794  
1 1 1 1  12 15 o 12.828 0.6038 168.996  15.466  165.283   21.179  173.239   22.638  12.686 0.8348 12.971 0.8726 -0.2858448     1.207600  
1 1 1 1  12 16 o 8.1309 0.7858 69.710   12.699  69.432    17.041  70.056    19.044  8.1364 1.0472 8.1254 1.1719 0.1104355E-01  1.571598  
1 1 1 1  12 17 f 11.301 0.6786 132.568  15.283  117.802   20.993  149.218   22.292  10.620 0.9883 11.982 0.9302 -1.361679      1.357261  
1 1 1 1  12 18 o 9.3238 0.7699 93.903   14.112  107.354   19.393  78.766    20.572  10.108 0.9593 8.5398 1.2045 1.567902       1.539845  
1 1 1 1  12 19 o 7.8422 0.9375 71.287   13.738  93.279    19.044  47.425    19.837  9.3691 1.0163 6.3153 1.5757 3.053785       1.874993  
1 1 1 1  12 20 o 3.1058 0.9653 -1.1272  11.704  3.4275    15.869  -6.5599   17.331  3.2605 1.3879 2.9512 1.3420 0.3092518      1.930611  
1 1 1 1  12 21 o 3.9424 1.0153 9.3961   12.556  29.644    17.102  -14.2777  18.493  5.0715 1.5460 2.8133 1.3165 2.258255       2.030621  
1 1 1 1  12 22 o 9.3640 0.8771 95.003   16.374  86.077    22.237  105.574   24.199  8.8791 1.2522 9.8489 1.2285 -0.9698162     1.754233  
1 1 1 1  12 23 o 3.2920 1.0264 -2.7689  13.564  5.5920    17.920  -13.9855  20.756  3.5548 1.4920 3.0292 1.4100 0.5255475      2.052823  
1 1 1 1  12 24 o 8.1485 1.1031 82.527   16.836  105.368   21.945  49.855    26.247  9.9456 1.1033 6.3514 1.9106 3.594158       2.206261  
1 1 1 1  12 25 o 5.6932 1.2970 38.748   16.617  37.808    21.622  40.105    25.971  5.6324 1.7421 5.7540 1.9221 -0.1216559     2.594093  
1 1 1 1  12 26 o 3.5217 1.0630 -2.1383  15.332  18.155    19.321  -36.6501  25.197  4.2363 1.6255 2.8071 1.3702 1.429241       2.125948  
1 1 1 1  12 27 o 9.6799 1.0065 109.054  19.335  107.000   25.763  111.702   29.256  9.6607 1.3334 9.6992 1.5082 -0.3844929E-01 2.013080  
1 1 1 1  12 28 o 10.415 0.9995 130.618  20.445  122.667   26.302  142.755   32.497  10.174 1.2926 10.655 1.5250 -0.4804659     1.999069  
1 1 1 1  12 29 o 4.0868 1.2432 20.648   17.886  21.001    21.923  19.945    30.931  4.0455 1.6702 4.1281 1.8420 -0.8256292E-01 2.486484  
1 1 1 1  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  12 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  13 0  o 4.9002 1.2357 31.834   11.120  28.305    15.474  35.603    15.993  4.5221 1.7815 5.2782 1.7129 -0.000000      0.000000  
1 1 1 1  13 1  o 3.1356 0.7611 8.3727   6.0686  13.307    8.4717  3.1717    8.6974  3.6184 1.0848 2.6528 1.0679 0.9655914      1.522255  
1 1 1 1  13 2  o 35.673 0.6323 1281.55  39.499  1284.61   45.911  1272.83   77.492  35.797 0.6413 35.549 1.0899 0.2479095      1.264586  
1 1 1 1  13 3  o 19.523 0.6151 383.087  23.044  383.309   28.797  382.691   38.427  19.544 0.7367 19.502 0.9852 0.4256630E-01  1.230225  
1 1 1 1  13 4  o 26.364 0.5896 695.564  27.376  692.492   31.864  704.225   53.497  26.282 0.6062 26.446 1.0115 -0.1631012     1.179196  
1 1 1 1  13 5  o 5.0728 0.9858 26.788   9.6414  26.788    9.6414  0.0000    0.0000  5.0728 0.9858 ?      ?      ?              ?         
1 1 1 1  13 6  o 20.260 0.5851 414.148  20.936  415.777   24.459  409.683   40.493  20.361 0.6006 20.159 1.0043 0.2019806      1.170217  
1 1 1 1  13 7  o 18.296 0.6043 342.533  19.449  348.928   22.759  325.224   37.445  18.648 0.6102 17.945 1.0433 0.7031097      1.208699  
1 1 1 1  13 8  o 28.306 0.5391 805.835  30.520  802.344   43.317  809.276   43.009  28.244 0.7668 28.367 0.7581 -0.1236038     1.078291  
1 1 1 1  13 9  o 13.504 0.5846 183.417  15.777  193.763   22.779  173.879   21.873  13.870 0.8212 13.138 0.8324 0.7322626      1.169281  
1 1 1 1  13 10 o 17.892 0.5569 323.853  19.866  352.806   28.072  294.808   28.117  18.702 0.7505 17.081 0.8230 1.621044       1.113814  
1 1 1 1  13 11 o 3.5935 0.9297 7.4145   10.074  20.568    13.546  -8.8659   15.070  4.4508 1.3793 2.7362 1.2470 1.714652       1.859421  
1 1 1 1  13 12 o 13.978 0.6026 199.562  16.805  209.029   23.364  189.413   24.190  14.333 0.8150 13.622 0.8879 0.7109346      1.205241  
1 1 1 1  13 13 o 5.9962 1.0187 40.027   12.073  43.426    16.412  36.019    17.823  6.3030 1.3430 5.6893 1.5322 0.6137142      2.037479  
1 1 1 1  13 14 o 11.575 0.6660 139.559  15.270  151.220   20.843  126.051   22.434  12.132 0.8590 11.017 1.0181 1.114822       1.332067  
1 1 1 1  13 15 o 12.595 0.6347 163.426  15.967  155.818   21.918  172.031   23.309  12.286 0.8920 12.904 0.9032 -0.6182661     1.269393  
1 1 1 1  13 16 o 7.5421 0.9085 61.359   13.001  40.966    17.517  86.373    19.400  6.0140 1.4690 9.0702 1.0695 -3.056226      1.817030  
1 1 1 1  13 17 o 8.5229 1.1297 82.070   17.383  87.393    31.435  79.725    20.864  8.4479 1.9059 8.5979 1.2133 -0.1499586     2.259308  
1 1 1 1  13 18 o 9.8755 0.7805 106.338  14.982  124.328   20.333  84.968    22.161  10.898 0.9329 8.8527 1.2516 2.045616       1.561036  
1 1 1 1  13 19 o 9.5828 0.7934 98.717   15.178  100.506   20.996  96.757    21.969  9.6966 1.0826 9.4689 1.1600 0.2276821      1.586749  
1 1 1 1  13 20 o 9.9907 0.8145 106.207  16.201  93.240    22.096  121.282   23.824  9.3153 1.1860 10.666 1.1168 -1.350803      1.629073  
1 1 1 1  13 21 o 4.9770 1.1707 27.247   14.102  16.660    19.268  39.462    20.696  4.2111 1.6214 5.7429 1.6892 -1.531795      2.341431  
1 1 1 1  13 22 o 7.6853 1.0832 67.295   15.995  61.788    21.402  74.263    24.074  7.3380 1.5087 8.0325 1.5547 -0.6944699     2.166382  
1 1 1 1  13 23 o 9.1165 1.0164 90.653   17.193  55.316    22.639  138.808   26.428  6.8413 1.6693 11.392 1.1600 -4.550331      2.032757  
1 1 1 1  13 24 o 8.2816 1.1247 78.268   17.729  69.831    22.957  90.737    27.908  7.7689 1.5319 8.7942 1.6473 -1.025345      2.249497  
1 1 1 1  13 25 f 11.701 0.8770 149.557  20.287  145.478   26.630  155.197   31.315  11.585 1.1493 11.817 1.3250 -0.2312202     1.754016  
1 1 1 1  13 26 o 8.4451 1.1660 90.713   18.562  107.830   24.058  65.533    29.178  9.8767 1.2179 7.0134 1.9887 2.863304       2.331984  
1 1 1 1  13 27 o 8.5149 1.2022 92.991   19.743  95.895    25.840  88.918    30.601  8.9775 1.4392 8.0523 1.9261 0.9251480      2.404361  
1 1 1 1  13 28 o 6.2548 1.3738 61.551   19.404  67.207    25.061  53.083    30.663  6.8544 1.8037 5.6551 2.0727 1.199308       2.747570  
1 1 1 1  13 29 o 4.6856 1.3498 37.782   19.818  38.379    24.851  36.739    32.845  4.7968 1.8428 4.5744 1.9728 0.2223554      2.699615  
1 1 1 1  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  13 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  14 0  o 1.9132 0.8910 -2.4049  8.6960  -2.5467   12.065  -2.2517   12.545  1.8857 1.2438 1.9408 1.2762 -0.000000      0.000000  
1 1 1 1  14 1  o 29.388 0.6099 873.758  31.427  879.854   36.597  856.639   61.327  29.622 0.6177 29.154 1.0518 0.4679184      1.219753  
1 1 1 1  14 2  o 31.873 0.5978 984.112  33.752  944.027   39.092  1101.52   66.904  30.680 0.6371 33.067 1.0116 -2.386795      1.195539  
1 1 1 1  14 3  o 19.959 0.5836 400.086  20.602  399.705   24.059  401.135   39.887  19.965 0.6025 19.952 0.9995 0.1255989E-01  1.167114  
1 1 1 1  14 4  o 14.664 0.6089 217.300  15.842  218.399   18.562  214.353   30.397  14.754 0.6290 14.575 1.0428 0.1792412      1.217829  
1 1 1 1  14 5  o 10.264 0.6611 108.949  11.990  112.347   14.118  100.153   22.712  10.578 0.6673 9.9491 1.1414 0.6289806      1.322187  
1 1 1 1  14 6  o 22.249 0.6082 505.536  23.683  513.280   27.617  484.010   46.044  22.615 0.6106 21.883 1.0521 0.7320824      1.216411  
1 1 1 1  14 7  o 22.207 0.5891 481.308  23.131  464.787   26.798  529.579   45.808  21.517 0.6227 22.897 1.0003 -1.380413      1.178281  
1 1 1 1  14 8  o 23.765 0.5943 554.615  24.922  538.740   28.880  600.920   49.324  23.159 0.6235 24.371 1.0119 -1.211967      1.188584  
1 1 1 1  14 9  o 10.844 0.6030 118.235  12.516  116.434   15.537  121.563   21.123  10.745 0.7230 10.943 0.9652 -0.1979380     1.205962  
1 1 1 1  14 10 o 19.194 0.5622 373.178  21.561  389.904   30.417  356.286   30.568  19.632 0.7747 18.755 0.8149 0.8769302      1.124379  
1 1 1 1  14 11 o 9.3455 0.7356 89.860   13.746  91.508    19.324  88.173    19.556  9.4363 1.0239 9.2547 1.0566 0.1816320      1.471297  
1 1 1 1  14 12 o 9.5405 0.7521 94.765   14.217  79.797    19.971  110.143   20.242  8.7476 1.1415 10.333 0.9795 -1.585711      1.504125  
1 1 1 1  14 13 o 16.410 0.5964 276.757  19.508  295.840   27.237  256.657   27.954  17.013 0.8005 15.808 0.8842 1.204271       1.192707  
1 1 1 1  14 14 o 11.406 0.7038 134.186  16.002  125.483   21.582  144.809   23.846  11.003 0.9807 11.808 1.0097 -0.8045635     1.407622  
1 1 1 1  14 15 o 12.851 0.6676 171.394  17.142  168.012   23.654  175.135   24.877  12.725 0.9294 12.977 0.9585 -0.2519846     1.335143  
1 1 1 1  14 16 o 4.6847 1.1015 24.412   12.245  28.767    16.407  18.938    18.397  5.0220 1.5105 4.3474 1.6036 0.6746364      2.203009  
1 1 1 1  14 17 f 6.2034 1.0705 44.359   13.356  33.260    18.306  56.992    19.530  5.3344 1.5936 7.0725 1.4298 -1.738120      2.141026  
1 1 1 1  14 18 o 6.0436 1.1118 43.486   13.485  43.508    17.859  43.457    20.570  6.0937 1.4801 5.9934 1.6594 0.1003213      2.223556  
1 1 1 1  14 19 o 4.4408 1.1377 20.670   13.034  16.889    17.766  25.077    19.181  4.1532 1.5670 4.7283 1.6499 -0.5751047     2.275430  
1 1 1 1  14 20 o 7.2528 1.0583 64.738   15.366  92.877    20.768  30.694    22.843  9.3343 1.1125 5.1714 1.8007 4.162899       2.116606  
1 1 1 1  14 21 o 8.4180 0.9786 79.084   16.104  72.405    21.944  86.880    23.708  7.9652 1.4301 8.8708 1.3363 -0.9055414     1.957231  
1 1 1 1  14 22 o 5.8171 1.2303 39.044   15.862  26.662    21.541  53.710    23.443  4.9216 1.7458 6.7126 1.7340 -1.790928      2.460587  
1 1 1 1  14 23 o 7.0347 1.2013 57.506   16.928  41.585    22.521  78.183    25.665  5.8817 1.7699 8.1877 1.6247 -2.305925      2.402526  
1 1 1 1  14 24 o 14.716 0.7698 230.089  22.517  231.129   30.292  228.805   33.661  14.803 1.0232 14.629 1.1505 0.1746378      1.539660  
1 1 1 1  14 25 o 8.9275 1.1366 93.701   19.598  90.658    25.693  97.935    30.306  8.9232 1.4397 8.9319 1.7591 -0.8766174E-02 2.273128  
1 1 1 1  14 26 o 8.4571 1.2203 95.754   19.859  118.999   25.861  62.345    31.003  10.282 1.2575 6.6317 2.0917 3.650643       2.440587  
1 1 1 1  14 27 o 15.859 0.8176 291.817  25.554  305.972   34.148  273.803   38.523  16.510 1.0342 15.208 1.2665 1.301359       1.635113  
1 1 1 1  14 28 o 4.1446 1.2130 19.120   18.333  36.129    23.503  -7.3085   29.297  4.8763 1.8098 3.4130 1.6156 1.463336       2.425972  
1 1 1 1  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  14 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  14 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  15 0  o 13.438 0.6798 185.198  17.279  180.126   28.651  188.097   21.661  13.252 1.0984 13.625 0.8012 -0.000000      0.000000  
1 1 1 1  15 1  o 33.748 0.6387 1164.81  37.656  1183.98   43.880  1111.24   73.344  34.345 0.6388 33.150 1.1062 1.194756       1.277441  
1 1 1 1  15 2  o 10.855 0.6224 111.020  12.369  100.914   14.505  137.950   23.679  10.021 0.7237 11.689 1.0128 -1.668238      1.244830  
1 1 1 1  15 3  o 19.291 0.6001 381.172  20.497  388.986   24.088  360.670   39.019  19.687 0.6118 18.894 1.0326 0.7929001      1.200178  
1 1 1 1  15 4  o 4.3138 0.9404 15.612   8.6021  9.7420    10.294  29.200    15.661  3.3616 1.2053 5.2660 1.4438 -1.904443      1.880802  
1 1 1 1  15 5  o 14.037 0.6097 187.982  15.480  175.154   18.066  223.406   30.022  13.203 0.6841 14.870 1.0095 -1.666928      1.219467  
1 1 1 1  15 6  o 16.009 0.6213 250.544  17.464  242.347   20.163  275.156   34.938  15.532 0.6491 16.487 1.0596 -0.9551363     1.242593  
1 1 1 1  15 7  o 18.235 0.6034 328.885  19.484  321.046   22.649  351.196   38.212  17.868 0.6338 18.603 1.0270 -0.7357483     1.206843  
1 1 1 1  15 8  o 18.972 0.5950 351.190  20.114  336.060   23.372  394.386   39.492  18.264 0.6398 19.679 1.0034 -1.415442      1.190044  
1 1 1 1  15 9  o 7.2789 0.7515 53.015   10.370  50.663    12.654  57.824    18.094  7.0615 0.8960 7.4962 1.2069 -0.4346390     1.503097  
1 1 1 1  15 10 o 6.4001 1.0277 44.934   12.939  35.768    18.045  54.635    18.563  5.6934 1.5452 7.1069 1.3555 -1.413560      2.055493  
1 1 1 1  15 11 o 2.9332 0.9305 -5.9915  11.384  -2.4909   15.849  -9.7227   16.363  3.0552 1.3431 2.8112 1.2881 0.2440524      1.860913  
1 1 1 1  15 12 o 8.9866 0.8330 84.813   14.922  91.916    21.025  77.603    21.183  9.3864 1.1200 8.5869 1.2334 0.7995443      1.666042  
1 1 1 1  15 13 o 19.152 0.5877 376.701  22.471  399.401   31.653  353.636   31.906  19.751 0.8013 18.552 0.8599 1.198694       1.175375  
1 1 1 1  15 14 o 21.316 0.5839 468.503  24.862  486.663   34.852  449.686   35.477  21.755 0.8010 20.876 0.8497 0.8787384      1.167731  
1 1 1 1  15 15 o 13.608 0.6572 193.896  17.768  210.430   24.568  175.763   25.729  14.257 0.8616 12.958 0.9927 1.299201       1.314476  
1 1 1 1  15 16 o 10.378 0.7947 115.705  16.349  119.895   22.010  110.549   24.417  10.640 1.0343 10.116 1.2069 0.5244570      1.589423  
1 1 1 1  15 17 o 3.6469 1.0652 7.7246   12.839  13.078    17.262  1.0980    19.206  3.8857 1.5239 3.4081 1.4888 0.4775879      2.130429  
1 1 1 1  15 18 o 14.610 0.6691 224.703  19.525  222.471   26.880  227.195   28.408  14.551 0.9236 14.670 0.9682 -0.1187305     1.338132  
1 1 1 1  15 19 o 11.184 0.7637 132.558  17.045  121.328   23.668  144.660   24.569  10.675 1.1085 11.693 1.0506 -1.017528      1.527301  
1 1 1 1  15 20 o 4.1618 1.1900 11.812   14.929  5.4359    18.686  23.066    24.826  3.5737 1.5130 4.7500 1.8372 -1.176301      2.380015  
1 1 1 1  15 21 o 14.063 0.7784 218.332  20.771  275.592   28.315  151.623   30.563  16.296 0.8688 11.829 1.2918 4.466602       1.556777  
1 1 1 1  15 22 o 5.0854 1.2563 29.259   15.846  33.125    21.334  24.502    23.667  5.3306 1.7403 4.8401 1.8122 0.4905419      2.512501  
1 1 1 1  15 23 o 8.2973 1.1499 81.636   18.368  91.103    24.391  69.235    27.918  9.1005 1.3401 7.4941 1.8690 1.606365       2.299788  
1 1 1 1  15 24 o 5.7359 1.3286 39.199   17.777  27.343    23.323  55.637    27.462  4.9007 1.8059 6.5710 1.9493 -1.670353      2.657286  
1 1 1 1  15 25 o 13.152 0.8661 190.368  22.532  185.291   29.633  197.326   34.691  13.032 1.1369 13.272 1.3069 -0.2398710     1.732216  
1 1 1 1  15 26 f 7.6997 1.3434 78.001   20.200  68.104    25.810  93.645    32.451  7.1702 1.8019 8.2291 1.9929 -1.058903      2.686725  
1 1 1 1  15 27 o 4.7096 1.3091 22.899   19.661  -2.2931   25.847  57.496    30.290  3.4629 1.5984 5.9562 2.0736 -2.493349      2.618116  
1 1 1 1  15 28 o 4.2839 1.2916 27.128   19.901  33.508    25.914  17.957    31.072  4.5596 1.8406 4.0082 1.8125 0.5514069      2.583208  
1 1 1 1  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  15 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  16 0  o 11.133 1.0076 123.072  19.809  82.924    24.979  191.107   32.517  8.6506 1.6066 13.615 1.2165 -0.000000      0.000000  
1 1 1 1  16 1  o 17.376 0.6024 302.847  18.768  301.210   22.074  307.116   35.650  17.319 0.6373 17.432 1.0226 -0.1122913     1.204890  
1 1 1 1  16 2  o 21.859 0.5941 476.340  23.030  470.628   26.867  492.167   44.721  21.651 0.6205 22.067 1.0133 -0.4167786     1.188154  
1 1 1 1  16 3  o 10.527 0.7633 112.332  15.804  112.859   20.599  111.578   24.640  10.569 0.9745 10.485 1.1750 0.8441067E-01  1.526540  
1 1 1 1  16 4  o 18.942 0.5963 348.485  20.198  333.017   23.511  392.061   39.462  18.203 0.6458 19.681 1.0026 -1.477900      1.192559  
1 1 1 1  16 5  o 5.2745 0.9531 32.712   10.238  39.563    11.946  13.759    19.870  6.2470 0.9562 4.3020 1.6490 1.944923       1.906162  
1 1 1 1  16 6  o 14.113 0.6510 198.992  16.276  195.377   18.956  209.135   31.754  13.920 0.6809 14.305 1.1099 -0.3846893     1.302095  
1 1 1 1  16 7  o 21.339 0.6626 465.505  27.164  472.076   34.137  454.162   44.853  21.597 0.7903 21.081 1.0638 0.5159473      1.325265  
1 1 1 1  16 8  o 14.535 0.6568 205.875  16.754  196.090   19.290  235.928   33.806  13.926 0.6926 15.144 1.1162 -1.217527      1.313564  
1 1 1 1  16 9  o 2.9040 0.9214 -8.1181  8.5296  -11.6166  9.4150  7.9027    20.147  1.8967 0.9030 3.9113 1.6064 -2.014633      1.842792  
1 1 1 1  16 10 o 3.2177 0.9316 3.6816   8.4517  1.5686    9.7647  9.9922    16.875  2.6266 1.1018 3.8087 1.5026 -1.182091      1.863260  
1 1 1 1  16 11 o 10.340 0.7770 111.212  15.984  127.878   23.335  96.479    21.940  11.085 1.0525 9.5951 1.1433 1.490303       1.553984  
1 1 1 1  16 12 o 13.457 0.6655 187.171  17.903  189.051   25.031  185.201   25.616  13.534 0.9248 13.380 0.9572 0.1534014      1.330988  
1 1 1 1  16 13 o 6.4601 1.0779 48.147   13.923  60.199    19.455  35.496    19.933  7.3664 1.3710 5.5539 1.6637 1.812504       2.155845  
1 1 1 1  16 14 o 7.2875 1.0655 60.622   15.003  66.252    20.810  54.527    21.650  7.7056 1.4020 6.8693 1.6048 0.8362112      2.130981  
1 1 1 1  16 15 o 11.361 0.7576 137.468  17.157  125.304   24.259  149.641   24.268  10.826 1.1204 11.897 1.0200 -1.070737      1.515126  
1 1 1 1  16 16 o 21.800 0.6019 495.285  26.182  527.113   36.792  462.630   37.267  22.545 0.8160 21.055 0.8850 1.490229       1.203760  
1 1 1 1  16 17 o 5.5995 1.1745 36.718   14.237  28.311    19.108  47.210    21.346  4.9412 1.6486 6.2579 1.6732 -1.316695      2.348953  
1 1 1 1  16 18 o 8.3456 1.0169 77.196   16.478  64.729    22.131  92.705    24.683  7.4935 1.5284 9.1978 1.3418 -1.704298      2.033863  
1 1 1 1  16 19 o 16.818 0.6578 297.777  21.990  322.197   30.448  271.156   31.791  17.593 0.8653 16.042 0.9909 1.551464       1.315540  
1 1 1 1  16 20 o 9.1397 0.9584 93.747   16.832  106.814   23.326  79.549    24.314  9.9629 1.1706 8.3165 1.5177 1.646400       1.916731  
1 1 1 1  16 21 o 12.410 0.8110 165.431  19.959  173.287   27.019  155.995   29.612  12.797 1.0557 12.023 1.2315 0.7739305      1.622045  
1 1 1 1  16 22 o 5.4681 1.2948 35.542   16.639  36.791    22.160  33.927    25.193  5.5547 1.7701 5.3815 1.8901 0.1731620      2.589545  
1 1 1 1  16 23 o 8.4641 1.1380 82.656   18.737  84.238    25.222  80.707    27.990  8.7033 1.4490 8.2249 1.7550 0.4784164      2.275903  
1 1 1 1  16 24 o 5.8892 1.3623 44.611   18.385  44.497    24.250  44.765    28.196  5.9153 1.8474 5.8631 2.0025 0.5213642E-01  2.724519  
1 1 1 1  16 25 o 7.2307 1.2690 71.506   19.620  89.420    25.435  45.184    30.832  8.7502 1.4534 5.7112 2.0806 3.038947       2.537994  
1 1 1 1  16 26 o 7.7140 1.3431 82.805   20.748  59.820    26.742  117.570   32.888  6.2855 1.9363 9.1424 1.8619 -2.856875      2.686230  
1 1 1 1  16 27 o 4.9485 1.4075 37.304   21.000  25.511    26.843  55.908    33.715  4.3553 1.8270 5.5417 2.1417 -1.186378      2.815082  
1 1 1 1  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  16 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  16 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  17 0  o 13.401 0.9345 189.381  23.773  199.045   31.004  175.595   37.032  13.904 1.1322 12.897 1.4870 -0.000000      0.000000  
1 1 1 1  17 1  o 16.085 0.5294 267.466  16.376  288.387   21.004  235.031   26.153  16.930 0.6203 15.241 0.8580 1.688974       1.058750  
1 1 1 1  17 2  o 7.9819 0.8856 69.427   11.952  73.075    14.075  59.997    22.630  8.4992 0.8280 7.4646 1.5658 1.034616       1.771239  
1 1 1 1  17 3  o 6.2996 1.0039 41.460   11.273  41.116    13.078  42.454    22.239  6.3514 1.0296 6.2478 1.7236 0.1036749      2.007719  
1 1 1 1  17 4  o 19.383 0.6094 361.649  21.050  340.166   24.385  424.481   41.702  18.366 0.6638 20.400 1.0221 -2.033762      1.218761  
1 1 1 1  17 5  o 6.8032 0.9350 43.485   11.236  35.798    13.078  65.160    21.960  5.8089 1.1662 7.7974 1.4619 -1.988461      1.870043  
1 1 1 1  17 6  o 8.6062 0.9216 75.796   15.658  70.054    20.292  84.244    24.615  8.2265 1.2333 8.9859 1.3696 -0.7593307     1.843100  
1 1 1 1  17 7  o 6.5654 1.0437 45.681   11.742  44.861    13.332  48.513    24.794  6.5970 1.0104 6.5337 1.8264 0.6327915E-01  2.087304  
1 1 1 1  17 8  o 3.4665 0.9357 9.8283   9.1066  15.408    9.9827  -17.8400  22.229  3.8290 1.1836 3.1040 1.4496 0.7250047      1.871410  
1 1 1 1  17 9  o 3.2692 0.9676 4.8160   9.2957  7.2339    10.361  -5.1588   21.045  3.1105 1.1911 3.4278 1.5252 -0.3173933     1.935220  
1 1 1 1  17 10 o 8.7156 0.9058 80.825   13.179  79.965    15.201  83.426    26.443  8.8155 0.8622 8.6157 1.5932 0.1997299      1.811565  
1 1 1 1  17 11 o 8.4944 0.7924 77.367   12.142  79.841    14.523  71.622    22.130  8.8177 0.8235 8.1712 1.3541 0.6464758      1.584878  
1 1 1 1  17 12 o 10.914 0.7973 125.845  17.361  115.766   24.463  136.074   24.643  10.451 1.1704 11.377 1.0830 -0.9259329     1.594578  
1 1 1 1  17 13 f 5.6637 1.1799 37.327   14.383  32.066    20.531  42.398    20.155  5.2913 1.7057 6.0362 1.6309 -0.7449107     2.359895  
1 1 1 1  17 14 o 14.855 0.6695 231.500  19.885  223.963   27.942  239.235   28.305  14.602 0.9568 15.107 0.9368 -0.5045891     1.339052  
1 1 1 1  17 15 o 4.7030 1.1851 24.125   14.217  28.751    19.483  18.856    20.794  5.0001 1.6646 4.4060 1.6874 0.5940747      2.370228  
1 1 1 1  17 16 o 12.609 0.7502 169.539  18.883  169.617   25.963  169.451   27.515  12.636 1.0273 12.581 1.0935 0.5512333E-01  1.500360  
1 1 1 1  17 17 o 7.4486 1.1162 64.527   16.034  63.057    21.507  66.367    24.059  7.3981 1.5048 7.4992 1.6490 -0.1011071     2.232374  
1 1 1 1  17 18 o 16.219 0.6772 276.496  21.917  289.892   30.571  262.329   31.438  16.655 0.9178 15.783 0.9959 0.8719044      1.354340  
1 1 1 1  17 19 o 4.9328 1.1902 23.869   15.646  4.1836    21.360  46.659    22.982  3.6933 1.5919 6.1724 1.7700 -2.479094      2.380496  
1 1 1 1  17 20 o 11.697 0.8499 147.648  19.702  161.460   27.125  132.225   28.663  12.344 1.0987 11.050 1.2970 1.294945       1.699825  
1 1 1 1  17 21 o 6.8274 1.5312 61.084   21.993  64.247    24.502  47.972    49.889  7.3659 1.6980 6.2890 2.5486 1.076842       3.062424  
1 1 1 1  17 22 o 3.6486 1.1088 -4.8287  16.301  18.281    22.399  -30.8505  23.768  4.4457 1.7380 2.8514 1.3774 1.594348       2.217635  
1 1 1 1  17 23 o 7.4484 1.0898 71.422   19.249  126.895   26.194  6.2903    28.382  10.761 1.2170 4.1354 1.8081 6.625853       2.179511  
1 1 1 1  17 24 o 4.8637 1.2092 9.7519   18.683  -29.9562  24.771  62.153    28.456  2.8928 1.3995 6.8347 1.9723 -3.941887      2.418392  
1 1 1 1  17 25 o 4.7884 1.3648 28.099   20.118  29.660    27.322  26.249    29.733  4.8480 1.9121 4.7288 1.9479 0.1192126      2.729533  
1 1 1 1  17 26 o 11.165 1.1192 161.916  23.585  178.558   31.516  140.736   35.555  12.256 1.2858 10.074 1.8322 2.182178       2.238317  
1 1 1 1  17 27 o 4.0221 1.2646 14.945   20.360  -1.2329   26.410  38.646    31.967  3.3601 1.5727 4.6841 1.9808 -1.324066      2.529181  
1 1 1 1  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  17 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  18 0  o 13.343 1.0209 195.906  24.594  224.215   31.915  154.514   38.592  14.767 1.0945 11.920 1.7236 -0.000000      0.000000  
1 1 1 1  18 1  o 15.171 0.6019 233.583  18.261  234.965   26.056  232.248   25.601  15.214 0.8563 15.128 0.8461 0.8554173E-01  1.203850  
1 1 1 1  18 2  o 11.143 0.7221 125.728  14.332  124.221   16.779  129.794   27.563  11.076 0.7574 11.209 1.2295 -0.1327572     1.444112  
1 1 1 1  18 3  o 16.767 0.6520 286.663  19.302  286.283   22.537  287.707   37.391  16.828 0.6697 16.707 1.1190 0.1203175      1.304083  
1 1 1 1  18 4  o 4.4724 1.0625 17.111   10.282  12.365    11.994  30.259    19.965  3.6534 1.3020 5.2913 1.6795 -1.637980      2.125082  
1 1 1 1  18 5  o 12.643 0.6839 157.807  15.472  149.668   18.008  180.748   30.235  12.125 0.7426 13.162 1.1485 -1.037548      1.367716  
1 1 1 1  18 6  o 13.542 0.6672 179.081  16.414  166.735   19.228  212.236   31.510  12.796 0.7514 14.288 1.1026 -1.492866      1.334302  
1 1 1 1  18 7  o 7.5430 0.9866 54.032   12.622  47.589    14.321  76.444    26.710  6.7904 1.0545 8.2956 1.6677 -1.505187      1.973178  
1 1 1 1  18 8  o 17.827 0.6591 326.848  20.507  325.600   23.798  330.447   40.420  17.898 0.6648 17.756 1.1382 0.1419582      1.318115  
1 1 1 1  18 9  o 6.8760 1.0827 51.746   13.119  51.318    15.150  53.028    26.230  7.0144 1.0799 6.7376 1.8768 0.2768745      2.165341  
1 1 1 1  18 10 o 10.216 0.8461 107.958  14.681  105.306   16.756  116.722   30.457  10.110 0.8286 10.321 1.4754 -0.2108412     1.692202  
1 1 1 1  18 11 o 4.1452 1.1230 9.5504   10.647  4.9604    11.778  30.062    24.898  3.0399 1.2360 5.2505 1.8754 -2.210652      2.246040  
1 1 1 1  18 12 o 8.9650 0.7740 84.935   12.849  84.783    15.525  85.266    22.892  9.0474 0.8580 8.8826 1.2886 0.1647768      1.548084  
1 1 1 1  18 13 o 14.699 0.6848 227.429  20.105  239.990   28.409  214.825   28.458  15.128 0.9389 14.271 0.9971 0.8573103      1.369581  
1 1 1 1  18 14 o 3.6146 1.0153 -3.0116  13.758  25.800    18.907  -35.4371  20.058  4.7886 1.6398 2.4405 1.1977 2.348155       2.030622  
1 1 1 1  18 15 o 4.8371 1.2131 26.400   14.748  23.354    20.785  29.490    20.931  4.6428 1.7057 5.0315 1.7253 -0.3887582     2.426134  
1 1 1 1  18 16 o 13.216 0.7557 186.414  19.786  216.649   28.207  157.132   27.760  14.335 0.9839 12.097 1.1474 2.238467       1.511479  
1 1 1 1  18 17 o 3.2264 1.0379 -8.2286  14.663  -13.1018  19.916  -2.4600   21.668  2.9763 1.3839 3.4766 1.5472 -0.5003262     2.075859  
1 1 1 1  18 18 o 5.2272 1.3496 31.830   18.525  25.970    27.616  36.624    24.980  4.9596 1.9323 5.4949 1.8847 -0.5353751     2.699263  
1 1 1 1  18 19 o 3.0094 0.9940 -14.9417 14.646  -13.6001  19.317  -16.7557  22.463  2.9205 1.3596 3.0984 1.4503 -0.1778822     1.987927  
1 1 1 1  18 20 o 9.7824 1.0006 108.174  18.637  123.531   25.364  90.154    27.476  10.735 1.1813 8.8297 1.6154 1.905338       2.001265  
1 1 1 1  18 21 o 7.4480 1.3398 67.254   19.362  63.125    24.044  74.869    32.656  7.2732 1.6858 7.6228 2.0828 -0.3495803     2.679557  
1 1 1 1  18 22 o 4.7469 1.2794 23.747   17.119  29.622    22.839  16.215    25.862  5.0522 1.7970 4.4416 1.8216 0.6105671      2.558828  
1 1 1 1  18 23 o 8.4958 1.1928 87.691   19.502  85.682    26.507  90.062    28.793  8.4379 1.6297 8.5537 1.7423 -0.1157713     2.385687  
1 1 1 1  18 24 o 6.8936 1.1926 56.965   19.261  19.198    25.671  105.608   29.134  4.4018 1.8112 9.3854 1.5521 -4.983645      2.385241  
1 1 1 1  18 25 o 6.7847 1.4238 72.476   21.086  78.415    27.313  63.714    33.176  7.4289 1.8463 6.1404 2.1678 1.288453       2.847511  
1 1 1 1  18 26 o 5.2111 1.4434 42.558   22.384  22.111    29.076  72.307    35.072  4.2308 1.8403 6.1913 2.2242 -1.960509      2.886862  
1 1 1 1  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  18 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  18 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  19 0  o 3.5190 1.4802 10.775   17.582  1.0580    21.513  30.317    30.509  2.6623 1.7216 4.3757 2.4083 -0.000000      0.000000  
1 1 1 1  19 1  o 17.236 0.5943 304.021  20.481  294.199   28.751  314.141   29.184  16.950 0.8481 17.522 0.8328 -0.5724220     1.188611  
1 1 1 1  19 2  o 4.2288 1.0775 16.598   11.755  21.629    17.066  12.054    16.216  4.5784 1.5579 3.8791 1.4890 0.6993032      2.155062  
1 1 1 1  19 3  o 12.690 0.7030 162.385  15.957  158.085   18.671  174.037   30.733  12.466 0.7489 12.913 1.1900 -0.4475117     1.406001  
1 1 1 1  19 4  o 9.2105 0.8358 88.368   13.592  88.542    15.904  87.895    26.177  9.3125 0.8539 9.1085 1.4369 0.2039576      1.671514  
1 1 1 1  19 5  o 4.0197 1.0704 13.494   10.714  13.083    12.494  14.636    20.826  3.7299 1.3289 4.3095 1.6783 -0.5795794     2.140713  
1 1 1 1  19 6  o 5.7994 1.2395 38.603   15.533  39.990    20.425  36.701    23.920  5.9163 1.6591 5.6825 1.8421 0.2338409      2.479068  
1 1 1 1  19 7  o 12.289 0.7694 152.283  16.244  147.301   18.584  168.416   33.441  12.005 0.7740 12.573 1.3299 -0.5685711     1.538709  
1 1 1 1  19 8  o 10.111 0.8067 100.824  14.670  92.505    17.045  124.590   28.810  9.4577 0.9011 10.764 1.3383 -1.305907      1.613420  
1 1 1 1  19 9  o 9.7657 1.0177 110.429  15.454  115.147   17.618  94.685    32.185  10.570 0.8334 8.9610 1.8569 1.609437       2.035302  
1 1 1 1  19 10 o 14.635 0.7277 218.091  18.602  211.600   21.477  237.584   37.220  14.368 0.7474 14.903 1.2487 -0.5347271     1.455319  
1 1 1 1  19 11 o 11.103 0.8637 143.253  16.131  155.867   18.976  110.380   30.632  12.296 0.7716 9.9097 1.5456 2.386422       1.727488  
1 1 1 1  19 12 o 8.5156 0.9284 71.695   14.146  63.061    16.302  98.002    28.457  7.7085 1.0574 9.3226 1.5262 -1.614082      1.856755  
1 1 1 1  19 13 o 9.6311 0.7898 94.860   14.121  87.701    16.823  111.935   25.980  9.1470 0.9196 10.115 1.2842 -0.9681816     1.579501  
1 1 1 1  19 14 o 8.9066 0.9644 88.066   17.150  82.559    24.221  93.604    24.287  8.5978 1.4085 9.2153 1.3178 -0.6174335     1.928863  
1 1 1 1  19 15 o 6.0937 1.2198 44.726   16.117  30.676    22.779  58.810    22.807  5.1490 1.7979 7.0384 1.6491 -1.889388      2.439630  
1 1 1 1  19 16 o 6.6589 1.2346 53.192   16.596  51.806    22.514  54.841    24.560  6.5904 1.6977 6.7273 1.7929 -0.1368222     2.469136  
1 1 1 1  19 17 o 3.0233 1.0003 -14.7574 14.989  -13.5609  19.958  -16.3051  22.699  2.9500 1.3763 3.0965 1.4521 -0.1465755     2.000664  
1 1 1 1  19 18 o 3.3558 1.0681 -9.1949  15.223  -20.4117  20.168  5.6582    23.208  2.7986 1.3293 3.9130 1.6723 -1.114383      2.136285  
1 1 1 1  19 19 o 11.866 0.8611 150.656  20.343  132.852   27.610  171.803   30.089  11.085 1.2454 12.647 1.1895 -1.562388      1.722177  
1 1 1 1  19 20 o 5.5617 1.1893 28.723   17.225  -1.6898   22.871  68.585    26.184  3.5829 1.5923 7.5405 1.7671 -3.957530      2.378655  
1 1 1 1  19 21 o 10.586 0.9802 125.042  20.432  136.767   27.665  110.972   30.307  11.244 1.2302 9.9278 1.5263 1.316092       1.960408  
1 1 1 1  19 22 o 7.4971 1.2940 71.940   19.436  82.963    26.485  59.076    28.611  8.2946 1.6545 6.6996 1.9902 1.595037       2.588078  
1 1 1 1  19 23 o 4.2571 1.2159 11.217   18.240  33.941    24.349  -17.8403  27.534  5.1839 1.8543 3.3303 1.5733 1.853648       2.431789  
1 1 1 1  19 24 o 4.7004 1.3402 27.088   19.411  15.962    25.418  42.655    30.066  4.1005 1.7512 5.3004 2.0292 -1.199966      2.680380  
1 1 1 1  19 25 o 4.8939 1.3716 36.697   20.360  42.725    26.799  28.468    31.311  5.2275 1.9340 4.5603 1.9455 0.6671910      2.743279  
1 1 1 1  19 26 o 5.2323 1.4566 51.518   22.062  43.579    28.629  63.127    34.617  4.9315 1.9534 5.5330 2.1613 -0.6014109     2.913238  
1 1 1 1  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  19 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  20 0  o 10.845 1.3125 138.863  23.721  154.350   30.235  114.066   38.258  12.047 1.2924 9.6436 2.2847 -0.000000      0.000000  
1 1 1 1  20 1  o 6.6123 1.0314 48.804   13.276  50.479    18.817  47.144    18.734  6.7352 1.4405 6.4895 1.4766 0.2457542      2.062888  
1 1 1 1  20 2  o 10.420 0.7502 113.301  15.632  115.768   22.239  110.892   21.978  10.534 1.0556 10.305 1.0663 0.2286129      1.500424  
1 1 1 1  20 3  o 7.7650 0.7829 61.429   11.680  57.277    14.428  69.324    19.897  7.4351 0.9703 8.0948 1.2290 -0.6597533     1.565851  
1 1 1 1  20 4  o 3.5280 1.0402 3.2868   11.144  -0.3828   13.150  12.638    20.991  2.8739 1.2438 4.1821 1.6676 -1.308262      2.080345  
1 1 1 1  20 5  o 10.704 0.8748 132.043  15.646  144.256   18.353  99.558    29.931  11.874 0.7728 9.5339 1.5697 2.340400       1.749636  
1 1 1 1  20 6  o 6.2356 1.0771 36.705   11.916  28.290    13.618  64.205    24.617  5.0343 1.3319 7.4368 1.6930 -2.402569      2.154136  
1 1 1 1  20 7  o 13.935 0.7153 196.833  17.880  189.399   20.919  216.989   34.446  13.587 0.7698 14.282 1.2059 -0.6955004     1.430659  
1 1 1 1  20 8  o 5.6597 1.1523 30.353   12.106  23.646    13.755  53.401    25.498  4.6214 1.3815 6.6980 1.8447 -2.076609      2.304701  
1 1 1 1  20 9  o 11.363 0.8780 142.926  16.736  147.043   19.293  130.405   33.645  11.935 0.8082 10.791 1.5589 1.144298       1.755956  
1 1 1 1  20 10 o 6.9368 1.1178 56.565   13.705  57.710    15.777  53.045    27.667  7.3689 1.0705 6.5048 1.9627 0.8640237      2.235653  
1 1 1 1  20 11 o 8.3423 0.9706 71.767   13.998  65.494    16.171  90.514    27.957  7.8754 1.0267 8.8092 1.6473 -0.9338164     1.941100  
1 1 1 1  20 12 f 12.741 0.7777 164.998  17.676  154.287   20.517  195.840   34.815  12.161 0.8435 13.320 1.3069 -1.158941      1.555475  
1 1 1 1  20 13 o 4.9695 1.0159 31.965   12.825  44.923    14.835  -6.3645   25.514  6.3505 1.2122 3.5885 1.6305 2.762080       2.031737  
1 1 1 1  20 14 o 3.8437 1.0786 7.5481   10.813  2.5443    12.328  24.243    22.518  2.9150 1.2312 4.7724 1.7714 -1.857433      2.157249  
1 1 1 1  20 15 o 5.4859 1.1284 31.869   12.020  27.126    14.060  44.753    23.172  4.8865 1.3787 6.0854 1.7867 -1.198863      2.256783  
1 1 1 1  20 16 o 4.8069 1.2464 21.169   16.739  4.3400    22.426  42.341    25.154  3.7674 1.6274 5.8465 1.8884 -2.079055      2.492880  
1 1 1 1  20 17 o 4.3070 1.2276 14.735   16.275  14.663    22.869  14.807    23.166  4.2964 1.7310 4.3176 1.7412 -0.2120209E-01 2.455220  
1 1 1 1  20 18 o 5.4593 1.2819 30.563   17.128  13.757    22.134  55.651    27.044  4.2089 1.7004 6.7097 1.9188 -2.500791      2.563773  
1 1 1 1  20 19 o 4.6155 1.2885 18.098   17.835  8.3202    24.166  29.796    26.432  4.0601 1.7198 5.1709 1.9192 -1.110734      2.577053  
1 1 1 1  20 20 f 4.9334 1.2981 23.937   17.602  12.075    23.904  37.987    26.016  4.2222 1.7437 5.6446 1.9235 -1.422398      2.596220  
1 1 1 1  20 21 o 4.5409 1.2929 19.639   17.954  21.217    23.608  17.475    27.649  4.5587 1.7837 4.5230 1.8722 0.3577757E-01  2.585835  
1 1 1 1  20 22 o 5.3386 1.5889 24.910   22.501  17.522    24.647  61.886    55.141  4.3687 1.7834 6.3086 2.6302 -1.939919      3.177835  
1 1 1 1  20 23 o 4.8205 1.3333 28.850   19.187  36.911    25.211  17.753    29.581  5.2336 1.8852 4.4074 1.8859 0.8262162      2.666595  
1 1 1 1  20 24 o 3.0750 1.0485 -21.9207 18.735  -26.9840  24.375  -14.6114  29.286  2.8060 1.3647 3.3439 1.5922 -0.5379536     2.097017  
1 1 1 1  20 25 o 5.2460 1.3531 47.151   22.123  71.833    28.509  9.7878    35.076  6.5672 1.9948 3.9248 1.8288 2.642419       2.706252  
1 1 1 1  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  20 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  20 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  21 0  o 4.9900 1.5423 41.430   19.149  53.528    23.002  14.118    34.561  6.3041 2.0596 3.6760 2.2962 -0.000000      0.000000  
1 1 1 1  21 1  o 5.6440 1.1564 36.385   13.812  32.234    18.818  41.233    20.336  5.3196 1.6217 5.9684 1.6489 -0.6487961     2.312799  
1 1 1 1  21 2  o 3.1583 0.9882 -4.6088  12.581  4.2931    18.178  -12.7929  17.430  3.5353 1.4943 2.7813 1.2937 0.7540655      1.976487  
1 1 1 1  21 3  o 10.228 0.7794 110.142  15.875  97.101    22.016  124.265   22.912  9.5755 1.1496 10.881 1.0528 -1.305881      1.558849  
1 1 1 1  21 4  o 9.1791 1.0143 103.732  15.110  117.679   17.949  69.803    27.995  10.685 0.8399 7.6733 1.8465 3.011566       2.028593  
1 1 1 1  21 5  o 3.2447 1.0065 -1.0350  10.947  -2.8717   12.650  4.4419    21.844  2.6792 1.1878 3.8101 1.6252 -1.130835      2.013011  
1 1 1 1  21 6  o 10.726 0.8703 121.554  16.440  120.015   19.169  125.834   31.968  10.763 0.8905 10.688 1.4955 0.7492542E-01  1.740548  
1 1 1 1  21 7  o 4.9485 1.1117 29.416   12.892  36.185    15.098  11.202    24.768  5.6584 1.3525 4.2387 1.7646 1.419668       2.223329  
1 1 1 1  21 8  o 4.9556 1.2182 27.649   13.719  29.097    15.631  22.792    28.625  5.0306 1.4647 4.8806 1.9469 0.1499143      2.436380  
1 1 1 1  21 9  o 3.1928 1.0056 -0.5875  11.859  4.9359    13.251  -22.8025  26.575  3.1425 1.2980 3.2431 1.5362 -0.1005328     2.011132  
1 1 1 1  21 10 o 11.056 0.8383 127.482  16.599  122.076   19.413  142.182   32.010  10.807 0.8982 11.305 1.4158 -0.4980631     1.676664  
1 1 1 1  21 11 o 5.5960 1.2156 28.530   13.416  18.402    15.268  62.846    28.105  4.1563 1.4703 7.0356 1.9363 -2.879307      2.431266  
1 1 1 1  21 12 o 5.0028 1.2391 27.903   13.638  28.003    15.297  27.516    30.110  4.9190 1.4537 5.0866 2.0069 -0.1676307     2.478144  
1 1 1 1  21 13 o 11.056 0.9031 136.837  16.870  141.320   19.544  123.738   33.412  11.673 0.8371 10.438 1.6005 1.234842       1.806187  
1 1 1 1  21 14 o 4.3441 1.1924 17.092   12.762  17.292    14.213  16.259    28.997  4.0645 1.4201 4.6237 1.9158 -0.5591893     2.384756  
1 1 1 1  21 15 o 4.1183 1.0606 16.943   13.082  27.886    14.591  -27.9045  29.540  4.9202 1.4102 3.3165 1.5846 1.603698       2.121201  
1 1 1 1  21 16 o 4.1777 1.1195 16.138   11.723  16.254    13.527  15.786    23.500  3.9697 1.3855 4.3857 1.7590 -0.4159968     2.239094  
1 1 1 1  21 17 o 4.7954 1.1846 18.838   16.966  46.493    23.253  -12.6441  24.810  6.2081 1.7804 3.3827 1.5630 2.825404       2.369145  
1 1 1 1  21 18 o 10.116 1.0689 118.590  20.318  138.107   27.372  94.642    30.320  11.316 1.2094 8.9164 1.7627 2.399688       2.137735  
1 1 1 1  21 19 o 5.6131 1.4042 36.790   19.683  43.366    29.218  31.327    26.632  5.9518 2.0384 5.2744 1.9319 0.6773634      2.808439  
1 1 1 1  21 20 o 7.8211 1.2912 76.699   19.788  79.910    26.683  72.774    29.498  8.1193 1.6978 7.5228 1.9459 0.5964246      2.582446  
1 1 1 1  21 21 o 10.216 1.0517 121.078  21.281  125.970   28.726  115.128   31.682  10.558 1.3603 9.8744 1.6043 0.6840963      2.103384  
1 1 1 1  21 22 o 8.5679 1.2679 97.360   21.304  117.663   28.756  72.659    31.718  10.014 1.4358 7.1216 2.0902 2.892588       2.535794  
1 1 1 1  21 23 o 6.2085 1.2857 59.892   21.370  91.500    27.709  13.496    33.571  8.2170 1.7403 4.2001 1.8930 4.016861       2.571347  
1 1 1 1  21 24 o 6.1502 1.2372 60.120   21.717  101.605   28.434  2.0361    33.645  8.5201 1.7277 3.7803 1.7712 4.739796       2.474305  
1 1 1 1  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  21 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  21 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  22 0  o 5.4060 1.8160 40.178   20.711  28.362    24.214  72.378    39.973  4.1631 2.1909 6.6488 2.8969 -0.000000      0.000000  
1 1 1 1  22 1  o 3.7431 1.1057 6.1578   13.881  10.881    20.131  1.8770    19.165  3.9921 1.6185 3.4941 1.5069 0.4979947      2.211439  
1 1 1 1  22 2  o 4.1465 1.1181 11.713   14.035  27.939    19.985  -4.0798   19.716  5.0037 1.6860 3.2894 1.4690 1.714319       2.236199  
1 1 1 1  22 3  o 16.438 0.6662 281.907  21.897  275.469   30.898  288.403   31.037  16.243 0.9511 16.633 0.9330 -0.3902473     1.332334  
1 1 1 1  22 4  o 12.115 0.7403 155.096  17.907  144.210   25.159  166.272   25.491  11.664 1.0785 12.566 1.0143 -0.9016123     1.480546  
1 1 1 1  22 5  o 8.1593 1.1513 84.333   18.030  111.341   23.638  46.754    27.883  10.188 1.1601 6.1306 1.9890 4.057227       2.302558  
1 1 1 1  22 6  o 3.5853 1.1053 -2.5432  12.516  -8.2383   14.163  17.760    26.742  2.5873 1.1903 4.5832 1.8628 -1.995888      2.210637  
1 1 1 1  22 7  o 4.4745 1.1180 22.097   12.791  28.013    14.877  5.3237    25.051  4.9539 1.4251 3.9951 1.7229 0.9588060      2.235920  
1 1 1 1  22 8  o 5.5477 1.1911 38.338   13.909  42.154    15.839  25.478    29.078  6.0959 1.3360 4.9994 1.9724 1.096547       2.382246  
1 1 1 1  22 9  o 9.8359 1.0213 106.722  16.551  103.925   18.964  115.664   33.907  9.9216 0.9557 9.7503 1.8052 0.1713381      2.042612  
1 1 1 1  22 10 o 7.4624 1.1742 65.205   15.503  64.664    17.956  66.787    30.726  7.7403 1.1599 7.1845 2.0420 0.5558214      2.348431  
1 1 1 1  22 11 o 3.7010 1.1258 4.7462   13.086  3.7225    14.966  8.0708    26.969  3.2126 1.3567 4.1893 1.7969 -0.9767287     2.251565  
1 1 1 1  22 12 o 14.578 0.7588 215.254  19.710  203.528   22.898  248.785   38.721  14.022 0.8165 15.134 1.2793 -1.111676      1.517654  
1 1 1 1  22 13 o 6.1019 1.2375 39.814   14.409  33.041    16.724  59.326    28.385  5.3344 1.5031 6.8695 1.9662 -1.535094      2.474970  
1 1 1 1  22 14 o 4.3923 1.2227 17.954   14.161  19.027    16.015  14.106    30.327  4.2311 1.5048 4.5534 1.9276 -0.3222766     2.445421  
1 1 1 1  22 15 o 5.4626 1.2728 29.594   14.278  23.552    16.347  49.032    29.320  4.6188 1.5241 6.3064 2.0389 -1.687565      2.545617  
1 1 1 1  22 16 o 7.5327 1.1829 58.084   15.081  50.099    17.055  86.714    32.295  6.6865 1.3222 8.3789 1.9617 -1.692370      2.365726  
1 1 1 1  22 17 o 6.2982 1.1561 49.337   14.307  54.112    16.573  35.369    28.343  7.1004 1.1670 5.4960 1.9960 1.604426       2.312145  
1 1 1 1  22 18 o 12.239 0.8753 181.776  18.011  213.178   21.843  115.055   31.839  14.386 0.7592 10.091 1.5775 4.294614       1.750694  
1 1 1 1  22 19 o 10.392 0.9025 116.335  16.970  112.349   20.042  126.432   31.896  10.291 0.9737 10.493 1.5198 -0.2023125     1.804998  
1 1 1 1  22 20 o 6.1336 1.2980 47.941   20.118  77.179    27.339  13.406    29.712  7.8563 1.7810 4.4110 1.8888 3.445354       2.596095  
1 1 1 1  22 21 o 5.3338 1.3094 34.364   19.938  61.467    27.209  2.9350    29.301  6.7192 1.9256 3.9484 1.7750 2.770843       2.618894  
1 1 1 1  22 22 o 4.2955 1.3127 18.946   20.497  10.134    27.013  30.905    31.470  3.8845 1.7282 4.7065 1.9764 -0.8219695     2.625451  
1 1 1 1  22 23 o 2.8152 0.9864 -41.1722 20.442  -41.5264  26.819  -40.6812  31.579  2.6772 1.3271 2.9533 1.4596 -0.2760770     1.972707  
1 1 1 1  22 24 o 3.7653 1.2258 3.7357   21.454  -18.3996  28.244  33.925    32.984  3.0533 1.4813 4.4772 1.9535 -1.423861      2.451652  
1 1 1 1  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  22 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  22 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  22 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  23 0  o 4.9837 1.6899 43.678   21.461  51.990    25.236  21.957    40.794  5.9221 2.2606 4.0453 2.5126 -0.000000      0.000000  
1 1 1 1  23 1  o 5.2966 1.2206 32.425   15.436  20.732    21.967  43.831    21.697  4.5536 1.7366 6.0395 1.7157 -1.485910      2.441164  
1 1 1 1  23 2  o 8.4556 1.0053 80.600   16.253  60.744    22.583  101.934   23.409  7.1921 1.6101 9.7190 1.2043 -2.526917      2.010677  
1 1 1 1  23 3  o 13.493 0.7454 192.916  20.108  194.731   28.142  191.023   28.742  13.570 1.0369 13.415 1.0712 0.1543179      1.490898  
1 1 1 1  23 4  o 8.0688 0.9768 72.301   15.444  69.128    21.293  75.823    22.433  7.8232 1.4129 8.3144 1.3491 -0.4911876     1.953523  
1 1 1 1  23 5  o 3.9119 1.1187 8.0369   14.419  -5.9338   20.318  22.209    20.465  3.2375 1.4646 4.5863 1.6914 -1.348755      2.237417  
1 1 1 1  23 6  o 3.1897 0.9906 0.0651   12.044  8.3886    13.433  -34.0393  27.191  3.3559 1.3353 3.0235 1.4636 0.3323998      1.981225  
1 1 1 1  23 7  o 8.0228 1.0943 70.435   15.586  65.053    18.290  84.711    29.787  7.7512 1.1798 8.2944 1.8434 -0.5431705     2.188656  
1 1 1 1  23 8  f 5.9620 1.2432 43.498   14.654  44.589    16.699  39.843    30.561  6.2394 1.3753 5.6846 2.0714 0.5547638      2.486358  
1 1 1 1  23 9  o 6.0466 1.2323 45.224   15.103  47.658    17.723  38.768    28.865  6.4463 1.4136 5.6469 2.0190 0.7994399      2.464674  
1 1 1 1  23 10 o 6.1360 1.1725 30.691   13.820  15.876    15.690  81.946    29.185  4.0219 1.4814 8.2500 1.8178 -4.228086      2.344979  
1 1 1 1  23 11 o 6.7430 1.1762 61.266   16.006  72.228    18.545  29.242    31.695  8.2234 1.1276 5.2627 2.0646 2.960658       2.352452  
1 1 1 1  23 12 o 7.6578 1.2045 72.534   16.279  75.835    18.821  62.729    32.436  8.4085 1.1192 6.9071 2.1333 1.501347       2.409029  
1 1 1 1  23 13 o 6.0246 1.2705 42.331   14.835  41.089    16.896  46.513    30.998  5.9738 1.4326 6.0753 2.0986 -0.1014676     2.540999  
1 1 1 1  23 14 o 9.2997 0.9847 85.477   16.504  74.526    19.087  117.917   32.852  8.3695 1.1403 10.230 1.6057 -1.860413      1.969376  
1 1 1 1  23 15 o 7.5365 1.1464 54.725   15.456  38.897    17.906  100.991   30.612  5.7919 1.5248 9.2811 1.7123 -3.489234      2.292794  
1 1 1 1  23 16 o 13.004 0.8967 185.632  20.159  187.796   23.461  179.526   39.409  13.426 0.8737 12.581 1.5662 0.8453188      1.793426  
1 1 1 1  23 17 o 12.550 0.8563 155.811  19.324  139.728   22.388  202.812   38.272  11.542 0.9698 13.557 1.4115 -2.015018      1.712574  
1 1 1 1  23 18 o 5.2051 1.3462 22.405   15.626  13.097    17.529  58.432    34.486  3.8801 1.5312 6.5300 2.2147 -2.649924      2.692467  
1 1 1 1  23 19 o 7.5294 1.1900 76.258   16.351  84.974    19.088  52.231    31.692  8.8689 1.0761 6.1899 2.1229 2.679046       2.380096  
1 1 1 1  23 20 o 5.4405 1.3054 39.763   17.169  44.378    21.155  30.859    29.388  5.8780 1.7018 5.0031 1.9799 0.8749795      2.610819  
1 1 1 1  23 21 o 3.7642 1.1786 3.8124   14.564  -3.3899   16.475  29.574    31.157  2.8555 1.3024 4.6729 1.9647 -1.817437      2.357114  
1 1 1 1  23 22 o 4.6010 1.1402 30.854   14.953  40.266    16.925  -2.6237   31.920  5.5292 1.4948 3.6727 1.7222 1.856481       2.280397  
1 1 1 1  23 23 o 5.7049 1.4678 62.171   21.992  65.339    28.710  57.672    34.210  6.0661 2.0207 5.3438 2.1294 0.7222295      2.935615  
1 1 1 1  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  23 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  23 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  24 0  o 4.8889 1.6317 42.953   22.318  56.601    25.806  2.4509    44.456  6.2265 2.2566 3.5514 2.3574 -0.000000      0.000000  
1 1 1 1  24 1  o 4.7693 1.1552 19.040   15.820  48.237    22.923  -7.5156   21.861  6.2560 1.7587 3.2827 1.4984 2.973324       2.310475  
1 1 1 1  24 2  o 9.7308 0.9033 104.523  17.316  84.679    24.269  125.100   24.713  8.7008 1.3946 10.761 1.1483 -2.059924      1.806544  
1 1 1 1  24 3  o 3.6088 1.0831 0.7821   14.601  17.089    20.560  -15.8112  20.740  4.2697 1.6662 2.9479 1.3842 1.321789       2.166179  
1 1 1 1  24 4  o 6.6789 1.1657 52.891   15.653  40.875    21.310  66.971    23.067  5.8082 1.7157 7.5496 1.5785 -1.741478      2.331357  
1 1 1 1  24 5  o 3.2169 1.0298 -7.0891  14.412  -14.7767  20.182  0.9103    20.587  2.9312 1.3729 3.5026 1.5354 -0.5713394     2.059662  
1 1 1 1  24 6  o 4.1259 1.1314 6.3647   15.171  -15.6386  20.346  33.920    22.769  2.9222 1.3718 5.3295 1.7996 -2.407240      2.262798  
1 1 1 1  24 7  o 6.1148 1.2372 39.359   14.511  31.471    16.894  61.552    28.336  5.2111 1.5243 7.0185 1.9492 -1.807485      2.474418  
1 1 1 1  24 8  o 5.8728 1.2536 43.630   15.791  48.911    18.173  27.354    31.905  6.5488 1.4278 5.1967 2.0610 1.352122       2.507223  
1 1 1 1  24 9  o 13.577 0.8730 212.816  19.928  228.534   23.333  170.438   38.313  14.874 0.7843 12.280 1.5600 2.594545       1.746067  
1 1 1 1  24 10 o 11.699 0.9216 141.359  18.925  132.205   21.788  169.488   38.193  11.201 0.9726 12.197 1.5657 -0.9960461     1.843172  
1 1 1 1  24 11 o 8.4101 1.2018 79.984   17.199  76.390    19.716  91.426    35.181  8.4118 1.1719 8.4084 2.0986 0.3373146E-02  2.403689  
1 1 1 1  24 12 o 13.908 0.8310 203.905  20.302  200.743   23.620  212.849   39.723  13.920 0.8484 13.897 1.4292 0.2334023E-01  1.662072  
1 1 1 1  24 13 o 4.1276 1.2225 6.9634   14.830  1.8534    17.050  22.844    30.057  3.3019 1.4227 4.9533 1.9884 -1.651339      2.444925  
1 1 1 1  24 14 f 7.7307 1.2367 63.887   16.712  55.730    19.231  89.054    33.778  7.0111 1.4202 8.4503 2.0251 -1.439210      2.473425  
1 1 1 1  24 15 f 9.1291 1.1733 93.692   17.881  90.407    20.494  104.165   36.597  9.1945 1.1145 9.0636 2.0650 0.1308928      2.346522  
1 1 1 1  24 16 o 14.220 0.9098 226.840  21.505  233.968   24.735  204.770   43.527  15.030 0.8228 13.410 1.6229 1.620280       1.819582  
1 1 1 1  24 17 o 12.177 0.9543 168.507  20.044  172.163   23.417  158.488   38.763  12.776 0.9164 11.577 1.6741 1.199417       1.908547  
1 1 1 1  24 18 o 6.6637 1.2229 63.351   18.135  77.386    21.179  24.786    35.109  8.3403 1.2697 4.9870 2.0905 3.353276       2.445898  
1 1 1 1  24 19 o 7.4666 1.2205 82.923   17.337  94.648    19.831  44.907    35.710  9.3054 1.0656 5.6278 2.1960 3.677551       2.440901  
1 1 1 1  24 20 o 3.4936 1.1480 -0.9872  15.356  -2.7135   17.068  6.3452    35.176  2.9290 1.3319 4.0581 1.8702 -1.129149      2.295986  
1 1 1 1  24 21 f 4.6014 1.2828 29.478   16.565  31.946    18.334  18.517    38.643  4.8332 1.6149 4.3696 1.9936 0.4636407      2.565611  
1 1 1 1  24 22 o 4.3570 1.2645 25.217   15.543  20.610    17.726  40.544    32.332  3.9533 1.5459 4.7606 2.0014 -0.8073614     2.528946  
1 1 1 1  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  24 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  24 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  25 0  o 7.5573 1.9898 75.445   27.278  51.633    32.301  134.647   50.932  5.4927 2.5968 9.6218 3.0156 -0.000000      0.000000  
1 1 1 1  25 1  o 6.1206 1.2662 45.738   16.484  44.191    23.052  47.357    23.581  6.0199 1.7860 6.2212 1.7955 -0.2013259     2.532449  
1 1 1 1  25 2  o 11.191 0.9282 139.923  19.869  96.988    28.142  182.597   28.056  9.2768 1.5168 13.105 1.0704 -3.827979      1.856475  
1 1 1 1  25 3  o 4.4319 1.1942 17.152   15.169  6.4114    20.704  29.600    22.289  3.7707 1.5943 5.0931 1.7784 -1.322341      2.388411  
1 1 1 1  25 4  o 7.4376 1.5511 73.949   23.186  62.527    50.204  77.046    26.141  6.7758 2.6149 8.0994 1.6693 -1.323617      3.102293  
1 1 1 1  25 5  o 3.3018 1.0456 -4.0761  14.100  -5.6322   18.741  -2.0462   21.406  3.1287 1.4118 3.4750 1.5426 -0.3463469     2.091130  
1 1 1 1  25 6  o 3.7747 1.1556 2.8190   16.024  -1.5458   21.588  8.1743    23.912  3.5049 1.5528 4.0444 1.7118 -0.5394981     2.311212  
1 1 1 1  25 7  o 6.8369 1.1771 56.296   16.009  62.846    21.582  48.282    23.871  7.3805 1.5129 6.2934 1.8037 1.087105       2.354164  
1 1 1 1  25 8  o 4.2390 1.2077 15.586   14.922  19.884    16.977  0.9842    31.292  4.3209 1.5480 4.1571 1.8540 0.1637683      2.415340  
1 1 1 1  25 9  o 9.9234 1.1928 133.445  18.848  154.493   22.200  79.113    35.668  12.140 0.9143 7.7067 2.2035 4.433444       2.385633  
1 1 1 1  25 10 o 8.5866 1.1153 67.308   16.484  51.949    18.562  124.604   35.852  6.7698 1.4165 10.403 1.7231 -3.633646      2.230551  
1 1 1 1  25 11 o 10.567 1.0836 133.639  19.178  145.225   22.908  106.497   35.063  11.772 0.9730 9.3625 1.9364 2.409319       2.167130  
1 1 1 1  25 12 o 7.8874 1.2470 81.422   17.903  91.043    20.887  54.780    34.759  9.2417 1.1300 6.5331 2.2234 2.708632       2.494077  
1 1 1 1  25 13 o 6.5640 1.3449 46.871   16.658  39.534    19.126  69.923    33.902  5.7971 1.5981 7.3310 2.1636 -1.533843      2.689790  
1 1 1 1  25 14 f 5.2850 1.2941 33.303   16.292  37.425    18.783  20.784    32.733  5.6384 1.5945 4.9317 2.0388 0.7067680      2.588273  
1 1 1 1  25 15 o 6.3441 1.3776 44.311   17.405  35.491    20.230  69.447    34.151  5.4540 1.6847 7.2343 2.1801 -1.780281      2.755237  
1 1 1 1  25 16 o 4.1446 1.2556 8.0145   16.945  3.1532    20.053  20.150    31.684  3.5288 1.5316 4.7604 1.9900 -1.231614      2.511178  
1 1 1 1  25 17 o 4.5347 1.2809 21.125   16.617  24.718    18.916  8.9829    34.774  4.6200 1.6363 4.4495 1.9711 0.1705027      2.561758  
1 1 1 1  25 18 o 8.3842 1.2504 112.589  19.628  133.667   22.559  46.918    39.818  11.094 1.0167 5.6740 2.2847 5.420484       2.500715  
1 1 1 1  25 19 o 3.5261 1.1562 -4.4151  15.937  -11.2249  18.142  18.601    33.353  2.7239 1.2839 4.3283 1.9233 -1.604354      2.312414  
1 1 1 1  25 20 o 4.9736 1.1133 37.274   17.693  57.820    19.799  -44.1900  39.424  6.6578 1.5203 3.2894 1.6267 3.368420       2.226506  
1 1 1 1  25 21 o 3.3272 1.1165 -6.1297  15.918  -12.8139  18.032  17.470    33.883  2.5983 1.2405 4.0561 1.8567 -1.457751      2.232984  
1 1 1 1  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  25 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  25 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 0  o 3.1263 1.4679 0.0685   23.012  7.0753    26.599  -20.7836  45.886  3.0845 1.9631 3.1681 2.1830 -0.000000      0.000000  
1 1 1 1  26 1  o 11.137 0.9060 136.182  19.876  159.169   27.882  112.431   28.342  12.194 1.1433 10.080 1.4059 2.114045       1.812081  
1 1 1 1  26 2  o 8.1265 1.1983 78.687   18.825  86.516    26.001  70.063    27.290  8.6620 1.5582 7.5911 1.8209 1.070873       2.396570  
1 1 1 1  26 3  o 8.6546 1.0699 85.579   17.965  89.438    24.422  81.028    26.521  9.0112 1.3551 8.2980 1.6561 0.7132416      2.139829  
1 1 1 1  26 4  o 11.336 0.9077 140.641  20.552  143.027   28.549  138.075   29.611  11.464 1.2451 11.207 1.3210 0.2571392      1.815351  
1 1 1 1  26 5  o 7.2548 1.1828 62.993   18.011  92.173    25.884  35.602    25.079  9.0735 1.4264 5.4361 1.8871 3.637443       2.365503  
1 1 1 1  26 6  o 4.5071 1.2261 16.234   17.248  35.153    23.554  -5.6425   25.328  5.4120 1.8303 3.6021 1.6319 1.809904       2.452183  
1 1 1 1  26 7  o 4.6611 1.2564 20.414   16.817  32.143    23.925  8.9599    23.642  5.2645 1.8423 4.0577 1.7090 1.206803       2.512895  
1 1 1 1  26 8  o 5.8621 1.3123 40.803   17.084  39.896    22.303  42.090    26.575  5.8057 1.7646 5.9186 1.9428 -0.1128778     2.624550  
1 1 1 1  26 9  o 10.920 1.1434 158.957  18.710  182.603   21.813  93.114    36.399  13.285 0.8210 8.5544 2.1344 4.730225       2.286882  
1 1 1 1  26 10 o 7.7396 1.3029 66.708   17.659  60.715    20.235  85.850    36.162  7.3177 1.4339 8.1616 2.1758 -0.8438978     2.605769  
1 1 1 1  26 11 o 4.1119 1.2153 8.1164   14.998  3.6826    17.512  20.320    29.053  3.4225 1.4574 4.8013 1.9452 -1.378777      2.430585  
1 1 1 1  26 12 o 5.8304 1.3240 31.195   16.508  17.192    19.178  71.235    32.430  4.2386 1.6211 7.4222 2.0938 -3.183565      2.648032  
1 1 1 1  26 13 o 4.8605 1.3642 17.797   17.368  11.286    19.924  38.403    35.446  3.9681 1.6097 5.7529 2.2031 -1.784827      2.728473  
1 1 1 1  26 14 o 4.2235 1.2562 12.076   15.916  11.120    18.216  15.161    32.724  3.8083 1.5412 4.6388 1.9842 -0.8304546     2.512433  
1 1 1 1  26 15 o 4.5686 1.3208 7.8270   17.669  -5.8398   20.513  47.110    34.778  3.2127 1.4606 5.9245 2.2009 -2.711793      2.641513  
1 1 1 1  26 16 o 9.7835 1.1006 99.348   19.851  79.820    23.216  152.443   38.282  8.3623 1.3881 11.205 1.7083 -2.842392      2.201157  
1 1 1 1  26 17 o 4.4377 1.3218 17.268   17.821  14.000    20.577  27.078    35.650  3.9658 1.6255 4.9096 2.0848 -0.9438357     2.643584  
1 1 1 1  26 18 o 4.9669 1.3841 32.816   18.648  24.746    22.089  52.833    34.788  4.3823 1.7222 5.5515 2.1671 -1.169203      2.768108  
1 1 1 1  26 19 o 3.5562 1.1559 2.3968   18.046  9.4763    20.546  -21.4965  37.746  3.5811 1.5523 3.5312 1.7130 0.4983640E-01  2.311727  
1 1 1 1  26 20 o 5.9023 1.1166 63.507   18.946  81.850    21.255  -7.4274   41.798  8.0822 1.3149 3.7224 1.8050 4.359785       2.233201  
1 1 1 1  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  26 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 0  o 2.2055 1.1339 -48.4541 22.859  -36.5647  25.781  -92.1720  49.436  1.9693 1.4102 2.4417 1.7761 -0.000000      0.000000  
1 1 1 1  27 1  o 3.9159 1.1554 4.2889   16.045  -12.2212  22.444  21.545    22.946  3.2040 1.4826 4.6278 1.7725 -1.423731      2.310806  
1 1 1 1  27 2  o 8.3075 1.1895 81.530   19.060  83.594    26.318  79.252    27.641  8.4722 1.6121 8.1428 1.7494 0.3293505      2.378907  
1 1 1 1  27 3  o 12.666 0.8635 174.262  21.578  144.510   30.652  203.492   30.382  11.498 1.3330 13.834 1.0980 -2.336906      1.726988  
1 1 1 1  27 4  o 7.9402 1.2050 72.992   19.036  54.387    26.082  94.200    27.847  6.6857 1.8748 9.1946 1.5143 -2.508822      2.409993  
1 1 1 1  27 5  o 7.1677 1.3036 62.021   18.860  55.867    26.689  68.159    26.655  6.7747 1.8953 7.5607 1.7904 -0.7860165     2.607264  
1 1 1 1  27 6  o 4.0355 1.2022 8.3564   16.457  7.6386    22.010  9.2665    24.784  3.9203 1.6499 4.1508 1.7490 -0.2305629     2.404442  
1 1 1 1  27 7  o 5.6358 1.2903 35.643   20.105  62.883    26.167  -3.6082   31.411  7.2027 1.8167 4.0690 1.8327 3.133616       2.580581  
1 1 1 1  27 8  o 8.9003 1.1922 92.519   20.436  88.777    28.376  96.551    29.455  8.7056 1.6907 9.0951 1.6812 -0.3894672     2.384330  
1 1 1 1  27 9  o 5.2887 1.2223 24.283   17.709  -5.2694   23.815  60.831    26.485  3.5322 1.5929 7.0452 1.8543 -3.512952      2.444585  
1 1 1 1  27 10 o 6.9315 1.2493 56.699   16.494  53.768    19.915  63.097    29.429  6.8109 1.5023 7.0520 1.9964 -0.2410355     2.498508  
1 1 1 1  27 11 o 3.1536 1.0151 -14.4926 15.657  5.4873    18.425  -66.4188  29.703  3.5816 1.5086 2.7256 1.3586 0.8559661      2.030144  
1 1 1 1  27 12 o 5.2346 1.3902 26.098   17.236  19.025    19.664  49.551    35.807  4.3384 1.6458 6.1308 2.2409 -1.792387      2.780329  
1 1 1 1  27 13 f 4.5439 1.2528 20.338   17.682  31.984    21.441  -4.4215   31.263  5.1448 1.7463 3.9430 1.7967 1.201809       2.505510  
1 1 1 1  27 14 o 4.4114 1.3142 14.854   18.531  12.731    22.242  19.673    33.507  4.0615 1.6800 4.7613 2.0214 -0.6997380     2.628411  
1 1 1 1  27 15 o 8.3292 1.3377 101.702  21.208  115.439   24.945  65.887    40.279  10.155 1.2282 6.5031 2.3767 3.652131       2.675328  
1 1 1 1  27 16 o 4.4133 1.3243 13.214   17.931  3.7576    20.736  41.253    35.706  3.4834 1.5336 5.3432 2.1593 -1.859734      2.648518  
1 1 1 1  27 17 o 4.0852 1.2864 12.303   18.160  9.9530    20.484  20.934    39.252  3.6479 1.5654 4.5224 2.0417 -0.8744578     2.572773  
1 1 1 1  27 18 o 3.2691 1.1002 -7.6115  17.137  -7.0490   19.660  -9.3906   34.964  2.9239 1.3647 3.6143 1.7261 -0.6903760     2.200397  
1 1 1 1  27 19 o 4.7790 1.4034 32.443   18.972  21.495    21.582  69.670    39.797  4.0082 1.6562 5.5499 2.2660 -1.541641      2.806702  
1 1 1 1  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  27 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 0  o 4.1545 1.8343 18.029   25.281  11.706    28.334  42.720    55.986  3.3365 2.0819 4.9724 3.0207 -0.000000      0.000000  
1 1 1 1  28 1  o 4.2595 1.2424 11.364   17.638  -0.1131   26.094  21.020    23.934  3.8644 1.7099 4.6547 1.8029 -0.7903526     2.484823  
1 1 1 1  28 2  o 11.177 0.9439 136.511  21.095  133.560   29.444  139.623   30.238  11.055 1.3317 11.298 1.3382 -0.2434778     1.887885  
1 1 1 1  28 3  o 6.0706 1.4862 48.455   23.298  -0.3377   54.003  59.613    25.825  5.1300 2.3467 7.0112 1.8242 -1.881245      2.972355  
1 1 1 1  28 4  o 3.7775 1.1792 -0.4329  17.140  -3.4380   22.215  3.9869    26.942  3.4893 1.5587 4.0657 1.7700 -0.5763781     2.358486  
1 1 1 1  28 5  o 6.1988 1.3675 47.233   18.788  48.285    27.057  46.253    26.108  6.2546 1.9511 6.1430 1.9166 0.1115990      2.735029  
1 1 1 1  28 6  o 5.6947 1.2148 30.566   19.184  73.668    27.399  -10.8904  26.871  7.8176 1.7908 3.5717 1.6418 4.245862       2.429513  
1 1 1 1  28 7  o 4.2598 1.2152 10.191   17.365  28.812    24.045  -10.1095  25.105  5.0572 1.8382 3.4625 1.5898 1.594695       2.430323  
1 1 1 1  28 8  o 3.7937 1.1897 -3.0403  18.513  9.6109    25.423  -17.3241  27.013  4.1805 1.7670 3.4069 1.5933 0.7736223      2.379305  
1 1 1 1  28 9  o 4.4068 1.3004 12.877   19.081  14.571    27.471  11.299    26.523  4.4968 1.8641 4.3168 1.8137 0.1800399      2.600821  
1 1 1 1  28 10 o 6.4228 1.4309 53.623   20.468  53.528    27.425  53.742    30.752  6.4569 1.9554 6.3886 2.0896 0.6832266E-01  2.861833  
1 1 1 1  28 11 o 14.689 0.8894 238.569  26.051  257.745   36.823  219.356   36.859  15.343 1.2000 14.035 1.3132 1.308215       1.778880  
1 1 1 1  28 12 o 4.5637 1.3640 16.301   19.471  14.239    22.731  21.985    37.733  4.1600 1.7071 4.9674 2.1279 -0.8073335     2.728048  
1 1 1 1  28 13 o 4.5492 1.3283 15.108   18.440  5.1832    22.177  37.337    33.190  3.7046 1.6093 5.3939 2.1137 -1.689231      2.656615  
1 1 1 1  28 14 o 4.2915 1.2925 1.0389   18.843  -17.7306  22.475  45.456    34.573  2.9567 1.4040 5.6264 2.1704 -2.669668      2.584932  
1 1 1 1  28 15 o 5.6039 1.3858 49.710   19.579  53.853    22.978  38.728    37.408  6.1866 1.7685 5.0212 2.1340 1.165372       2.771511  
1 1 1 1  28 16 o 4.5084 1.3451 24.153   19.062  20.913    22.286  32.985    36.794  4.1994 1.7028 4.8174 2.0828 -0.6179881     2.690276  
1 1 1 1  28 17 o 5.0692 1.4677 35.992   20.426  24.517    23.241  74.929    42.812  4.2675 1.7358 5.8710 2.3673 -1.603510      2.935490  
1 1 1 1  28 18 o 4.4287 1.2893 31.896   19.462  38.819    22.533  11.568    38.613  4.9055 1.7800 3.9518 1.8658 0.9537115      2.578664  
1 1 1 1  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  28 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 0  o 2.7386 1.3457 -16.3435 23.247  -4.7206   25.791  -66.7010  53.684  2.6455 1.7685 2.8316 2.0289 -0.000000      0.000000  
1 1 1 1  29 1  o 7.7749 1.2495 75.064   21.244  31.018    30.297  117.670   29.797  5.2888 2.0340 10.261 1.4520 -4.972204      2.499098  
1 1 1 1  29 2  f 4.2349 1.2084 9.7580   17.436  28.678    23.503  -13.3982  26.002  5.0384 1.8195 3.4314 1.5906 1.607040       2.416752  
1 1 1 1  29 3  o 4.9394 1.2944 24.255   17.998  8.1345    25.301  40.770    25.608  4.1045 1.7499 5.7742 1.9077 -1.669708      2.588755  
1 1 1 1  29 4  f 12.358 0.9525 169.356  23.139  138.131   33.010  199.518   32.444  11.106 1.4862 13.610 1.1919 -2.504045      1.905084  
1 1 1 1  29 5  f 9.8018 1.1394 110.960  21.343  86.831    30.148  135.205   30.220  8.4981 1.8280 11.105 1.3606 -2.607354      2.278813  
1 1 1 1  29 6  o 6.7783 1.4134 57.920   21.042  72.352    29.569  43.114    29.951  7.6383 1.9337 5.9184 2.0618 1.719893       2.826729  
1 1 1 1  29 7  o 5.8036 1.4237 40.426   20.632  57.906    30.932  26.417    27.691  6.6391 2.0886 4.9682 1.9351 1.670946       2.847319  
1 1 1 1  29 8  o 8.3349 1.3353 87.500   21.691  86.804    29.503  88.320    32.000  8.3658 1.8155 8.3040 1.9585 0.6176662E-01  2.670532  
1 1 1 1  29 9  o 5.9081 1.4593 45.281   21.445  55.814    31.132  35.771    29.582  6.4289 2.1024 5.3872 2.0243 1.041630       2.918535  
1 1 1 1  29 10 o 4.5870 1.3827 14.778   22.910  0.6036    33.274  27.555    31.592  4.1566 1.8779 5.0175 2.0299 -0.8608384     2.765341  
1 1 1 1  29 11 o 5.4628 1.4565 37.656   22.987  17.842    33.635  55.022    31.488  4.6542 2.0018 6.2714 2.1163 -1.617260      2.913043  
1 1 1 1  29 12 o 5.5834 1.5069 43.935   23.559  49.424    32.659  37.979    34.017  5.8448 2.1395 5.3221 2.1226 0.5227532      3.013816  
1 1 1 1  29 13 o 6.5410 1.3888 63.570   19.522  65.275    24.231  60.416    32.954  6.9535 1.7451 6.1284 2.1609 0.8250866      2.777542  
1 1 1 1  29 14 o 4.6254 1.3717 27.475   20.155  28.024    23.296  25.843    40.196  4.5862 1.7781 4.6646 2.0893 -0.7839870E-01 2.743493  
1 1 1 1  29 15 o 3.4092 1.1503 -10.8561 18.366  -17.6828  21.299  8.9376    36.268  2.7611 1.3262 4.0572 1.8800 -1.296165      2.300697  
1 1 1 1  29 16 o 4.4734 1.3324 5.5779   19.031  -19.0216  21.877  82.084    38.582  2.7214 1.3163 6.2254 2.3171 -3.504011      2.664893  
1 1 1 1  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  29 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 0  o 4.1054 1.7719 25.477   27.139  34.258    29.895  -15.6601  64.707  4.4214 2.4010 3.7893 2.6063 -0.000000      0.000000  
1 1 1 1  30 1  o 5.4088 1.3973 35.237   19.644  34.685    26.787  35.878    28.894  5.3693 1.9419 5.4483 2.0097 -0.7903433E-01 2.794617  
1 1 1 1  30 2  o 5.5157 1.2683 25.949   20.592  73.253    29.674  -17.9910  28.599  7.5726 1.9481 3.4588 1.6245 4.113843       2.536566  
1 1 1 1  30 3  f 7.5799 1.3931 74.194   21.304  75.737    29.165  72.430    31.193  7.7311 1.8998 7.4288 2.0380 0.3022938      2.786169  
1 1 1 1  30 4  o 3.7217 1.1953 -4.9009  19.358  -2.3443   27.880  -7.2808   26.899  3.8248 1.7243 3.6186 1.6557 0.2061753      2.390506  
1 1 1 1  30 5  o 4.6246 1.3469 19.147   20.047  22.723    29.676  16.145    27.190  4.8032 1.9584 4.4460 1.8497 0.3572025      2.693893  
1 1 1 1  30 6  o 10.156 1.2652 120.589  24.309  75.114    31.416  188.448   38.376  7.5226 2.0377 12.790 1.5002 -5.267277      2.530370  
1 1 1 1  30 7  o 8.9663 1.4037 104.378  24.505  105.826   34.977  102.982   34.344  9.0224 1.9916 8.9101 1.9787 0.1122580      2.807485  
1 1 1 1  30 8  o 5.0174 1.4362 26.550   23.160  10.729    33.373  41.251    32.168  4.4370 1.9497 5.5977 2.1094 -1.160744      2.872445  
1 1 1 1  30 9  o 3.7159 1.2113 -6.9162  20.937  -12.1057  29.415  -1.5871   29.808  3.5667 1.6663 3.8651 1.7586 -0.2984078     2.422600  
1 1 1 1  30 10 o 7.2278 1.5019 76.420   24.930  106.936   35.560  46.925    34.961  8.7750 2.0613 5.6806 2.1849 3.094448       3.003798  
1 1 1 1  30 11 o 4.9175 1.4512 33.505   23.778  38.913    34.418  28.567    32.889  5.1115 2.0995 4.7235 2.0039 0.3879819      2.902331  
1 1 1 1  30 12 o 6.9750 1.5413 81.054   24.998  59.830    35.554  101.805   35.155  5.8765 2.2169 8.0736 2.1419 -2.197051      3.082577  
1 1 1 1  30 13 o 3.6777 1.2025 -0.8975  20.565  -11.5183  27.075  13.585    31.617  3.2627 1.5469 4.0927 1.8415 -0.8300185     2.405023  
1 1 1 1  30 14 o 5.2524 1.3933 45.662   23.455  74.782    31.105  7.2819    35.710  6.5785 2.0973 3.9263 1.8348 2.652200       2.786572  
1 1 1 1  30 15 o 3.7912 1.2239 8.4732   19.158  -2.6993   23.276  31.942    33.734  3.1699 1.4813 4.4126 1.9487 -1.242679      2.447831  
1 1 1 1  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  30 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 0  o 4.7652 2.0293 29.144   30.211  12.681    34.603  81.929    61.959  3.4931 2.2294 6.0373 3.3914 -0.000000      0.000000  
1 1 1 1  31 1  o 7.3903 1.3528 71.559   20.903  93.388    29.649  49.984    29.476  8.6761 1.7687 6.1045 2.0476 2.571646       2.705698  
1 1 1 1  31 2  o 4.3550 1.4860 -12.7226 25.746  0.8816    70.475  -14.8179  27.657  5.2724 2.4986 3.4376 1.6091 1.834813       2.971912  
1 1 1 1  31 3  o 9.0843 1.3366 106.603  23.906  81.187    34.412  130.313   33.236  7.6512 2.1563 10.517 1.5800 -2.866242      2.673199  
1 1 1 1  31 4  o 6.0439 1.4526 49.475   21.364  59.988    30.141  38.860    30.286  6.6143 2.0587 5.4734 2.0499 1.140940       2.905156  
1 1 1 1  31 5  o 6.4210 1.5221 58.886   23.065  56.239    32.893  61.446    32.350  6.2742 2.1621 6.5679 2.1430 -0.2937422     3.044197  
1 1 1 1  31 6  o 5.9003 1.3867 45.299   22.998  4.6974    34.002  79.536    31.224  4.2075 1.8999 7.5931 2.0206 -3.385616      2.773486  
1 1 1 1  31 7  o 4.5436 1.3757 16.430   22.672  1.9750    30.933  33.209    33.327  3.9789 1.8030 5.1082 2.0783 -1.129260      2.751337  
1 1 1 1  31 8  o 8.9659 1.4470 115.288  25.380  107.012   37.410  122.344   34.547  8.4170 2.1983 9.5147 1.8821 -1.097718      2.893952  
1 1 1 1  31 9  f 5.0612 1.4564 36.623   24.071  61.256    35.497  15.653    32.752  5.9004 2.2173 4.2219 1.8888 1.678494       2.912788  
1 1 1 1  31 10 o 4.4417 1.3629 22.083   22.739  28.983    29.897  12.615    35.022  4.6622 1.9397 4.2212 1.9150 0.4410324      2.725719  
1 1 1 1  31 11 o 4.4040 1.3327 18.070   22.690  -11.0792  31.920  47.846    32.261  3.4891 1.6615 5.3189 2.0840 -1.829814      2.665309  
1 1 1 1  31 12 o 4.1363 1.3203 17.312   23.442  26.158    32.486  7.6993    33.862  4.3780 1.9237 3.8946 1.8088 0.4834085      2.640533  
1 1 1 1  31 13 o 3.2660 1.1221 -17.4493 23.151  -20.7757  32.621  -14.0737  32.861  3.2050 1.5632 3.3269 1.6101 -0.1218710     2.244132  
1 1 1 1  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  31 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 0  o 3.6829 1.7175 14.235   29.987  21.195    33.354  -15.1156  68.494  3.6799 2.2796 3.6859 2.5696 -0.000000      0.000000  
1 1 1 1  32 1  o 5.1369 1.3978 33.393   21.408  50.195    29.616  15.008    30.981  5.9051 2.0507 4.3687 1.8999 1.536442       2.795536  
1 1 1 1  32 2  o 5.0423 1.4146 30.980   21.738  16.463    29.474  48.296    32.190  4.3578 1.8741 5.7269 2.1195 -1.369108      2.829185  
1 1 1 1  32 3  o 7.1453 1.4833 76.099   22.740  69.633    33.201  81.812    31.209  6.7315 2.1690 7.5591 2.0240 -0.8275590     2.966663  
1 1 1 1  32 4  o 5.7956 1.4378 50.846   21.903  30.848    31.126  70.463    30.829  4.8102 1.9883 6.7811 2.0773 -1.970869      2.875540  
1 1 1 1  32 5  o 5.6267 1.4812 51.679   22.454  44.323    31.529  59.250    31.986  5.2774 2.0623 5.9760 2.1266 -0.6986337     2.962326  
1 1 1 1  32 6  o 7.5734 1.5169 91.355   24.009  91.181    35.171  91.508    32.855  7.4556 2.2047 7.6912 2.0840 -0.2355857     3.033758  
1 1 1 1  32 7  o 3.6388 1.2080 -14.5679 23.352  -45.6056  33.222  15.744    32.831  3.0232 1.4947 4.2544 1.8981 -1.231213      2.416004  
1 1 1 1  32 8  o 8.5051 1.4470 111.370  24.812  86.361    34.406  138.470   35.816  7.1579 2.1949 9.8523 1.8864 -2.694408      2.894085  
1 1 1 1  32 9  o 4.4289 1.3778 24.868   24.217  37.587    33.232  10.465    35.362  4.8201 2.0279 4.0376 1.8658 0.7825098      2.755634  
1 1 1 1  32 10 o 4.3456 1.3611 26.154   23.650  35.672    33.389  16.569    33.505  4.6304 1.9930 4.0608 1.8541 0.5696263      2.722104  
1 1 1 1  32 11 o 4.5880 1.4125 37.394   24.564  28.159    35.491  45.886    34.033  4.3046 1.9426 4.8714 2.0510 -0.5667915     2.824947  
1 1 1 1  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  32 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 0  o 2.6777 1.3543 -23.8508 26.815  -13.5595  29.196  -79.3271  67.787  2.4560 1.7041 2.8994 2.1054 -0.000000      0.000000  
1 1 1 1  33 1  o 3.5421 1.1818 -8.5841  21.871  -13.2476  32.064  -4.5263   29.909  3.4928 1.6639 3.5913 1.6786 -0.9850502E-01 2.363501  
1 1 1 1  33 2  o 3.8209 1.2323 4.0166   21.203  14.879    29.299  -7.9273   30.723  4.1046 1.8142 3.5372 1.6683 0.5673428      2.464672  
1 1 1 1  33 3  o 3.1942 1.0860 -23.7716 20.670  -1.2940   29.323  -45.9701  29.140  3.6186 1.6815 2.7698 1.3747 0.8488445      2.171928  
1 1 1 1  33 4  o 4.2664 1.3441 19.266   23.086  23.430    34.420  15.862    31.125  4.4078 1.9564 4.1249 1.8437 0.2828398      2.688273  
1 1 1 1  33 5  o 3.8185 1.2526 3.6587   22.861  -4.8339   31.372  13.275    33.382  3.5680 1.6837 4.0690 1.8551 -0.5009837     2.505212  
1 1 1 1  33 6  o 4.1867 1.3099 16.308   22.765  -7.0209   32.241  39.505    32.150  3.5220 1.6752 4.8514 2.0143 -1.329428      2.619852  
1 1 1 1  33 7  o 4.0547 1.3233 15.738   25.060  18.158    35.399  13.307    35.481  4.1124 1.8881 3.9970 1.8547 0.1154172      2.646680  
1 1 1 1  33 8  o 3.3463 1.1360 -22.0454 23.392  -67.3871  34.184  17.882    32.078  2.6917 1.3575 4.0009 1.8219 -1.309215      2.271987  
1 1 1 1  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  33 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 0  o 3.3446 1.6542 7.4386   30.880  4.7685    33.511  22.468    79.504  2.9197 1.9710 3.7695 2.6573 -0.000000      0.000000  
1 1 1 1  34 1  o 4.7226 1.5829 29.590   28.418  126.836   75.672  13.623    30.662  5.5684 2.6238 3.8768 1.7715 1.691643       3.165816  
1 1 1 1  34 2  o 4.5676 1.3794 31.123   24.522  -1.5479   35.459  61.069    33.948  3.6411 1.7387 5.4941 2.1419 -1.852902      2.758778  
1 1 1 1  34 3  o 5.4805 1.5103 60.756   24.025  52.101    33.522  69.898    34.451  5.1235 2.0844 5.8376 2.1863 -0.7140431     3.020665  
1 1 1 1  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  34 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  35 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  36 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  37 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  38 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  39 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  39 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 1  39 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  2  o 40.753 0.5504 1665.76  44.859  1659.37   63.446  1672.14   63.433  40.674 0.7799 40.831 0.7768 -0.1567307     1.100752  
1 1 1 2  1  3  o 19.655 0.5601 388.884  20.768  391.845   25.503  383.056   35.785  19.776 0.6448 19.534 0.9160 0.2423191      1.120178  
1 1 1 2  1  4  o 16.532 0.5497 273.446  17.310  278.784   29.489  270.640   21.382  16.642 0.8860 16.422 0.6510 0.2203045      1.099429  
1 1 1 2  1  5  f 24.959 0.4828 625.183  24.102  630.454   34.174  619.965   33.998  25.064 0.6817 24.854 0.6840 0.2096653      0.9656947 
1 1 1 2  1  6  o 10.357 0.4550 107.593  9.4229  105.473   13.370  109.686   13.282  10.255 0.6519 10.459 0.6350 -0.2036037     0.9100310 
1 1 1 2  1  7  o 32.219 0.4704 1046.05  29.732  1064.96   38.662  1018.68   46.511  32.589 0.5932 31.850 0.7302 0.7386112      0.9407410 
1 1 1 2  1  8  o 10.637 0.4274 114.065  8.9105  116.733   11.585  110.201   13.943  10.793 0.5367 10.480 0.6652 0.3123131      0.8547022 
1 1 1 2  1  9  o 22.126 0.4339 492.560  18.840  498.356   24.465  484.116   29.530  22.294 0.5487 21.959 0.6724 0.3355122      0.8678641 
1 1 1 2  1  10 o 43.433 0.4404 1892.79  37.866  1901.60   50.180  1881.15   57.708  43.559 0.5760 43.308 0.6663 0.2510948      0.8807243 
1 1 1 2  1  11 o 5.1410 0.3904 27.457   3.8364  30.662    4.9451  22.612    6.0799  5.5335 0.4468 4.7484 0.6402 0.7850738      0.7807127 
1 1 1 2  1  12 o 6.8717 0.3327 47.284   4.5701  47.428    6.3783  47.133    6.5513  6.8826 0.4634 6.8608 0.4774 0.2174616E-01  0.6653277 
1 1 1 2  1  13 o 32.073 0.3276 1030.23  21.013  1013.34   29.652  1047.27   29.781  31.809 0.4661 32.337 0.4605 -0.5286274     0.6552039 
1 1 1 2  1  14 o 10.594 0.3084 112.455  6.5315  113.614   9.1371  111.243   9.3401  10.650 0.4290 10.538 0.4432 0.1123180      0.6167879 
1 1 1 2  1  15 o 11.881 0.3067 141.410  7.2879  139.082   10.232  143.806   10.383  11.782 0.4342 11.980 0.4333 -0.1984549     0.6134671 
1 1 1 2  1  16 o 11.530 0.3161 134.208  7.2451  147.730   10.094  119.842   10.405  12.136 0.4159 10.925 0.4762 1.210565       0.6322457 
1 1 1 2  1  17 o 2.1717 0.4703 2.5721   3.1905  9.6766    4.1278  -7.9710   5.0285  3.0324 0.6954 1.3111 0.6334 1.721238       0.9406682 
1 1 1 2  1  18 o 9.7949 0.3257 96.699   6.3671  90.848    9.0739  102.375   8.9367  9.5003 0.4776 10.090 0.4429 -0.5893259     0.6513029 
1 1 1 2  1  19 f 14.996 0.3061 226.177  9.1733  238.255   13.205  214.912   12.753  15.383 0.4292 14.608 0.4365 0.7746887      0.6121540 
1 1 1 2  1  20 o 7.5141 0.3752 59.702   5.3849  71.242    7.1486  44.563    8.1876  8.4075 0.4251 6.6206 0.6183 1.786830       0.7503890 
1 1 1 2  1  21 o 14.424 0.3065 211.333  8.7743  221.403   11.877  199.234   13.019  14.815 0.4008 14.033 0.4639 0.7819681      0.6130816 
1 1 1 2  1  22 o 2.7477 0.6662 7.0350   4.2776  5.7321    5.3304  9.3918    7.1691  2.4680 0.8692 3.0274 1.0098 -0.5594337     1.332382  
1 1 1 2  1  23 o 10.345 0.3502 109.666  7.0987  114.963   9.2983  102.264   10.991  10.664 0.4360 10.026 0.5481 0.6377602      0.7003688 
1 1 1 2  1  24 o 3.0263 0.6586 10.006   4.7548  13.775    5.8247  2.4800    8.2319  3.5777 0.8301 2.4749 1.0227 1.102813       1.317199  
1 1 1 2  1  25 o 5.0697 0.5627 25.507   5.4805  23.000    6.7344  30.425    9.4306  4.7323 0.7115 5.4072 0.8720 -0.6749239     1.125498  
1 1 1 2  1  26 o 7.0028 0.4922 53.259   6.2820  59.039    7.7396  42.100    10.755  7.6332 0.5070 6.3724 0.8439 1.260779       0.9844393 
1 1 1 2  1  27 o 19.451 0.3293 387.716  12.549  411.627   16.501  354.911   19.327  20.197 0.4085 18.704 0.5167 1.493303       0.6586391 
1 1 1 2  1  28 o 2.3998 0.6825 2.9796   5.2853  6.8549    6.1099  -8.5417   10.535  2.6617 0.9310 2.1380 0.9983 0.5237741      1.365036  
1 1 1 2  1  29 o 3.4372 0.7896 12.974   5.8707  13.863    6.7950  10.353    11.659  3.5397 0.9429 3.3348 1.2667 0.2048457      1.579139  
1 1 1 2  1  30 o 10.066 0.4605 108.554  8.4605  112.483   10.214  99.965    15.102  10.465 0.4880 9.6680 0.7810 0.7967882      0.9209660 
1 1 1 2  1  31 o 8.6387 0.5948 92.302   8.3400  105.484   9.8809  59.646    15.552  10.107 0.4888 7.1700 1.0845 2.937371       1.189573  
1 1 1 2  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  2  0  o 2.1143 0.7046 6.1705   3.7724  9.6141    5.2739  2.5626    5.3983  2.6419 1.0399 1.5868 0.9509 -0.000000      0.000000  
1 1 1 2  2  1  o 22.306 0.4561 498.495  20.342  510.333   28.814  486.734   28.721  22.570 0.6383 22.041 0.6515 0.5288391      0.9121190 
1 1 1 2  2  2  o 33.685 0.5061 1137.32  34.098  1147.35   48.280  1127.34   48.164  33.834 0.7135 33.537 0.7181 0.2968330      1.012270  
1 1 1 2  2  3  o 12.697 0.4338 161.591  11.015  165.109   15.597  158.090   15.559  12.835 0.6076 12.559 0.6195 0.2763519      0.8676984 
1 1 1 2  2  4  o 9.3342 0.5370 85.952   9.4218  82.888    11.413  92.507    16.694  9.0865 0.6280 9.5819 0.8711 -0.4954042     1.073924  
1 1 1 2  2  5  f 20.471 0.5568 418.344  21.468  413.515   26.193  428.225   37.468  20.306 0.6450 20.636 0.9078 -0.3294315     1.113618  
1 1 1 2  2  6  o 34.875 0.6359 1223.59  41.797  1223.89   51.186  1223.01   72.408  34.916 0.7330 34.834 1.0393 0.8130646E-01  1.271804  
1 1 1 2  2  7  o 5.9157 0.5643 35.910   6.3380  46.316    9.1460  26.295    8.7911  6.7943 0.6731 5.0372 0.9059 1.757087       1.128588  
1 1 1 2  2  8  f 20.480 0.4747 421.086  19.428  401.028   27.460  441.188   27.491  19.989 0.6869 20.970 0.6555 -0.9804153     0.9494408 
1 1 1 2  2  9  o 25.442 0.4897 650.099  24.913  665.686   35.370  634.752   35.096  25.745 0.6869 25.138 0.6981 0.6070595      0.9793638 
1 1 1 2  2  10 o 60.304 0.6225 3645.89  73.637  3700.75   116.434 3609.31   95.064  60.653 0.9598 59.955 0.7928 0.6973648      1.244912  
1 1 1 2  2  11 o 45.806 0.4525 2098.62  41.038  2067.81   54.155  2140.18   62.895  45.420 0.5962 46.192 0.6808 -0.7716408     0.9049257 
1 1 1 2  2  12 o 21.949 0.3736 484.810  16.146  496.090   21.193  469.208   24.924  22.258 0.4761 21.640 0.5759 0.6182289      0.7471951 
1 1 1 2  2  13 o 24.027 0.3315 577.929  15.815  575.730   21.125  580.733   23.854  23.977 0.4405 24.077 0.4954 -0.9945869E-01 0.6629199 
1 1 1 2  2  14 o 33.765 0.3358 1142.52  22.676  1149.01   32.058  1136.03   32.078  33.861 0.4734 33.668 0.4764 0.1922913      0.6715893 
1 1 1 2  2  15 o 10.681 0.3151 114.384  6.7261  118.273   9.4786  110.440   9.5461  10.864 0.4362 10.497 0.4547 0.3668604      0.6301217 
1 1 1 2  2  16 o 15.245 0.3092 233.348  9.4227  237.453   13.201  229.084   13.454  15.383 0.4291 15.107 0.4453 0.2755079      0.6183707 
1 1 1 2  2  17 o 4.9259 0.4833 26.334   4.3394  34.270    5.9077  17.034    6.3949  5.8330 0.5064 4.0188 0.8233 1.814258       0.9665852 
1 1 1 2  2  18 o 8.7660 0.3574 78.125   6.2082  86.368    8.5528  68.945    9.0258  9.2646 0.4616 8.2673 0.5459 0.9972391      0.7148682 
1 1 1 2  2  19 o 16.235 0.3206 266.427  10.378  281.856   14.434  249.919   14.930  16.729 0.4314 15.741 0.4742 0.9878635      0.6411099 
1 1 1 2  2  20 o 14.698 0.3266 217.900  9.5891  214.860   13.201  221.294   13.952  14.593 0.4523 14.804 0.4712 -0.2112741     0.6531825 
1 1 1 2  2  21 o 6.1874 0.4529 38.634   5.5669  34.397    7.3851  44.210    8.4718  5.8005 0.6366 6.5743 0.6443 -0.7738376     0.9057543 
1 1 1 2  2  22 o 8.1852 0.4094 68.497   6.6436  69.386    8.8711  67.361    10.025  8.2572 0.5372 8.1131 0.6178 0.1440735      0.8187083 
1 1 1 2  2  23 f 4.9400 0.6061 27.335   5.5278  32.544    7.1786  19.746    8.6643  5.6409 0.6363 4.2390 1.0317 1.401953       1.212159  
1 1 1 2  2  24 o 2.1393 0.6398 0.8655   4.6925  2.8467    5.7745  -2.9861   8.0515  2.1971 0.8751 2.0815 0.9335 0.1155198      1.279532  
1 1 1 2  2  25 o 18.913 0.3461 363.389  13.003  374.037   17.555  350.449   19.353  19.236 0.4563 18.590 0.5205 0.6464100      0.6922269 
1 1 1 2  2  26 o 8.7619 0.4521 80.245   7.6177  86.415    9.7734  70.695    12.159  9.2296 0.5295 8.2941 0.7330 0.9355230      0.9042287 
1 1 1 2  2  27 o 13.691 0.3867 192.151  10.355  199.585   13.475  181.431   16.182  14.042 0.4798 13.340 0.6065 0.7018232      0.7733452 
1 1 1 2  2  28 o 4.5772 0.7934 23.581   6.7108  23.979    7.9075  22.557    12.687  4.7152 0.8706 4.4392 1.3268 0.2760148      1.586895  
1 1 1 2  2  29 o 5.7584 0.7102 36.707   7.3031  37.397    8.8054  35.187    13.072  5.9875 0.7353 5.5293 1.2152 0.4582033      1.420370  
1 1 1 2  2  30 o 9.1807 0.5757 89.535   10.507  81.432    13.948  100.162   15.975  8.7169 0.8000 9.6445 0.8282 -0.9275789     1.151493  
1 1 1 2  2  31 o 7.1588 0.7454 66.184   8.6079  76.351    10.346  43.321    15.515  8.5221 0.6070 5.7954 1.3617 2.726756       1.490858  
1 1 1 2  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  2  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  3  0  o 45.564 0.8148 2086.76  74.146  2064.88   104.682 2108.80   105.037 45.323 1.1565 45.805 1.1482 -0.000000      0.000000  
1 1 1 2  3  1  o 35.397 0.5167 1256.39  36.579  1268.22   51.803  1244.62   51.660  35.564 0.7283 35.231 0.7332 0.3331871      1.033428  
1 1 1 2  3  2  o 19.275 0.4494 372.555  17.323  372.909   24.514  372.201   24.484  19.284 0.6356 19.266 0.6354 0.1830101E-01  0.8987418 
1 1 1 2  3  3  f 28.186 0.4831 798.164  27.230  810.480   38.562  785.915   38.456  28.404 0.6788 27.968 0.6875 0.4354095      0.9661430 
1 1 1 2  3  4  o 8.2536 0.4432 68.326   7.3158  68.679    10.283  67.964    10.411  8.2754 0.6213 8.2318 0.6323 0.4359722E-01  0.8864830 
1 1 1 2  3  5  o 13.348 0.5353 175.428  13.491  168.866   16.405  189.134   23.709  12.978 0.6321 13.718 0.8641 -0.7408333     1.070617  
1 1 1 2  3  6  o 32.065 0.6145 1027.62  37.145  1014.29   45.350  1054.79   64.746  31.783 0.7134 32.348 1.0008 -0.5645809     1.229055  
1 1 1 2  3  7  o 25.086 0.5534 631.435  24.136  630.788   27.924  633.348   47.994  25.088 0.5565 25.085 0.9566 0.3103256E-02  1.106738  
1 1 1 2  3  8  o 10.715 0.5635 119.209  10.176  122.704   11.698  108.333   20.635  11.064 0.5286 10.366 0.9953 0.6985235      1.127006  
1 1 1 2  3  9  o 11.140 0.6014 125.999  12.650  128.372   15.595  121.434   21.630  11.307 0.6896 10.974 0.9855 0.3332081      1.202850  
1 1 1 2  3  10 o 37.970 0.5057 1452.92  37.681  1414.37   58.903  1479.62   49.025  37.529 0.7848 38.412 0.6381 -0.8833771     1.011488  
1 1 1 2  3  11 o 47.864 0.5539 2301.94  52.032  2288.07   81.750  2311.39   67.460  47.725 0.8565 48.003 0.7027 -0.2782326     1.107818  
1 1 1 2  3  12 o 19.772 0.4459 393.006  17.322  385.999   27.033  397.888   22.564  19.617 0.6890 19.927 0.5662 -0.3096313     0.8917899 
1 1 1 2  3  13 o 53.269 0.5225 2848.06  55.653  2765.67   77.710  2934.81   79.740  52.478 0.7404 54.059 0.7375 -1.581730      1.045058  
1 1 1 2  3  14 o 37.384 0.4500 1404.34  33.617  1461.59   47.282  1345.82   47.806  38.159 0.6195 36.609 0.6529 1.549976       0.9000723 
1 1 1 2  3  15 o 7.6006 0.4682 59.777   6.9047  68.670    9.2073  48.349    10.437  8.2713 0.5566 6.9298 0.7531 1.341554       0.9364320 
1 1 1 2  3  16 o 9.7225 0.3779 95.290   7.3248  98.921    10.092  91.249    10.648  9.9211 0.5086 9.5238 0.5590 0.3973904      0.7557746 
1 1 1 2  3  17 o 14.503 0.3822 212.264  10.946  212.215   14.384  212.331   16.871  14.511 0.4956 14.494 0.5820 0.1714134E-01  0.7644212 
1 1 1 2  3  18 o 6.5361 0.4502 43.194   5.8715  42.087    7.9988  44.488    8.6460  6.4476 0.6203 6.6247 0.6526 -0.1770902     0.9003360 
1 1 1 2  3  19 o 15.352 0.3429 238.038  10.491  236.743   15.481  239.137   14.267  15.307 0.5057 15.397 0.4633 -0.9002590E-01 0.6858449 
1 1 1 2  3  20 o 7.8399 0.4122 62.363   6.4602  64.765    9.2544  60.081    9.0222  7.9877 0.5793 7.6920 0.5865 0.2956886      0.8243257 
1 1 1 2  3  21 o 9.7579 0.3687 96.905   7.1633  99.923    9.7792  93.410    10.523  9.9301 0.4924 9.5858 0.5489 0.3443708      0.7373668 
1 1 1 2  3  22 o 8.8256 0.3930 79.142   6.9097  77.048    9.3122  81.707    10.307  8.7021 0.5351 8.9491 0.5759 -0.2470388     0.7860681 
1 1 1 2  3  23 o 9.5300 0.3919 91.671   7.4391  85.219    9.9810  99.735    11.158  9.1580 0.5449 9.9019 0.5634 -0.7439175     0.7838379 
1 1 1 2  3  24 o 4.1730 0.6454 20.237   5.3322  26.151    6.8648  11.241    8.4664  5.0491 0.6798 3.2969 1.0973 1.752239       1.290803  
1 1 1 2  3  25 o 12.968 0.3705 170.835  9.5291  173.489   12.737  167.460   14.361  13.095 0.4864 12.841 0.5592 0.2535849      0.7410925 
1 1 1 2  3  26 o 15.567 0.3824 244.997  11.627  241.358   14.874  250.714   18.644  15.443 0.4816 15.691 0.5941 -0.2479906     0.7647448 
1 1 1 2  3  27 o 11.003 0.4283 127.879  9.0084  143.549   11.652  104.596   14.203  11.907 0.4893 10.098 0.7032 1.809046       0.8566964 
1 1 1 2  3  28 o 6.0212 0.6824 42.455   7.1496  49.130    8.8391  29.825    12.159  6.9154 0.6391 5.1270 1.2060 1.788404       1.364862  
1 1 1 2  3  29 o 8.8398 0.5044 81.905   8.4759  83.156    10.537  79.610    14.267  8.9936 0.5858 8.6859 0.8213 0.3076286      1.008782  
1 1 1 2  3  30 o 6.6652 0.7456 57.902   8.1357  70.305    9.9297  32.571    14.191  8.2209 0.6039 5.1094 1.3634 3.111518       1.491137  
1 1 1 2  3  31 f 1.9227 0.6666 -11.8905 6.8543  -10.3512  7.7118  -17.6808  14.957  1.6233 0.7843 2.2221 1.0780 -0.5987593     1.333112  
1 1 1 2  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  3  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  4  0  o 12.115 0.6322 149.711  15.124  152.646   21.401  146.783   21.375  12.238 0.8850 11.992 0.9030 -0.000000      0.000000  
1 1 1 2  4  1  f 15.213 0.4427 232.353  13.469  227.364   19.021  237.371   19.076  15.049 0.6320 15.378 0.6203 -0.3287401     0.8854951 
1 1 1 2  4  2  o 8.3356 0.4500 69.897   7.4783  76.238    10.567  63.534    10.585  8.7167 0.6061 7.9546 0.6654 0.7620926      0.9000356 
1 1 1 2  4  3  o 13.676 0.4422 187.588  12.095  188.345   17.052  186.821   17.157  13.704 0.6221 13.649 0.6285 0.5593777E-01  0.8843710 
1 1 1 2  4  4  o 25.737 0.4766 664.381  24.531  662.176   34.553  666.621   34.831  25.694 0.6724 25.780 0.6755 -0.8573532E-01 0.9531400 
1 1 1 2  4  5  o 30.344 0.4979 924.391  30.213  938.408   42.605  910.210   42.852  30.576 0.6967 30.111 0.7116 0.4653187      0.9958504 
1 1 1 2  4  6  o 20.721 0.4664 430.891  19.321  438.694   27.096  422.819   27.559  20.913 0.6478 20.529 0.6712 0.3841972      0.9328576 
1 1 1 2  4  7  o 20.246 0.5411 410.204  19.043  408.638   22.015  414.858   37.954  20.192 0.5451 20.300 0.9348 -0.1085606     1.082141  
1 1 1 2  4  8  o 12.300 0.5448 150.589  11.590  149.132   13.346  155.057   23.375  12.196 0.5471 12.403 0.9423 -0.2075634     1.089615  
1 1 1 2  4  9  o 20.987 0.5530 445.949  20.121  449.676   23.302  435.027   39.894  21.183 0.5500 20.790 0.9594 0.3929520      1.105924  
1 1 1 2  4  10 o 28.669 0.5822 831.084  29.075  836.580   33.736  815.216   57.322  28.888 0.5839 28.449 1.0075 0.4397278      1.164446  
1 1 1 2  4  11 o 33.568 0.5325 1130.20  35.741  1101.17   50.144  1160.18   50.956  33.129 0.7568 34.006 0.7492 -0.8771820     1.064914  
1 1 1 2  4  12 o 33.047 0.5313 1096.01  35.115  1074.85   49.194  1118.00   50.139  32.722 0.7517 33.373 0.7512 -0.6504478     1.062700  
1 1 1 2  4  13 o 26.180 0.4644 691.725  23.853  667.536   37.216  708.589   31.074  25.779 0.7218 26.581 0.5845 -0.8011684     0.9288132 
1 1 1 2  4  14 o 32.704 0.4330 1073.77  28.308  1083.53   39.571  1063.54   40.514  32.858 0.6022 32.549 0.6223 0.3085442      0.8659701 
1 1 1 2  4  15 o 14.598 0.4046 215.054  11.752  227.299   16.140  201.236   17.145  15.046 0.5364 14.149 0.6059 0.8967590      0.8091726 
1 1 1 2  4  16 o 9.4547 0.4427 89.428   8.3161  84.764    11.030  95.571    12.658  9.1740 0.6012 9.7354 0.6501 -0.5613918     0.8854783 
1 1 1 2  4  17 o 3.2093 0.6860 10.758   4.5613  11.228    5.4435  9.6496    8.3575  3.2519 0.8332 3.1666 1.0899 0.8533287E-01  1.371930  
1 1 1 2  4  18 o 13.689 0.3668 189.700  10.018  201.149   14.010  177.722   14.331  14.118 0.4962 13.260 0.5404 0.8587723      0.7336214 
1 1 1 2  4  19 o 4.2233 0.6286 18.954   5.1260  17.316    6.9073  20.963    7.6476  4.0190 0.8834 4.4277 0.8944 -0.4087272     1.257133  
1 1 1 2  4  20 o 15.043 0.3676 229.210  11.053  230.670   15.392  227.654   15.881  15.096 0.5098 14.989 0.5297 0.1062412      0.7352052 
1 1 1 2  4  21 o 15.555 0.3741 245.326  11.629  233.099   16.165  258.442   16.743  15.152 0.5334 15.959 0.5246 -0.8063841     0.7481351 
1 1 1 2  4  22 o 12.985 0.3954 172.185  10.239  179.934   14.175  163.730   14.807  13.303 0.5328 12.668 0.5844 0.6343946      0.7908216 
1 1 1 2  4  23 o 2.8544 0.6376 6.6878   5.2061  15.402    6.7657  -5.9615   8.1513  3.7714 0.9079 1.9374 0.8954 1.833988       1.275187  
1 1 1 2  4  24 o 4.0909 0.7666 16.922   6.4464  10.802    8.1670  27.036    10.499  3.2340 1.0778 4.9478 1.0904 -1.713749      1.533165  
1 1 1 2  4  25 o 3.9550 0.7356 17.742   6.3221  24.559    8.3230  8.4437    9.7205  4.7914 0.9016 3.1187 1.1626 1.672715       1.471256  
1 1 1 2  4  26 o 25.264 0.3908 649.006  19.712  658.333   27.226  638.731   28.578  25.467 0.5345 25.060 0.5702 0.4075966      0.7815561 
1 1 1 2  4  27 o 5.7834 0.6597 33.906   7.4380  30.465    9.3500  39.837    12.275  5.4143 0.8635 6.1525 0.9976 -0.7382493     1.319358  
1 1 1 2  4  28 o 2.8449 0.7765 6.4891   6.3490  9.4227    7.6679  0.0930    11.322  3.0446 1.0442 2.6451 1.1495 0.3995459      1.552969  
1 1 1 2  4  29 o 5.2128 0.7901 33.046   7.7402  38.196    9.5051  22.909    13.336  6.0256 0.7887 4.4000 1.3693 1.625600       1.580239  
1 1 1 2  4  30 o 3.0139 0.7859 8.7581   7.2096  14.904    8.1464  -13.4488  15.485  3.5900 1.0609 2.4378 1.1599 1.152206       1.571896  
1 1 1 2  4  31 o 4.5925 0.8975 28.367   8.5503  31.342    10.366  22.037    15.123  5.1375 1.0444 4.0474 1.4598 1.090102       1.794983  
1 1 1 2  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  4  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  5  0  o 18.998 0.6478 364.534  24.483  362.697   34.530  366.392   34.718  18.950 0.9160 19.047 0.9162 -0.000000      0.000000  
1 1 1 2  5  1  o 12.950 0.4451 168.192  11.529  169.455   16.278  166.920   16.332  12.999 0.6261 12.901 0.6329 0.9799385E-01  0.8902929 
1 1 1 2  5  2  o 8.2077 0.4604 67.577   7.5501  63.930    10.635  71.284    10.721  7.9837 0.6660 8.4316 0.6358 -0.4478340     0.9207386 
1 1 1 2  5  3  o 19.399 0.4573 377.388  17.741  378.769   25.035  375.995   25.145  19.435 0.6441 19.363 0.6493 0.7172585E-01  0.9145615 
1 1 1 2  5  4  o 20.884 0.4640 437.671  19.379  444.237   27.308  431.012   27.504  21.043 0.6489 20.726 0.6635 0.3171215      0.9280730 
1 1 1 2  5  5  f 20.779 0.4658 433.102  19.355  430.230   27.149  436.070   27.601  20.709 0.6555 20.848 0.6620 -0.1394119     0.9315788 
1 1 1 2  5  6  o 13.806 0.4616 191.276  12.740  194.297   17.844  188.135   18.195  13.918 0.6410 13.694 0.6643 0.2240152      0.9231877 
1 1 1 2  5  7  o 18.039 0.5393 324.123  16.983  321.130   19.650  332.958   33.761  17.897 0.5490 18.181 0.9285 -0.2836361     1.078604  
1 1 1 2  5  8  o 14.999 0.5443 227.927  14.213  229.829   16.496  222.443   28.006  15.141 0.5448 14.857 0.9425 0.2834845      1.088620  
1 1 1 2  5  9  o 10.311 0.5764 109.195  10.166  111.561   11.737  102.089   20.338  10.551 0.5562 10.070 1.0098 0.4814119      1.152887  
1 1 1 2  5  10 o 18.110 0.5487 327.296  17.297  325.282   19.996  333.278   34.471  18.018 0.5549 18.203 0.9468 -0.1855450     1.097459  
1 1 1 2  5  11 o 35.110 0.5415 1237.11  38.019  1244.61   53.427  1229.43   54.114  35.219 0.7585 35.001 0.7730 0.2177505      1.082995  
1 1 1 2  5  12 o 55.001 0.6539 3041.46  71.888  2888.69   100.325 3202.68   103.060 53.579 0.9362 56.424 0.9133 -2.845261      1.307889  
1 1 1 2  5  13 o 24.971 0.5079 625.948  25.343  589.607   35.303  664.586   36.402  24.223 0.7287 25.720 0.7076 -1.497663      1.015777  
1 1 1 2  5  14 o 31.482 0.5317 997.307  33.464  1019.95   47.032  974.093   47.624  31.847 0.7384 31.117 0.7652 0.7305508      1.063401  
1 1 1 2  5  15 o 23.997 0.4686 577.744  21.942  569.437   28.008  590.942   35.304  23.793 0.5886 24.201 0.7294 -0.4074783     0.9372345 
1 1 1 2  5  16 o 14.817 0.4138 220.863  12.245  214.791   16.792  227.760   17.896  14.602 0.5750 15.032 0.5953 -0.4303827     0.8276205 
1 1 1 2  5  17 o 12.883 0.4653 168.684  11.649  170.093   14.857  166.434   18.770  12.974 0.5726 12.792 0.7337 0.1826935      0.9306429 
1 1 1 2  5  18 o 14.424 0.4260 212.221  12.199  224.941   16.626  197.387   17.955  14.909 0.5576 13.939 0.6441 0.9704895      0.8519012 
1 1 1 2  5  19 o 2.7029 0.6897 6.2653   5.1868  10.209    6.2301  -2.6417   9.3630  3.1120 0.9297 2.2937 1.0191 0.8182578      1.379449  
1 1 1 2  5  20 o 8.6772 0.4824 76.108   8.1624  72.901    10.352  81.377    13.270  8.4582 0.6120 8.8962 0.7458 -0.4380026     0.9647697 
1 1 1 2  5  21 o 13.839 0.3844 194.737  10.630  202.427   14.923  186.816   15.145  14.123 0.5283 13.556 0.5586 0.5671949      0.7688772 
1 1 1 2  5  22 o 3.5326 0.7467 13.368   5.5896  12.633    7.1798  14.498    8.9060  3.4143 0.9923 3.6508 1.1162 -0.2364645     1.493498  
1 1 1 2  5  23 o 1.8669 0.5894 -2.4651  4.5526  0.2854    5.7361  -7.1469   7.4836  1.9568 0.8337 1.7770 0.8334 0.1798648      1.178861  
1 1 1 2  5  24 o 8.5563 0.4851 75.792   8.2302  81.343    11.229  69.349    12.098  8.9155 0.6298 8.1972 0.7379 0.7183275      0.9701158 
1 1 1 2  5  25 o 7.9853 0.5044 64.654   8.0053  56.240    10.726  75.237    12.028  7.4022 0.7245 8.5684 0.7019 -1.166162      1.008741  
1 1 1 2  5  26 o 14.371 0.4154 210.279  11.912  209.173   16.285  211.551   17.468  14.339 0.5679 14.403 0.6064 -0.6399536E-01 0.8307945 
1 1 1 2  5  27 o 3.8635 0.8050 14.528   6.7854  8.3088    8.5813  24.904    11.084  3.0075 1.0974 4.7196 1.1780 -1.712151      1.609911  
1 1 1 2  5  28 o 6.2088 0.7275 46.157   7.9886  57.340    10.202  28.430    12.845  7.4526 0.6844 4.9651 1.2839 2.487499       1.454984  
1 1 1 2  5  29 o 8.3162 0.6615 74.652   10.183  75.146    12.342  73.599    18.022  8.4755 0.7281 8.1569 1.1047 0.3185387      1.323071  
1 1 1 2  5  30 o 3.4481 0.8694 13.596   7.5892  15.741    9.2985  9.3175    13.134  3.6575 1.1443 3.2387 1.3094 0.4187431      1.738899  
1 1 1 2  5  31 o 2.8712 0.8137 6.9395   7.7133  12.524    9.2584  -5.7289   13.945  3.2595 1.1457 2.4828 1.1557 0.7766726      1.627358  
1 1 1 2  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  5  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  6  0  o 8.7360 0.7149 79.860   11.940  70.304    16.846  89.509    16.927  8.1610 1.0858 9.3109 0.9303 -0.000000      0.000000  
1 1 1 2  6  1  o 30.153 0.4993 912.361  30.108  915.030   42.544  909.683   42.615  30.197 0.7044 30.108 0.7077 0.8884239E-01  0.9985369 
1 1 1 2  6  2  o 7.2988 0.4882 53.415   7.1233  51.599    9.9041  55.361    10.253  7.1704 0.6906 7.4272 0.6902 -0.2567811     0.9763883 
1 1 1 2  6  3  o 2.0392 0.5697 1.8255   3.5773  4.2904    4.9164  -0.9478   5.2148  2.2867 0.8312 1.7916 0.7793 0.4951687      1.139393  
1 1 1 2  6  4  o 12.087 0.4620 146.553  11.168  144.557   15.726  148.586   15.864  12.004 0.6550 12.171 0.6517 -0.1663351     0.9240106 
1 1 1 2  6  5  o 30.660 0.5061 943.841  31.025  965.962   43.749  921.460   44.005  31.024 0.7051 30.297 0.7262 0.7263889      1.012203  
1 1 1 2  6  6  o 24.205 0.4837 588.223  23.414  593.941   32.912  582.364   33.317  24.325 0.6765 24.085 0.6917 0.2402782      0.9674870 
1 1 1 2  6  7  o 15.787 0.5433 246.956  14.935  243.305   17.235  257.960   29.925  15.576 0.5532 15.997 0.9353 -0.4207716     1.086685  
1 1 1 2  6  8  o 30.720 0.5893 947.911  31.627  947.784   36.691  948.278   62.387  30.750 0.5966 30.690 1.0164 0.6032372E-01  1.178572  
1 1 1 2  6  9  o 9.5266 0.6067 90.123   9.9205  89.087    11.377  93.412    20.267  9.4263 0.6035 9.6269 1.0526 -0.2006092     1.213306  
1 1 1 2  6  10 o 9.7205 0.6617 96.382   12.112  99.366    14.942  90.665    20.682  9.9520 0.7507 9.4891 1.0898 0.4628868      1.323327  
1 1 1 2  6  11 o 8.3828 0.5611 75.603   8.5115  84.775    10.460  57.631    14.642  9.1975 0.5687 7.5681 0.9674 1.629417       1.122121  
1 1 1 2  6  12 o 8.0246 0.6214 64.609   9.9518  59.090    13.709  70.758    14.470  7.6624 0.8946 8.3868 0.8627 -0.7243624     1.242738  
1 1 1 2  6  13 o 24.971 0.5101 626.322  25.468  604.802   35.542  649.035   36.514  24.530 0.7245 25.412 0.7184 -0.8822746     1.020285  
1 1 1 2  6  14 o 32.918 0.5388 1089.95  35.429  1015.08   49.363  1169.50   50.880  31.749 0.7774 34.088 0.7463 -2.338820      1.077646  
1 1 1 2  6  15 o 15.974 0.6869 271.467  20.240  226.622   34.588  294.820   24.960  14.864 1.1635 17.084 0.7305 -2.219968      1.373821  
1 1 1 2  6  16 o 6.3722 0.7421 41.569   9.3946  39.432    12.462  44.381    14.298  6.1916 1.0064 6.5528 1.0910 -0.3611689     1.484264  
1 1 1 2  6  17 o 7.0903 0.7227 51.689   10.207  50.737    13.772  52.848    15.202  7.0264 0.9800 7.1542 1.0625 -0.1278076     1.445444  
1 1 1 2  6  18 o 18.985 0.5321 370.443  20.044  414.805   27.997  323.800   28.708  20.188 0.6934 17.781 0.8072 2.406591       1.064171  
1 1 1 2  6  19 o 9.8300 0.4808 98.600   9.4094  98.886    12.726  98.255    13.975  9.8552 0.6457 9.8047 0.7127 0.5055046E-01  0.9616482 
1 1 1 2  6  20 o 12.860 0.4872 168.879  12.501  185.235   18.328  154.650   17.095  13.443 0.6817 12.276 0.6963 1.166280       0.9744380 
1 1 1 2  6  21 o 8.2682 0.5360 69.766   8.7507  65.576    11.366  75.865    13.712  7.9826 0.7119 8.5538 0.8015 -0.5711436     1.072046  
1 1 1 2  6  22 o 6.8627 0.6361 48.138   8.1022  46.139    9.7084  52.725    14.706  6.6888 0.7257 7.0366 1.0450 -0.3478470     1.272262  
1 1 1 2  6  23 o 2.9796 0.7255 8.7758   5.2435  9.7557    6.9483  7.4795    7.9917  3.0699 0.9926 2.8894 1.0583 0.1805847      1.450902  
1 1 1 2  6  24 f 6.7895 0.5344 47.715   7.2234  48.867    9.8376  46.368    10.641  6.8902 0.7139 6.6887 0.7954 0.2014756      1.068785  
1 1 1 2  6  25 o 3.4246 0.7502 12.540   5.6208  13.180    7.2269  11.560    8.9421  3.4917 0.9896 3.3575 1.1278 0.1341970      1.500414  
1 1 1 2  6  26 o 7.1959 0.5824 54.392   8.2648  59.855    11.217  47.904    12.224  7.6226 0.7358 6.7693 0.9029 0.8533001      1.164753  
1 1 1 2  6  27 o 8.0762 0.5551 69.276   8.7228  77.411    11.576  58.588    13.268  8.6791 0.6669 7.4733 0.8877 1.205789       1.110291  
1 1 1 2  6  28 o 10.827 0.4798 121.123  10.322  121.750   13.861  120.342   15.465  10.878 0.6371 10.775 0.7177 0.1036263      0.9596523 
1 1 1 2  6  29 o 6.0318 0.7140 40.240   8.1933  39.728    10.495  41.040    13.110  6.0887 0.8619 5.9748 1.1387 0.1139126      1.428100  
1 1 1 2  6  30 o 5.8846 0.7885 41.611   8.7096  45.808    11.155  35.056    13.940  6.4795 0.8608 5.2896 1.3215 1.189902       1.577093  
1 1 1 2  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  7  0  o 29.028 0.7075 848.749  40.958  829.960   57.555  868.027   58.299  28.700 1.0055 29.356 0.9956 -0.000000      0.000000  
1 1 1 2  7  1  o 33.900 0.5201 1153.93  35.260  1155.77   49.877  1152.09   49.854  33.927 0.7351 33.873 0.7359 0.5412674E-01  1.040129  
1 1 1 2  7  2  o 45.986 0.5861 2125.38  53.904  2147.34   76.284  2103.49   76.179  46.225 0.8251 45.748 0.8326 0.4764366      1.172207  
1 1 1 2  7  3  o 8.6771 0.4936 75.593   8.5616  77.869    12.049  73.273    12.167  8.8097 0.6839 8.5446 0.7120 0.2651014      0.9872305 
1 1 1 2  7  4  o 29.645 0.5034 882.231  29.844  888.667   42.109  875.735   42.303  29.754 0.7076 29.536 0.7161 0.2186394      1.006765  
1 1 1 2  7  5  o 3.9712 0.6781 16.532   5.3242  16.848    7.4200  16.198    7.6441  4.0102 0.9413 3.9323 0.9764 0.7793236E-01  1.356267  
1 1 1 2  7  6  o 10.093 0.4833 102.198  9.7305  92.520    13.529  112.570   14.006  9.5969 0.7048 10.589 0.6613 -0.9917917     0.9665338 
1 1 1 2  7  7  o 33.972 0.6011 1149.66  35.771  1138.80   41.465  1181.27   70.728  33.701 0.6152 34.242 1.0328 -0.5404968     1.202104  
1 1 1 2  7  8  o 11.541 0.5952 136.143  11.710  138.317   13.480  129.455   23.641  11.747 0.5738 11.334 1.0429 0.4130049      1.190324  
1 1 1 2  7  9  o 10.760 0.5872 112.623  10.925  109.189   12.517  123.606   22.385  10.438 0.5996 11.083 1.0099 -0.6450338     1.174478  
1 1 1 2  7  10 o 33.381 0.6068 1117.89  35.412  1116.37   41.085  1122.27   69.842  33.374 0.6155 33.389 1.0459 -0.1558304E-01 1.213567  
1 1 1 2  7  11 o 8.6937 0.7075 83.238   9.8064  88.865    11.170  64.312    20.483  9.4150 0.5932 7.9725 1.2846 1.442470       1.414961  
1 1 1 2  7  12 o 22.603 0.5098 513.170  23.044  501.395   32.320  525.347   32.866  22.339 0.7234 22.867 0.7186 -0.5280685     1.019673  
1 1 1 2  7  13 o 32.882 0.5386 1086.76  35.397  1029.91   49.387  1146.81   50.758  31.996 0.7718 33.768 0.7516 -1.772348      1.077257  
1 1 1 2  7  14 o 6.5125 0.7313 42.952   9.4967  41.151    12.851  45.119    14.095  6.3651 1.0095 6.6599 1.0582 -0.2947464     1.462523  
1 1 1 2  7  15 o 4.4915 0.9205 21.249   9.0634  28.088    12.539  13.768    13.115  5.1229 1.2377 3.8602 1.3630 1.262689       1.841086  
1 1 1 2  7  16 o 13.994 0.7018 202.891  18.392  200.476   32.065  204.075   22.452  13.852 1.1574 14.137 0.7941 -0.2853708     1.403651  
1 1 1 2  7  17 o 16.450 0.5447 276.109  17.909  272.136   24.795  280.442   25.896  16.332 0.7591 16.569 0.7814 -0.2375317     1.089450  
1 1 1 2  7  18 o 15.955 0.5681 265.282  17.835  307.398   24.674  219.203   25.809  17.347 0.7112 14.564 0.8860 2.782899       1.136167  
1 1 1 2  7  19 o 4.8859 0.9554 26.986   10.500  39.141    14.204  12.340    15.592  5.9624 1.2319 3.8094 1.4606 2.152961       1.910754  
1 1 1 2  7  20 o 8.7859 0.5259 79.828   9.2014  83.834    12.667  75.352    13.389  9.0346 0.7010 8.5372 0.7842 0.4974251      1.051819  
1 1 1 2  7  21 o 5.4295 0.7393 33.252   7.5646  37.527    9.7184  26.679    12.050  6.0065 0.8090 4.8525 1.2377 1.154036       1.478610  
1 1 1 2  7  22 o 16.971 0.4557 294.748  15.426  295.230   21.065  294.190   22.653  17.001 0.6195 16.941 0.6686 0.5923653E-01  0.9114771 
1 1 1 2  7  23 o 11.052 0.5231 125.046  11.445  120.853   15.041  130.811   17.637  10.853 0.6930 11.251 0.7838 -0.3983850     1.046216  
1 1 1 2  7  24 o 6.5909 0.7231 47.792   8.4708  50.244    10.305  42.684    14.875  6.9881 0.7373 6.1938 1.2440 0.7942586      1.446102  
1 1 1 2  7  25 o 4.5167 0.6797 21.192   6.3033  9.7500    8.4159  35.811    9.5131  3.1478 1.0932 5.8856 0.8082 -2.737794      1.359459  
1 1 1 2  7  26 o 2.3295 0.6957 -0.0648  4.9793  -2.0309   5.7842  5.5620    9.7851  1.7844 0.7964 2.8746 1.1409 -1.090203      1.391395  
1 1 1 2  7  27 o 11.470 0.4668 134.854  10.692  126.631   14.652  144.221   15.638  11.097 0.6602 11.843 0.6602 -0.7456665     0.9336783 
1 1 1 2  7  28 o 6.2410 0.6453 40.483   7.9670  34.362    10.438  49.027    12.332  5.6858 0.9179 6.7962 0.9072 -1.110400      1.290593  
1 1 1 2  7  29 o 3.4310 0.7607 8.2228   6.6367  -1.7105   8.2162  26.871    11.258  2.1235 0.9483 4.7384 1.1897 -2.614848      1.521392  
1 1 1 2  7  30 o 2.7217 0.7798 4.6397   7.1893  10.591    9.0147  -5.7590   11.917  3.1146 1.1265 2.3288 1.0786 0.7857828      1.559614  
1 1 1 2  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  8  0  o 13.637 0.6739 189.279  18.172  187.139   25.569  191.464   25.832  13.558 0.9538 13.716 0.9522 -0.000000      0.000000  
1 1 1 2  8  1  o 22.222 0.4778 495.502  21.233  500.464   30.053  490.557   30.002  22.333 0.6728 22.110 0.6785 0.2227802      0.9555138 
1 1 1 2  8  2  o 17.864 0.4728 320.264  16.885  332.285   23.929  308.342   23.830  18.198 0.6574 17.529 0.6797 0.6699047      0.9456642 
1 1 1 2  8  3  o 2.8777 0.6280 6.3054   4.8189  15.128    6.7930  -2.6316   6.8371  3.8012 0.9063 1.9542 0.8694 1.847055       1.255915  
1 1 1 2  8  4  o 30.690 0.5109 946.221  31.358  954.913   44.269  937.468   44.424  30.832 0.7179 30.547 0.7271 0.2847099      1.021822  
1 1 1 2  8  5  o 10.367 0.4944 107.977  10.249  109.771   14.434  106.153   14.555  10.455 0.6903 10.280 0.7079 0.1748753      0.9887573 
1 1 1 2  8  6  o 15.914 0.4408 254.089  13.788  254.808   17.924  253.046   21.579  15.946 0.5620 15.883 0.6793 0.6307220E-01  0.8816936 
1 1 1 2  8  7  o 12.627 0.5645 157.985  12.628  155.540   14.710  164.839   24.627  12.456 0.5905 12.797 0.9622 -0.3409472     1.128913  
1 1 1 2  8  8  o 19.840 0.5705 399.491  19.674  403.944   22.828  386.635   38.786  20.078 0.5685 19.602 0.9894 0.4758797      1.141063  
1 1 1 2  8  9  o 27.730 0.5741 758.636  27.990  744.495   32.436  799.866   55.385  27.257 0.5950 28.203 0.9819 -0.9456635     1.148110  
1 1 1 2  8  10 o 3.1117 0.8447 6.8465   6.0761  7.2855    6.6745  4.7226    14.681  2.8265 0.9740 3.3969 1.3804 -0.5703850     1.689421  
1 1 1 2  8  11 o 16.361 0.5846 272.400  16.477  275.572   19.039  262.936   32.883  16.577 0.5742 16.145 1.0184 0.4321690      1.169100  
1 1 1 2  8  12 o 14.534 0.4871 216.794  13.488  228.720   16.967  196.314   22.234  15.100 0.5618 13.968 0.7959 1.132276       0.9742050 
1 1 1 2  8  13 o 7.6820 0.6728 59.524   10.322  57.810    14.153  61.472    15.088  7.5654 0.9354 7.7986 0.9673 -0.2332382     1.345601  
1 1 1 2  8  14 o 7.7142 0.6828 60.792   10.472  63.285    14.249  57.864    15.442  7.8953 0.9024 7.5331 1.0249 0.3621130      1.365565  
1 1 1 2  8  15 o 5.5519 0.9903 33.689   10.963  32.105    16.462  34.952    14.697  5.4240 1.4774 5.6798 1.3191 -0.2558231     1.980582  
1 1 1 2  8  16 o 11.509 0.5999 135.058  13.797  129.737   19.033  140.950   20.028  11.272 0.8443 11.746 0.8525 -0.4746027     1.199852  
1 1 1 2  8  17 o 5.6422 1.0104 36.955   11.211  41.071    13.759  28.821    19.341  6.1675 1.1579 5.1168 1.6562 1.050729       2.020820  
1 1 1 2  8  18 o 2.5840 0.8264 -5.2808  9.0487  -2.7266   11.599  -9.2521   14.463  2.5664 1.1376 2.6017 1.1991 -0.3530502E-01 1.652827  
1 1 1 2  8  19 f 13.046 0.6043 177.463  15.650  198.172   21.897  155.835   22.376  13.862 0.7898 12.229 0.9149 1.632825       1.208614  
1 1 1 2  8  20 o 2.8016 0.8698 -4.2150  9.7986  -13.4775  13.640  5.6610    14.085  2.3452 1.1077 3.2580 1.3412 -0.9128308     1.739505  
1 1 1 2  8  21 o 11.527 0.6681 139.976  15.349  141.558   20.951  138.143   22.551  11.623 0.9013 11.431 0.9864 0.1925564      1.336166  
1 1 1 2  8  22 o 17.739 0.4683 322.540  16.584  338.672   23.186  305.643   23.730  18.209 0.6366 17.269 0.6871 0.9404449      0.9366822 
1 1 1 2  8  23 o 10.246 0.5562 108.002  11.303  103.388   14.922  114.214   17.312  10.009 0.7454 10.484 0.8257 -0.4742413     1.112366  
1 1 1 2  8  24 o 6.5228 0.9770 48.826   10.589  50.195    12.000  44.009    22.509  6.9596 0.8621 6.0860 1.7535 0.8735304      1.953994  
1 1 1 2  8  25 o 3.4335 0.8929 10.547   7.3307  10.144    8.5036  11.713    14.465  3.1923 1.0994 3.6748 1.4073 -0.4825010     1.785835  
1 1 1 2  8  26 o 2.7792 0.8209 -1.7376  6.1941  -4.9965   6.8415  13.079    14.588  1.7823 0.8226 3.7761 1.4210 -1.993866      1.641895  
1 1 1 2  8  27 o 2.4700 0.7265 2.3558   5.9568  4.5064    7.6130  -1.0395   9.5657  2.5568 1.0090 2.3831 1.0456 0.1736774      1.453079  
1 1 1 2  8  28 o 12.218 0.4651 154.191  11.351  144.181   15.710  165.124   16.419  11.799 0.6658 12.637 0.6496 -0.8382864     0.9302098 
1 1 1 2  8  29 o 11.610 0.4957 141.960  11.497  137.504   15.789  146.990   16.774  11.425 0.6910 11.795 0.7111 -0.3699236     0.9914813 
1 1 1 2  8  30 o 3.8407 0.8538 18.303   7.2491  19.046    9.1684  17.065    11.840  3.9647 1.1115 3.7167 1.2963 0.2479720      1.707535  
1 1 1 2  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  8  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  9  0  o 1.4260 0.6858 -5.1492  5.9498  -7.7846   8.1928  -2.2082   8.6548  1.2752 0.8889 1.5769 1.0445 -0.000000      0.000000  
1 1 1 2  9  1  f 36.737 0.5403 1356.54  39.696  1383.88   56.272  1329.46   56.006  37.107 0.7583 36.367 0.7700 0.7397575      1.080678  
1 1 1 2  9  2  o 13.628 0.4825 186.577  13.125  171.386   18.421  202.238   18.704  13.062 0.7051 14.193 0.6589 -1.131064      0.9650648 
1 1 1 2  9  3  o 11.399 0.4880 130.484  11.124  130.153   15.705  130.816   15.759  11.384 0.6898 11.413 0.6904 -0.2892590E-01 0.9759258 
1 1 1 2  9  4  o 26.943 0.5000 728.785  26.942  739.034   38.050  718.479   38.155  27.134 0.7011 26.752 0.7131 0.3817329      1.000066  
1 1 1 2  9  5  o 6.4698 0.5836 42.088   7.4504  33.498    10.291  51.551    10.801  5.7729 0.8913 7.1667 0.7535 -1.393881      1.167140  
1 1 1 2  9  6  o 13.955 0.5874 199.638  14.129  203.666   16.367  187.859   27.990  14.254 0.5741 13.655 1.0249 0.5993700      1.174744  
1 1 1 2  9  7  o 19.044 0.5568 359.865  18.610  355.372   21.577  372.913   36.771  18.832 0.5729 19.255 0.9548 -0.4236126     1.113510  
1 1 1 2  9  8  o 35.404 0.6133 1247.03  38.184  1234.18   44.344  1283.87   75.100  35.091 0.6319 35.718 1.0513 -0.6270256     1.226572  
1 1 1 2  9  9  o 7.0398 0.8314 52.546   10.814  56.991    13.663  45.092    17.693  7.5284 0.9074 6.5512 1.3932 0.9771461      1.662702  
1 1 1 2  9  10 o 31.326 0.5998 984.974  32.936  982.968   38.264  990.710   64.710  31.307 0.6111 31.345 1.0322 -0.3844833E-01 1.199553  
1 1 1 2  9  11 o 30.405 0.5939 922.377  31.811  913.237   36.989  948.344   62.346  30.166 0.6131 30.644 1.0173 -0.4780426     1.187743  
1 1 1 2  9  12 o 27.810 0.5913 778.040  28.814  777.027   33.476  780.936   56.606  27.823 0.6016 27.796 1.0182 0.2668571E-01  1.182658  
1 1 1 2  9  13 o 30.003 0.6878 914.710  37.983  916.188   45.603  911.362   68.632  30.131 0.7567 29.875 1.1487 0.2560329      1.375541  
1 1 1 2  9  14 o 9.5866 0.6505 93.490   12.426  93.798    16.885  93.127    18.352  9.6109 0.8785 9.5623 0.9596 0.4853344E-01  1.300983  
1 1 1 2  9  15 o 11.534 0.5993 135.944  13.806  126.384   19.091  146.423   19.988  11.106 0.8595 11.962 0.8355 -0.8560343     1.198624  
1 1 1 2  9  16 o 15.247 0.7088 242.735  20.214  232.674   35.019  247.762   24.755  14.916 1.1739 15.578 0.7946 -0.6620464     1.417506  
1 1 1 2  9  17 o 6.3441 0.8789 43.873   10.874  51.411    15.183  35.934    15.582  7.0098 1.0830 5.6784 1.3845 1.331431       1.757740  
1 1 1 2  9  18 o 6.7565 0.8930 50.102   11.620  47.802    16.379  52.433    16.489  6.5843 1.2899 6.9286 1.2352 -0.3442454     1.785958  
1 1 1 2  9  19 o 3.7385 1.1034 1.3957   12.246  -5.7088   14.078  23.484    24.823  2.6814 1.2156 4.7955 1.8419 -2.114061      2.206865  
1 1 1 2  9  20 o 9.6388 0.7422 99.683   14.151  107.445   19.221  90.498    20.910  10.104 0.9512 9.1737 1.1396 0.9300470      1.484449  
1 1 1 2  9  21 o 5.5019 1.0860 34.960   12.537  26.957    16.854  44.873    18.757  4.8293 1.5442 6.1745 1.5273 -1.345268      2.171975  
1 1 1 2  9  22 o 7.7002 1.0072 69.497   14.682  87.166    19.823  48.023    21.853  9.0531 1.0948 6.3473 1.6910 2.705829       2.014496  
1 1 1 2  9  23 o 10.886 0.7779 127.326  16.811  131.290   22.711  122.521   25.002  11.124 1.0208 10.648 1.1740 0.4761372      1.555733  
1 1 1 2  9  24 o 10.649 0.5789 116.365  12.272  102.767   16.592  132.789   18.235  9.9613 0.8328 11.336 0.8042 -1.375121      1.157744  
1 1 1 2  9  25 o 9.1938 0.6345 86.474   11.532  77.126    14.979  100.078   18.070  8.6073 0.8701 9.7803 0.9238 -1.172945      1.269044  
1 1 1 2  9  26 o 6.3916 0.8634 46.008   10.222  48.452    12.706  41.526    17.208  6.7939 0.9351 5.9894 1.4517 0.8045578      1.726785  
1 1 1 2  9  27 o 4.8325 0.9934 25.846   9.5898  23.075    11.511  32.130    17.336  4.4932 1.2403 5.1719 1.5521 -0.6787448     1.986792  
1 1 1 2  9  28 o 11.280 0.5920 133.523  12.821  130.189   15.971  139.566   21.501  11.170 0.7149 11.390 0.9439 -0.2201824     1.184080  
1 1 1 2  9  29 f 7.6426 0.6491 63.895   9.8585  55.304    13.714  73.083    14.182  7.0730 0.9694 8.2121 0.8635 -1.139132      1.298239  
1 1 1 2  9  30 o 2.4324 0.7502 1.5949   6.6736  1.9570    8.3456  0.9525    11.114  2.3314 0.9998 2.5333 1.1187 -0.2018447     1.500333  
1 1 1 2  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  9  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  10 0  o 16.976 0.6884 292.054  23.192  295.056   32.598  288.977   33.003  17.068 0.9619 16.884 0.9850 -0.000000      0.000000  
1 1 1 2  10 1  o 23.785 0.4905 567.740  23.326  547.389   32.868  588.390   33.109  23.355 0.7037 24.216 0.6836 -0.8613052     0.9810691 
1 1 1 2  10 2  o 7.2761 0.5774 54.200   8.2309  64.131    11.363  43.236    11.939  7.9948 0.7107 6.5574 0.9103 1.437359       1.154880  
1 1 1 2  10 3  o 14.672 0.4819 215.841  14.138  210.071   19.807  221.834   20.186  14.472 0.6843 14.872 0.6787 -0.4000101     0.9638036 
1 1 1 2  10 4  f 20.423 0.4847 418.533  19.794  422.540   27.842  414.439   28.145  20.522 0.6783 20.323 0.6924 0.1990566      0.9693252 
1 1 1 2  10 5  o 12.769 0.4944 163.568  12.623  162.667   17.627  164.517   18.085  12.733 0.6922 12.804 0.7062 -0.7135105E-01 0.9888372 
1 1 1 2  10 6  o 8.6391 0.6479 69.093   9.8148  63.428    11.217  87.606    20.276  7.9521 0.7053 9.3261 1.0870 -1.374078      1.295787  
1 1 1 2  10 7  f 16.464 0.5835 281.212  16.643  291.075   19.407  253.786   32.361  17.045 0.5693 15.882 1.0188 1.162298       1.167024  
1 1 1 2  10 8  o 13.605 0.5876 187.716  13.970  189.606   16.251  182.366   27.343  13.754 0.5908 13.457 1.0159 0.2961006      1.175217  
1 1 1 2  10 9  o 16.098 0.6120 260.611  18.770  260.550   23.246  260.727   31.815  16.109 0.7215 16.087 0.9889 0.2254105E-01  1.224099  
1 1 1 2  10 10 o 13.093 0.6274 170.753  15.255  167.587   18.350  177.836   27.449  12.915 0.7104 13.270 1.0343 -0.3544235     1.254756  
1 1 1 2  10 11 o 32.070 0.6049 1025.07  34.159  1013.03   39.689  1059.47   67.087  31.766 0.6247 32.375 1.0361 -0.6089668     1.209874  
1 1 1 2  10 12 f 8.4963 0.8390 86.116   10.626  95.226    12.145  56.387    21.939  9.7326 0.6240 7.2601 1.5576 2.472499       1.677912  
1 1 1 2  10 13 o 25.262 0.4874 648.568  23.878  663.650   30.474  624.582   38.431  25.674 0.5935 24.849 0.7733 0.8255730      0.9747790 
1 1 1 2  10 14 o 13.972 0.5693 199.780  15.818  213.367   21.770  184.587   23.021  14.494 0.7510 13.451 0.8558 1.043768       1.138561  
1 1 1 2  10 15 o 10.974 0.6154 122.870  13.493  116.332   18.646  130.058   19.551  10.667 0.8740 11.281 0.8666 -0.6138573     1.230762  
1 1 1 2  10 16 o 6.9516 0.8675 52.720   11.573  59.845    15.710  44.264    17.115  7.5842 1.0357 6.3190 1.3919 1.265204       1.734913  
1 1 1 2  10 17 o 14.339 0.5857 212.467  16.742  222.044   23.146  201.958   24.245  14.699 0.7873 13.979 0.8672 0.7206936      1.171320  
1 1 1 2  10 18 f 4.3228 0.9958 19.407   10.834  30.423    14.669  6.1860    16.070  5.1867 1.3871 3.4588 1.4291 1.727897       1.991584  
1 1 1 2  10 19 o 5.8342 0.9377 39.827   11.790  61.042    16.201  15.939    17.191  7.5827 1.0683 4.0857 1.5415 3.496992       1.875485  
1 1 1 2  10 20 o 7.9480 0.8819 70.147   13.585  75.850    18.730  63.815    19.734  8.4004 1.1148 7.4956 1.3667 0.9047771      1.763752  
1 1 1 2  10 21 o 7.2842 1.0031 62.013   14.197  89.232    20.047  34.630    20.108  9.1521 1.0952 5.4163 1.6808 3.735770       2.006121  
1 1 1 2  10 22 o 5.8119 1.1723 40.541   14.416  45.256    19.352  34.662    21.610  6.2144 1.5595 5.4094 1.7506 0.8049998      2.344500  
1 1 1 2  10 23 o 10.530 0.8470 118.004  17.634  95.968    23.761  145.020   26.310  9.4059 1.2631 11.655 1.1287 -2.248627      1.693941  
1 1 1 2  10 24 o 9.3492 0.9910 99.814   17.376  114.929   23.176  80.412    26.257  10.390 1.1153 8.3083 1.6384 2.081684       1.981974  
1 1 1 2  10 25 o 7.8002 1.0913 70.220   16.527  72.884    21.995  66.765    25.046  8.1325 1.3523 7.4680 1.7133 0.6645479      2.182667  
1 1 1 2  10 26 o 14.444 0.5479 216.161  15.803  208.004   21.632  225.496   23.142  14.160 0.7638 14.728 0.7856 -0.5680647     1.095745  
1 1 1 2  10 27 o 8.7829 0.7338 83.048   12.662  82.792    16.471  83.417    19.798  8.8269 0.9330 8.7389 1.1327 0.8791161E-01  1.467526  
1 1 1 2  10 28 o 3.4726 0.8596 13.825   7.8904  18.510    9.0036  -1.6855   16.382  3.9975 1.0942 2.9477 1.3260 1.049854       1.719183  
1 1 1 2  10 29 o 3.8007 0.9786 17.790   9.8006  21.269    11.479  8.4325    18.827  4.1472 1.2671 3.4541 1.4916 0.6931350      1.957137  
1 1 1 2  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  10 35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  11 0  o 22.528 0.7010 512.209  31.442  512.329   44.083  512.085   44.857  22.532 0.9825 22.523 1.0003 -0.000000      0.000000  
1 1 1 2  11 1  o 39.049 0.5577 1531.63  43.557  1520.64   61.479  1542.71   61.721  38.908 0.7900 39.190 0.7875 -0.2818260     1.115461  
1 1 1 2  11 2  o 12.914 0.4965 167.300  12.820  161.088   17.973  173.735   18.292  12.670 0.7093 13.158 0.6951 -0.4888716     0.9930928 
1 1 1 2  11 3  o 20.962 0.4887 440.802  20.487  443.340   28.925  438.246   29.022  21.023 0.6879 20.901 0.6943 0.1217117      0.9773861 
1 1 1 2  11 4  o 29.285 0.5132 860.425  30.058  860.420   42.342  860.430   42.677  29.286 0.7229 29.285 0.7287 0.5664825E-03  1.026423  
1 1 1 2  11 5  o 10.529 0.4822 110.807  10.045  108.874   13.219  113.449   15.454  10.422 0.6342 10.635 0.7265 -0.2129068     0.9643842 
1 1 1 2  11 6  o 29.214 0.6006 867.156  30.639  877.819   35.648  837.010   59.938  29.594 0.6023 28.834 1.0394 0.7605877      1.201256  
1 1 1 2  11 7  o 29.990 0.6051 916.283  31.770  930.023   37.043  878.071   61.777  30.458 0.6081 29.522 1.0463 0.9360867      1.210185  
1 1 1 2  11 8  o 11.730 0.6095 136.805  12.732  134.939   14.881  141.900   24.593  11.598 0.6416 11.862 1.0366 -0.2645245     1.219095  
1 1 1 2  11 9  o 13.173 0.6048 178.354  13.908  182.388   16.227  167.186   26.997  13.482 0.6018 12.864 1.0493 0.6180267      1.209618  
1 1 1 2  11 10 o 4.8382 0.9268 26.022   8.4339  28.456    9.5493  17.390    17.982  5.2322 0.9474 4.4442 1.5931 0.7880259      1.853534  
1 1 1 2  11 11 o 16.001 0.6133 264.762  17.017  271.579   19.807  245.550   33.252  16.443 0.6023 15.560 1.0685 0.8826885      1.226569  
1 1 1 2  11 12 o 26.656 0.6072 731.450  28.237  743.676   32.896  697.229   55.036  27.177 0.6052 26.135 1.0529 1.042118       1.214459  
1 1 1 2  11 13 o 4.3172 0.9054 21.941   8.5958  27.132    9.6320  1.6355    19.051  5.0691 0.9856 3.5652 1.5192 1.503852       1.810898  
1 1 1 2  11 14 o 7.9201 0.6916 68.877   9.7025  75.144    11.675  54.885    17.444  8.6034 0.6785 7.2368 1.2052 1.366544       1.383110  
1 1 1 2  11 15 o 9.5871 0.6950 95.238   13.269  95.976    18.008  94.361    19.628  9.6438 0.9337 9.5304 1.0298 0.1133776      1.390002  
1 1 1 2  11 16 o 5.0107 1.0632 25.921   12.404  43.167    18.379  11.495    16.810  6.1763 1.5023 3.8451 1.5049 2.331229       2.126420  
1 1 1 2  11 17 o 1.9130 0.6709 -29.7438 9.3713  -33.3054  12.354  -24.9178  14.381  1.7085 0.8553 2.1174 1.0339 -0.4089681     1.341810  
1 1 1 2  11 18 o 13.693 0.6276 195.673  17.174  199.714   23.977  191.416   24.612  13.852 0.8654 13.534 0.9093 0.3183136      1.255286  
1 1 1 2  11 19 o 10.878 0.7276 127.625  15.386  157.996   21.557  96.089    21.967  12.307 0.8758 9.4500 1.1623 2.856930       1.455294  
1 1 1 2  11 20 o 4.0961 1.0962 16.266   12.360  18.599    17.314  13.840    17.651  4.2390 1.5569 3.9532 1.5436 0.2858329      2.192387  
1 1 1 2  11 21 o 4.5582 1.1188 19.344   13.515  4.5469    18.365  36.822    19.960  3.5285 1.4972 5.5880 1.6628 -2.059518      2.237550  
1 1 1 2  11 22 f 4.8479 1.2059 26.628   14.439  26.329    19.244  27.012    21.840  4.8062 1.6539 4.8895 1.7554 -0.8333158E-01 2.411818  
1 1 1 2  11 23 o 8.1921 1.0640 77.390   16.670  97.026    23.119  56.121    24.060  9.5127 1.2152 6.8715 1.7469 2.641172       2.127971  
1 1 1 2  11 24 o 7.7303 1.1172 68.045   17.246  36.930    23.207  106.425   25.774  5.5745 1.8148 9.8860 1.3036 -4.311470      2.234472  
1 1 1 2  11 25 o 8.3498 1.1025 79.682   17.615  80.754    22.814  78.100    27.718  8.6023 1.3261 8.0972 1.7617 0.5050478      2.204965  
1 1 1 2  11 26 o 11.912 0.8773 155.297  20.584  149.911   26.734  163.139   32.259  11.748 1.1378 12.075 1.3357 -0.3275394     1.754654  
1 1 1 2  11 27 f 6.5024 1.0966 57.443   18.394  93.570    23.560  1.0584    29.434  9.0852 1.2966 3.9196 1.7690 5.165589       2.193286  
1 1 1 2  11 28 o 2.8519 0.8597 4.0686   8.5120  6.8725    10.316  -1.9124   15.067  2.9043 1.1652 2.7994 1.2643 0.1048098      1.719373  
1 1 1 2  11 29 o 4.0892 1.0517 18.991   10.687  12.473    13.002  32.565    18.762  3.3974 1.3253 4.7809 1.6335 -1.383505      2.103471  
1 1 1 2  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  11 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  12 0  o 42.145 0.8172 1787.21  68.758  1794.73   96.606  1779.48   97.884  42.237 1.1455 42.052 1.1659 -0.000000      0.000000  
1 1 1 2  12 1  o 13.292 0.5066 177.233  13.465  180.117   18.990  174.317   19.094  13.401 0.7085 13.183 0.7242 0.2184124      1.013146  
1 1 1 2  12 2  o 13.748 0.4988 189.537  13.711  183.370   19.300  195.821   19.481  13.522 0.7137 13.974 0.6971 -0.4524403     0.9976078 
1 1 1 2  12 3  o 11.730 0.5077 138.020  11.908  140.941   16.842  135.099   16.840  11.854 0.7104 11.605 0.7255 0.2490053      1.015365  
1 1 1 2  12 4  o 21.876 0.5987 477.204  24.903  492.080   42.695  469.534   30.658  22.118 0.9652 21.635 0.7086 0.4835358      1.197323  
1 1 1 2  12 5  o 22.099 0.5687 480.481  22.205  469.510   25.778  512.036   43.717  21.642 0.5956 22.556 0.9691 -0.9143124     1.137443  
1 1 1 2  12 6  o 7.8056 0.7262 61.160   11.337  61.160    11.337  0.0000    0.0000  7.8056 0.7262 ?      ?      ?              ?         
1 1 1 2  12 7  o 26.282 0.5898 693.054  27.248  691.141   31.696  698.468   53.339  26.249 0.6038 26.315 1.0135 -0.6540489E-01 1.179693  
1 1 1 2  12 8  o 9.9627 0.7354 103.365  13.955  112.151   17.725  89.041    22.632  10.555 0.8397 9.3709 1.2076 1.183612       1.470805  
1 1 1 2  12 9  o 8.7022 0.6958 75.142   10.846  73.534    12.702  79.470    20.839  8.5514 0.7427 8.8530 1.1769 -0.3015385     1.391679  
1 1 1 2  12 10 o 23.389 0.6072 567.373  24.657  584.174   28.749  520.634   47.952  24.117 0.5960 22.662 1.0580 1.455400       1.214357  
1 1 1 2  12 11 o 21.026 0.6037 447.042  22.091  446.077   25.576  449.879   43.833  21.050 0.6075 21.003 1.0435 0.4701424E-01  1.207465  
1 1 1 2  12 12 o 3.6139 0.9891 7.9058   7.9351  6.6286    8.6617  14.575    19.792  2.9191 1.0956 4.3088 1.6471 -1.389707      1.978259  
1 1 1 2  12 13 o 5.4101 0.9935 26.183   9.3327  20.946    10.472  46.401    20.575  4.3988 1.1700 6.4214 1.6061 -2.022636      1.987091  
1 1 1 2  12 14 o 13.831 0.6439 193.826  15.407  191.467   17.754  201.022   31.004  13.749 0.6457 13.913 1.1142 -0.1643686     1.287777  
1 1 1 2  12 15 o 11.488 0.6018 141.440  12.651  152.346   15.472  119.439   21.975  12.253 0.6314 10.723 1.0247 1.530306       1.203619  
1 1 1 2  12 16 o 5.0611 1.0615 29.198   11.654  33.454    15.327  23.364    17.944  5.4548 1.3984 4.6673 1.5975 0.7874994      2.123055  
1 1 1 2  12 17 f 3.3288 1.0619 -6.6083  13.648  3.5061    24.987  -10.9087  16.293  3.9388 1.7096 2.7188 1.2599 1.219959       2.123718  
1 1 1 2  12 18 o 6.5155 0.9440 51.422   12.895  82.830    17.707  15.950    18.817  8.8682 0.9983 4.1627 1.6025 4.705476       1.888002  
1 1 1 2  12 19 o 7.8108 0.9897 74.399   14.368  104.388   19.562  39.278    21.170  9.9322 0.9848 5.6894 1.7169 4.242752       1.979303  
1 1 1 2  12 20 o 4.3217 1.1009 16.834   12.765  5.6426    17.051  31.105    19.254  3.4784 1.4574 5.1650 1.6504 -1.686632      2.201808  
1 1 1 2  12 21 o 5.3312 1.1153 28.793   14.330  7.8544    18.988  56.502    21.843  3.7269 1.5478 6.9354 1.6063 -3.208504      2.230649  
1 1 1 2  12 22 o 7.1838 1.1256 59.814   15.764  49.240    21.260  72.727    23.495  6.4346 1.6455 7.9330 1.5363 -1.498443      2.251245  
1 1 1 2  12 23 o 9.7734 0.9091 103.762  17.709  103.258   24.079  104.356   26.137  9.7801 1.2310 9.7668 1.3381 0.1324654E-01  1.818194  
1 1 1 2  12 24 o 6.6393 1.1904 54.851   16.722  72.949    22.496  32.502    24.998  7.9941 1.4609 5.2845 1.8800 2.709630       2.380883  
1 1 1 2  12 25 f 13.889 0.8133 211.125  22.129  228.927   29.457  188.067   33.525  14.694 1.0024 13.084 1.2811 1.609399       1.626667  
1 1 1 2  12 26 o 4.1122 1.2215 12.147   16.452  13.077    20.256  10.344    28.198  3.9875 1.6211 4.2370 1.8276 -0.2494287     2.442933  
1 1 1 2  12 27 f 6.0573 1.3408 50.768   18.139  54.080    23.396  45.778    28.719  6.4113 1.7676 5.7034 2.0166 0.7078881      2.681584  
1 1 1 2  12 28 o 5.3581 1.3800 42.395   18.832  35.584    24.163  52.934    30.057  4.9766 1.8374 5.7395 2.0594 -0.7628980     2.759912  
1 1 1 2  12 29 o 5.2131 1.0486 45.960   14.487  58.019    16.317  1.0757    31.480  6.8357 1.2392 3.5905 1.6920 3.245140       2.097204  
1 1 1 2  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  12 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  13 0  o 3.0551 1.0117 9.7475   9.0860  24.795    12.820  -5.4395   12.879  4.2777 1.6046 1.8324 1.2325 -0.000000      0.000000  
1 1 1 2  13 1  o 34.017 0.5370 1161.61  36.528  1140.44   51.543  1182.96   51.774  33.704 0.7646 34.329 0.7541 -0.6244621     1.073921  
1 1 1 2  13 2  o 17.249 0.5015 298.709  17.287  312.526   24.443  284.884   24.451  17.650 0.6925 16.848 0.7256 0.8012924      1.003000  
1 1 1 2  13 3  o 23.237 0.5038 541.922  23.411  549.021   33.050  534.773   33.165  23.391 0.7065 23.084 0.7184 0.3068638      1.007556  
1 1 1 2  13 4  o 25.439 0.5066 649.609  25.771  636.342   36.347  663.021   36.545  25.177 0.7218 25.701 0.7110 -0.5238419     1.013152  
1 1 1 2  13 5  o 21.055 0.5726 437.362  21.396  427.907   24.911  463.953   41.778  20.655 0.6030 21.456 0.9736 -0.8007717     1.145223  
1 1 1 2  13 6  o 12.210 0.5888 141.150  13.027  130.279   15.198  171.253   25.290  11.391 0.6671 13.030 0.9704 -1.639439      1.177612  
1 1 1 2  13 7  o 13.478 0.6065 175.928  14.604  167.876   16.985  198.768   28.606  12.929 0.6568 14.027 1.0197 -1.097775      1.212906  
1 1 1 2  13 8  o 22.252 0.5893 489.871  23.097  480.334   26.792  517.464   45.573  21.874 0.6124 22.630 1.0069 -0.7557106     1.178533  
1 1 1 2  13 9  o 20.642 0.6030 434.121  21.826  438.451   25.444  422.058   42.464  20.887 0.6091 20.397 1.0410 0.4907265      1.206051  
1 1 1 2  13 10 o 5.0295 0.8667 32.787   8.9853  41.225    10.204  3.6602    18.958  6.3832 0.7993 3.6759 1.5382 2.707331       1.733491  
1 1 1 2  13 11 o 18.230 0.6084 326.195  19.468  314.447   22.466  361.617   39.009  17.657 0.6362 18.803 1.0373 -1.145987      1.216841  
1 1 1 2  13 12 o 12.476 0.7174 165.478  14.867  169.518   16.997  152.323   30.672  12.928 0.6574 12.024 1.2754 0.9039431      1.434830  
1 1 1 2  13 13 o 10.070 0.7591 99.894   12.730  96.099    14.341  113.990   27.640  9.7264 0.7372 10.413 1.3272 -0.6867218     1.518176  
1 1 1 2  13 14 f 7.5307 0.9792 68.424   11.511  73.695    13.059  50.067    24.373  8.4912 0.7690 6.5702 1.8011 1.921000       1.958417  
1 1 1 2  13 15 o 10.329 0.6288 108.606  12.157  105.269   14.704  115.815   21.611  10.141 0.7249 10.516 1.0275 -0.3746185     1.257505  
1 1 1 2  13 16 o 7.2093 0.8911 66.608   10.515  78.820    12.487  36.825    19.500  8.7766 0.7114 5.6420 1.6340 3.134591       1.782129  
1 1 1 2  13 17 o 8.8448 0.8824 88.043   14.625  106.221   19.948  66.915    21.506  10.037 0.9938 7.6531 1.4583 2.383390       1.764719  
1 1 1 2  13 18 o 9.7966 0.7974 104.521  15.382  118.645   21.170  88.727    22.387  10.580 1.0004 9.0129 1.2419 1.567408       1.594755  
1 1 1 2  13 19 o 3.2143 0.9632 -3.7418  12.238  14.881    16.752  -25.0565  17.922  3.9732 1.5162 2.4553 1.1885 1.517970       1.926483  
1 1 1 2  13 20 o 8.1518 0.9798 74.093   15.488  75.294    20.813  72.603    23.184  8.3414 1.2476 7.9622 1.5112 0.3792448      1.959599  
1 1 1 2  13 21 o 4.4312 1.1911 19.780   14.424  19.905    18.691  19.596    22.679  4.3716 1.6156 4.4909 1.7507 -0.1193433     2.382245  
1 1 1 2  13 22 o 4.2562 1.1890 14.910   14.887  12.308    19.917  18.203    22.408  4.0387 1.6195 4.4738 1.7413 -0.4350829     2.378000  
1 1 1 2  13 23 o 8.8155 1.0306 88.627   17.327  99.894    23.413  74.983    25.765  9.6325 1.2153 7.9984 1.6648 1.634138       2.061167  
1 1 1 2  13 24 o 4.5672 1.2506 18.775   16.395  11.324    22.019  28.045    24.560  4.0840 1.6786 5.0505 1.8544 -0.9664888     2.501249  
1 1 1 2  13 25 o 10.668 0.9866 125.495  20.691  98.326    27.349  161.855   31.639  9.2770 1.4740 12.060 1.3117 -2.782978      1.973183  
1 1 1 2  13 26 o 4.4666 1.2671 19.860   17.724  27.573    22.710  7.8394    28.349  4.8170 1.7807 4.1163 1.8032 0.7006402      2.534240  
1 1 1 2  13 27 o 4.8434 1.3055 26.091   17.961  8.3365    22.553  56.877    29.698  3.6806 1.6104 6.0063 2.0551 -2.325696      2.610921  
1 1 1 2  13 28 o 6.3969 1.4211 65.917   20.123  63.980    26.279  68.662    31.287  6.4549 1.9048 6.3389 2.1093 0.1159940      2.842141  
1 1 1 2  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  13 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  14 0  o 14.951 0.7347 227.754  21.693  212.698   30.444  243.283   30.919  14.434 1.0680 15.468 1.0093 -0.000000      0.000000  
1 1 1 2  14 1  o 15.395 0.7111 237.988  21.895  237.988   21.895  0.0000    0.0000  15.395 0.7111 ?      ?      ?              ?         
1 1 1 2  14 2  o 34.597 0.5434 1202.90  37.599  1188.67   52.954  1217.36   53.394  34.390 0.7699 34.803 0.7671 -0.4131699     1.086812  
1 1 1 2  14 3  o 15.579 0.5131 243.879  15.985  241.970   22.760  245.737   22.455  15.518 0.7333 15.640 0.7179 -0.1218977     1.026217  
1 1 1 2  14 4  o 11.484 0.5033 132.628  11.502  133.839   15.556  131.169   17.082  11.544 0.6738 11.423 0.7477 0.1213560      1.006504  
1 1 1 2  14 5  o 17.204 0.5976 300.256  18.174  302.842   21.271  293.263   34.977  17.370 0.6123 17.037 1.0265 0.3333778      1.195225  
1 1 1 2  14 6  o 26.821 0.5952 714.745  28.249  703.763   32.884  745.667   55.182  26.477 0.6210 27.165 1.0157 -0.6884823     1.190473  
1 1 1 2  14 7  o 13.891 0.6309 191.789  15.463  188.593   17.968  200.915   30.359  13.700 0.6558 14.083 1.0779 -0.3828287     1.261706  
1 1 1 2  14 8  o 22.540 0.6015 512.861  23.922  511.813   27.901  515.771   46.484  22.556 0.6185 22.525 1.0319 0.3163528E-01  1.203013  
1 1 1 2  14 9  o 5.6756 0.9226 43.412   10.312  54.166    11.732  6.8696    21.625  7.3150 0.8019 4.0363 1.6617 3.278685       1.845113  
1 1 1 2  14 10 o 20.014 0.6137 404.761  21.384  402.111   24.743  412.583   42.508  19.967 0.6196 20.061 1.0595 -0.9430885E-01 1.227342  
1 1 1 2  14 11 o 12.588 0.6741 158.831  14.877  154.200   17.196  172.608   29.663  12.319 0.6980 12.857 1.1535 -0.5387697     1.348248  
1 1 1 2  14 12 o 10.970 0.7572 123.112  13.912  122.097   15.820  126.573   29.224  10.968 0.7212 10.973 1.3316 -0.5436897E-02 1.514354  
1 1 1 2  14 13 o 19.270 0.6148 365.682  20.897  348.305   24.136  417.708   41.762  18.513 0.6519 20.026 1.0427 -1.512724      1.229696  
1 1 1 2  14 14 o 10.877 0.8153 129.793  14.258  133.461   16.151  116.840   30.353  11.427 0.7067 10.327 1.4696 1.099852       1.630656  
1 1 1 2  14 15 o 15.666 0.6746 259.688  17.978  264.040   20.728  246.471   36.121  16.102 0.6436 15.231 1.1858 0.8710155      1.349214  
1 1 1 2  14 16 o 10.769 0.6436 117.007  12.961  109.825   15.566  133.244   23.405  10.322 0.7540 11.217 1.0433 -0.8950014     1.287252  
1 1 1 2  14 17 o 3.3267 0.9055 9.7114   8.0634  13.148    8.8724  -6.5966   19.328  3.5157 1.1200 3.1377 1.4231 0.3779914      1.811023  
1 1 1 2  14 18 f 10.483 0.7906 119.770  16.258  133.850   21.993  102.802   24.143  11.258 0.9768 9.7074 1.2435 1.550476       1.581285  
1 1 1 2  14 19 o 5.0958 1.1775 29.708   13.729  27.435    18.297  32.636    20.768  4.9079 1.6122 5.2838 1.7167 -0.3759012     2.355006  
1 1 1 2  14 20 o 5.1147 1.1471 25.694   14.482  7.3718    18.998  51.108    22.374  3.6997 1.5433 6.5298 1.6975 -2.830055      2.294190  
1 1 1 2  14 21 o 4.2687 1.1886 15.927   14.640  15.019    18.761  17.342    23.411  4.1020 1.5942 4.4353 1.7634 -0.3333416     2.377193  
1 1 1 2  14 22 o 4.8370 1.0028 17.153   15.234  55.044    20.069  -34.3603  23.400  6.9209 1.4937 2.7531 1.3386 4.167764       2.005695  
1 1 1 2  14 23 o 10.355 0.9206 114.898  18.815  93.087    24.865  144.115   28.779  9.1936 1.3523 11.517 1.2494 -2.323438      1.841125  
1 1 1 2  14 24 o 7.3746 1.2414 68.186   18.295  81.162    24.392  51.498    27.662  8.3832 1.5104 6.3661 1.9707 2.017157       2.482897  
1 1 1 2  14 25 o 6.9140 1.3596 63.089   19.445  66.824    24.827  57.161    31.274  7.3518 1.7192 6.4762 2.1067 0.8756390      2.719168  
1 1 1 2  14 26 o 5.0391 1.3459 32.468   19.112  40.464    24.959  21.133    29.716  5.4942 1.8840 4.5839 1.9225 0.9102592      2.691725  
1 1 1 2  14 27 o 9.8568 1.1706 127.419  21.843  132.857   28.521  119.703   33.971  10.509 1.3570 9.2049 1.9079 1.303887       2.341298  
1 1 1 2  14 28 o 6.0061 1.2623 61.178   20.776  91.414    26.818  15.793    32.856  7.9815 1.7299 4.0306 1.8387 3.950836       2.524542  
1 1 1 2  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  14 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  15 0  o 19.224 0.7229 374.921  27.588  387.740   38.687  361.657   39.351  19.569 0.9943 18.880 1.0496 -0.000000      0.000000  
1 1 1 2  15 1  o 9.1547 0.5959 84.691   10.871  79.506    15.734  89.428    15.037  8.8823 0.8857 9.4271 0.7975 -0.5448065     1.191854  
1 1 1 2  15 2  o 18.605 0.5088 347.923  18.929  357.571   26.875  338.425   26.664  18.862 0.7124 18.348 0.7266 0.5137749      1.017600  
1 1 1 2  15 3  o 20.080 0.5159 405.478  20.712  395.195   29.340  415.692   29.242  19.825 0.7400 20.336 0.7190 -0.5107288     1.031754  
1 1 1 2  15 4  o 13.200 0.7067 187.269  15.684  198.362   18.176  154.934   31.032  14.053 0.6467 12.346 1.2568 1.707528       1.413400  
1 1 1 2  15 5  o 11.757 0.6623 135.888  13.790  131.773   16.008  147.725   27.149  11.447 0.6992 12.066 1.1250 -0.6192417     1.324611  
1 1 1 2  15 6  o 19.890 0.5896 384.292  20.892  367.000   24.261  433.904   41.096  19.100 0.6351 20.680 0.9936 -1.579603      1.179256  
1 1 1 2  15 7  o 15.014 0.6965 229.030  20.164  228.008   25.345  230.794   33.284  15.003 0.8447 15.025 1.1076 -0.2222061E-01 1.392950  
1 1 1 2  15 8  o 35.645 0.6302 1244.50  39.724  1194.98   45.995  1389.87   78.808  34.418 0.6682 36.871 1.0687 -2.452812      1.260380  
1 1 1 2  15 9  o 4.2183 1.0139 18.270   9.7359  21.078    11.104  8.9324    20.248  4.4342 1.2157 4.0025 1.6231 0.4317060      2.027886  
1 1 1 2  15 10 o 15.748 0.6614 259.096  18.047  263.262   20.971  247.203   35.433  16.111 0.6508 15.384 1.1516 0.7270355      1.322767  
1 1 1 2  15 11 o 6.3228 1.0609 40.271   11.459  37.072    12.956  51.761    24.552  5.8859 1.1418 6.7598 1.7883 -0.8739538     2.121783  
1 1 1 2  15 12 o 6.0958 1.0226 45.707   11.260  50.749    12.804  28.490    23.658  7.0137 0.9128 5.1779 1.8303 1.835847       2.045297  
1 1 1 2  15 13 o 6.2309 1.0301 36.353   11.092  29.004    12.574  62.127    23.548  5.1201 1.2409 7.3417 1.6445 -2.221684      2.060145  
1 1 1 2  15 14 o 9.6299 0.9389 104.809  13.751  107.858   15.496  93.515    29.823  10.258 0.7553 9.0019 1.7192 1.255967       1.877791  
1 1 1 2  15 15 o 3.7587 1.0807 5.8341   9.8849  2.4925    10.818  22.728    24.325  2.7640 1.1596 4.7533 1.8239 -1.989316      2.161345  
1 1 1 2  15 16 f 7.1153 0.9954 50.452   11.542  45.719    12.897  69.506    25.876  6.5964 0.9776 7.6341 1.7342 -1.037774      1.990771  
1 1 1 2  15 17 o 5.0696 1.1075 29.862   10.796  30.754    11.855  25.523    26.139  5.2492 1.1601 4.8900 1.8869 0.3592687      2.215010  
1 1 1 2  15 18 o 3.5320 1.0090 8.9079   9.2314  9.1662    10.226  7.7709    21.458  3.1998 1.1925 3.8643 1.6278 -0.6645284     2.017928  
1 1 1 2  15 19 o 3.8184 0.9746 14.983   9.5617  19.346    10.837  -0.3590   20.318  4.1805 1.2202 3.4563 1.5200 0.7241495      1.949189  
1 1 1 2  15 20 o 13.612 0.8316 204.260  21.701  217.847   27.756  182.893   34.806  14.373 0.9656 12.852 1.3542 1.520978       1.663163  
1 1 1 2  15 21 o 6.3423 1.1693 44.272   16.568  17.884    22.113  78.045    25.016  4.4388 1.7292 8.2458 1.5743 -3.807072      2.338501  
1 1 1 2  15 22 o 7.0560 1.2431 59.846   17.332  60.593    22.661  58.794    26.905  7.1975 1.6140 6.9145 1.8911 0.2830110      2.486204  
1 1 1 2  15 23 o 3.9808 1.1958 7.1665   16.359  6.8229    21.200  7.6721    25.719  3.8293 1.6158 4.1323 1.7631 -0.3029797     2.391543  
1 1 1 2  15 24 o 10.107 0.9820 115.263  19.643  116.888   26.192  113.173   29.695  10.278 1.2742 9.9352 1.4944 0.3427019      1.963907  
1 1 1 2  15 25 o 5.8782 1.3526 43.654   18.317  32.152    23.928  59.932    28.466  5.0936 1.8364 6.6628 1.9865 -1.569186      2.705257  
1 1 1 2  15 26 o 5.7491 1.4177 50.716   20.122  53.188    26.103  47.096    31.588  6.0124 1.9217 5.4858 2.0847 0.5266185      2.835330  
1 1 1 2  15 27 o 6.5523 1.4385 66.802   20.732  52.547    26.794  88.070    32.727  5.7541 1.9521 7.3505 2.1134 -1.596406      2.877010  
1 1 1 2  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  15 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  16 0  o 3.6010 1.2288 13.461   12.366  -2.2675   16.325  34.635    18.942  2.2324 1.4636 4.9697 1.9744 -0.000000      0.000000  
1 1 1 2  16 1  o 19.536 0.5188 384.233  20.268  377.824   28.709  390.601   28.618  19.372 0.7410 19.700 0.7263 -0.3274250     1.037612  
1 1 1 2  16 2  o 5.2520 0.8470 29.382   9.1270  40.635    12.661  17.207    13.169  6.3326 0.9997 4.1714 1.3676 2.161137       1.693980  
1 1 1 2  16 3  o 12.006 0.5403 144.548  12.890  138.353   17.140  152.616   19.558  11.716 0.7315 12.296 0.7953 -0.5802116     1.080556  
1 1 1 2  16 4  o 21.945 0.6115 486.862  23.744  485.963   27.739  489.325   45.924  21.971 0.6313 21.920 1.0475 0.5160522E-01  1.223045  
1 1 1 2  16 5  o 17.703 0.6352 319.024  19.602  319.971   22.749  316.291   38.629  17.820 0.6383 17.586 1.0983 0.2335243      1.270307  
1 1 1 2  16 6  o 11.463 0.7547 136.459  14.892  138.671   17.241  129.961   29.551  11.714 0.7359 11.212 1.3179 0.5023623      1.509410  
1 1 1 2  16 7  o 13.720 0.6463 177.966  15.931  162.048   18.453  224.554   31.568  12.651 0.7293 14.789 1.0673 -2.137708      1.292670  
1 1 1 2  16 8  o 8.8888 0.7951 75.727   12.787  67.936    14.858  97.977    25.107  8.1354 0.9132 9.6423 1.3019 -1.506933      1.590260  
1 1 1 2  16 9  o 5.9406 0.9456 22.398   10.681  8.5218    11.951  77.451    23.805  3.3378 1.2790 8.5434 1.3931 -5.205690      1.891207  
1 1 1 2  16 10 o 13.179 0.6736 169.292  15.916  158.104   18.493  201.250   31.255  12.460 0.7421 13.897 1.1245 -1.436836      1.347289  
1 1 1 2  16 11 o 5.0734 1.1205 24.892   11.181  20.995    12.799  37.450    22.974  4.4052 1.3363 5.7416 1.7990 -1.336439      2.240964  
1 1 1 2  16 12 o 5.8454 1.1339 32.507   11.480  27.301    12.781  54.241    26.118  4.9561 1.2804 6.7347 1.8717 -1.778673      2.267720  
1 1 1 2  16 13 o 3.7580 1.0101 12.610   10.541  18.428    11.654  -13.5751  24.724  4.1287 1.2793 3.3873 1.5634 0.7414412      2.020123  
1 1 1 2  16 14 o 7.0556 0.9872 47.557   11.564  40.231    12.995  75.427    25.346  6.0707 1.1112 8.0406 1.6319 -1.969872      1.974324  
1 1 1 2  16 15 o 9.7636 0.8783 96.206   14.155  91.006    15.874  116.393   31.278  9.3618 0.8478 10.165 1.5385 -0.8036146     1.756586  
1 1 1 2  16 16 o 4.8080 1.1627 23.958   11.183  22.502    12.312  30.823    26.736  4.4539 1.3008 5.1621 1.9274 -0.7082248     2.325307  
1 1 1 2  16 17 o 9.2791 1.0218 106.654  14.042  113.735   15.872  81.146    30.125  10.489 0.7566 8.0693 1.8983 2.419570       2.043578  
1 1 1 2  16 18 o 7.0789 1.0804 63.390   12.601  68.208    14.178  45.275    27.492  8.0965 0.8755 6.0612 1.9754 2.035298       2.160737  
1 1 1 2  16 19 o 8.1180 0.9061 70.713   12.713  68.029    14.847  78.084    24.607  8.0506 0.9221 8.1854 1.5601 -0.1347828     1.812230  
1 1 1 2  16 20 o 4.6411 0.9582 27.406   10.314  34.869    11.581  -1.2047   22.677  5.6701 1.0603 3.6121 1.5964 2.058006       1.916370  
1 1 1 2  16 21 o 7.5006 1.3891 62.783   14.228  61.511    14.902  75.900    47.854  7.6581 0.9729 7.3430 2.6024 0.3151031      2.778294  
1 1 1 2  16 22 o 3.6005 1.1313 -1.7273  15.996  -4.6334   20.656  2.6256    25.281  3.3097 1.4889 3.8914 1.7038 -0.5817165     2.262663  
1 1 1 2  16 23 o 4.1809 1.2241 12.785   16.772  17.810    21.274  4.5303    27.266  4.3246 1.6929 4.0373 1.7685 0.2873073      2.448138  
1 1 1 2  16 24 f 9.4088 1.1631 109.110  20.503  125.404   27.043  87.080    31.445  10.618 1.2735 8.1997 1.9466 2.418211       2.326122  
1 1 1 2  16 25 f 5.7634 1.4149 45.802   19.733  42.327    25.865  50.643    30.526  5.5836 1.9177 5.9431 2.0809 -0.3594737     2.829776  
1 1 1 2  16 26 o 4.1529 1.2603 6.3611   19.302  -15.7682  24.409  43.294    31.534  3.0489 1.4522 5.2570 2.0602 -2.208066      2.520597  
1 1 1 2  16 27 o 7.5630 1.4353 93.576   22.028  93.255    28.276  94.070    35.131  7.9407 1.8195 7.1853 2.2203 0.7554126      2.870573  
1 1 1 2  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  16 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  17 0  o 21.135 0.7479 454.498  31.424  442.302   43.778  467.460   45.132  20.842 1.0565 21.429 1.0589 -0.000000      0.000000  
1 1 1 2  17 1  o 6.5351 0.8379 44.634   10.634  53.459    15.338  36.464    14.758  7.2337 1.0601 5.8366 1.2978 1.397160       1.675796  
1 1 1 2  17 2  o 6.7998 0.7854 47.858   10.391  41.505    14.306  54.952    15.118  6.2617 1.1858 7.3379 1.0301 -1.076197      1.570755  
1 1 1 2  17 3  o 12.942 0.6497 160.451  15.079  149.168   17.503  192.949   29.704  12.151 0.7202 13.733 1.0815 -1.581594      1.299336  
1 1 1 2  17 4  o 4.9873 1.0989 20.436   10.725  14.579    12.173  40.761    22.675  3.8719 1.3158 6.1027 1.7604 -2.230804      2.197820  
1 1 1 2  17 5  o 9.1345 0.8927 88.575   12.921  89.108    14.632  86.686    27.537  9.3652 0.7812 8.9038 1.6054 0.4613924      1.785374  
1 1 1 2  17 6  o 5.9347 1.0643 36.900   11.624  34.034    13.623  44.577    22.293  5.5946 1.2491 6.2748 1.7236 -0.6802073     2.128607  
1 1 1 2  17 7  o 7.8736 1.1026 73.529   16.177  87.942    20.451  49.438    26.440  9.1943 1.1122 6.5529 1.9041 2.641383       2.205121  
1 1 1 2  17 8  o 22.157 0.6388 493.199  24.866  483.022   28.822  522.829   49.178  21.839 0.6599 22.475 1.0941 -0.6360931     1.277649  
1 1 1 2  17 9  o 10.491 0.8255 120.423  14.621  125.128   16.925  106.584   29.027  11.061 0.7651 9.9206 1.4629 1.140647       1.650913  
1 1 1 2  17 10 o 12.627 0.7564 166.168  16.196  166.056   18.563  166.524   33.149  12.759 0.7274 12.496 1.3264 0.2637272      1.512805  
1 1 1 2  17 11 o 4.5901 1.1548 19.001   11.263  16.359    12.597  29.524    25.144  3.9660 1.3386 5.2142 1.8821 -1.248147      2.309526  
1 1 1 2  17 12 o 4.5093 1.0759 22.637   11.181  26.348    12.683  9.6922    23.689  4.8683 1.2841 4.1502 1.7266 0.7181177      2.151775  
1 1 1 2  17 13 o 13.673 0.7600 199.673  17.430  200.998   19.946  195.391   35.856  13.990 0.7128 13.355 1.3424 0.6350164      1.519906  
1 1 1 2  17 14 o 4.7162 1.1685 14.292   11.683  6.4068    12.984  47.841    26.781  3.2143 1.3010 6.2182 1.9414 -3.003941      2.336985  
1 1 1 2  17 15 o 3.2057 0.9956 -3.9500  9.1637  -7.7617   9.9971  16.094    22.925  2.1058 0.9796 4.3056 1.7336 -2.199855      1.991262  
1 1 1 2  17 16 o 13.035 0.7519 176.747  16.872  172.321   19.380  190.606   34.294  12.913 0.7504 13.157 1.3032 -0.2448292     1.503823  
1 1 1 2  17 17 o 12.724 0.7668 165.435  16.741  159.399   19.142  185.075   34.528  12.433 0.7698 13.016 1.3264 -0.5824480     1.533606  
1 1 1 2  17 18 o 8.9926 0.9755 83.963   13.892  79.364    15.540  102.254   30.991  8.7158 0.8915 9.2695 1.7355 -0.5536909     1.951065  
1 1 1 2  17 19 o 2.7447 0.9240 -9.1066  9.4946  -8.3036   10.258  -13.9092  25.086  2.1258 0.9900 3.3635 1.5603 -1.237693      1.847903  
1 1 1 2  17 20 o 10.625 0.9000 118.204  15.631  115.048   17.576  130.141   34.182  10.535 0.8341 10.715 1.5950 -0.1797085     1.799985  
1 1 1 2  17 21 o 15.725 0.6483 257.028  18.972  254.336   22.952  262.836   33.713  15.722 0.7299 15.728 1.0717 -0.6665230E-02 1.296681  
1 1 1 2  17 22 o 8.9034 1.0250 93.090   14.807  97.417    17.140  80.364    29.396  9.6699 0.8863 8.1368 1.8484 1.533137       2.049903  
1 1 1 2  17 23 o 2.9086 0.9524 -3.1391  9.9332  -0.4295   10.695  -20.1580  26.803  2.5495 1.1124 3.2676 1.5463 -0.7181311     1.904884  
1 1 1 2  17 24 o 6.9400 1.2025 49.618   13.868  41.326    15.409  84.974    31.818  5.9444 1.3294 7.9356 2.0043 -1.991248      2.405080  
1 1 1 2  17 25 o 5.3767 1.2618 29.339   12.594  21.608    13.767  68.970    31.171  4.1812 1.3994 6.5722 2.1000 -2.390986      2.523520  
1 1 1 2  17 26 o 7.7008 1.2145 80.710   15.528  79.488    17.424  85.428    34.229  8.3689 1.0410 7.0328 2.1946 1.336020       2.429016  
1 1 1 2  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  17 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  18 0  o 8.8286 1.1011 86.767   17.512  76.844    23.982  98.104    25.633  8.1931 1.6515 9.4642 1.4569 -0.000000      0.000000  
1 1 1 2  18 1  o 3.7950 0.9782 12.945   9.6668  11.070    13.976  14.665    13.385  3.6775 1.3893 3.9125 1.3774 -0.2349398     1.956379  
1 1 1 2  18 2  o 14.481 0.5276 212.160  15.218  200.802   20.423  226.338   22.818  14.054 0.7266 14.908 0.7653 -0.8535910     1.055265  
1 1 1 2  18 3  o 9.0320 0.8195 83.799   12.996  82.258    15.085  88.238    25.597  8.9648 0.8413 9.0992 1.4065 -0.1344299     1.638957  
1 1 1 2  18 4  o 11.723 0.7766 147.748  15.311  152.414   17.638  133.485   30.840  12.240 0.7205 11.206 1.3760 1.034200       1.553231  
1 1 1 2  18 5  o 9.2154 0.7877 83.717   12.714  79.335    14.619  97.323    25.758  8.8177 0.8290 9.6131 1.3397 -0.7953625     1.575460  
1 1 1 2  18 6  o 6.4435 1.1902 46.048   15.289  43.039    19.774  50.522    24.109  6.2123 1.5860 6.6748 1.7752 -0.4624500     2.380473  
1 1 1 2  18 7  o 6.3187 1.0819 50.055   12.781  56.594    14.599  28.595    26.449  7.3853 0.9884 5.2520 1.9250 2.133313       2.163886  
1 1 1 2  18 8  o 11.687 0.7507 138.190  15.549  133.586   18.075  151.291   30.492  11.427 0.7909 11.947 1.2761 -0.5198383     1.501355  
1 1 1 2  18 9  o 8.8025 1.0111 89.669   14.006  93.480    15.983  77.063    29.068  9.5245 0.8391 8.0806 1.8399 1.443912       2.022172  
1 1 1 2  18 10 o 12.237 0.8686 155.749  20.739  143.059   26.180  177.128   33.981  11.645 1.1241 12.829 1.3244 -1.183579      1.737148  
1 1 1 2  18 11 o 6.1482 1.0914 38.944   11.829  34.522    13.494  53.623    24.584  5.5835 1.2406 6.7129 1.7959 -1.129456      2.182767  
1 1 1 2  18 12 o 4.6604 1.1807 19.367   11.726  15.542    13.102  34.756    26.280  3.8836 1.3631 5.4373 1.9283 -1.553607      2.361461  
1 1 1 2  18 13 o 5.0320 1.1918 23.957   11.658  20.177    12.911  40.649    27.131  4.2748 1.3500 5.7893 1.9644 -1.514550      2.383502  
1 1 1 2  18 14 o 4.7285 1.0748 10.203   10.835  -0.8253   12.047  56.915    24.793  2.6839 1.1756 6.7730 1.7997 -4.089075      2.149586  
1 1 1 2  18 15 o 4.0851 1.1444 2.9357   11.487  -4.6037   12.644  38.562    27.486  2.5671 1.1589 5.6031 1.9737 -3.035995      2.288784  
1 1 1 2  18 16 o 4.8515 1.1354 27.705   11.988  31.043    13.157  11.388    29.088  5.2585 1.2662 4.4445 1.8850 0.8139238      2.270780  
1 1 1 2  18 17 f 8.2669 1.0233 69.579   14.110  62.897    15.979  93.236    30.066  7.7050 1.0369 8.8288 1.7644 -1.123839      2.046549  
1 1 1 2  18 18 o 7.5800 1.1723 80.160   15.365  90.585    17.360  42.461    33.012  9.2941 0.9339 5.8659 2.1505 3.428179       2.344546  
1 1 1 2  18 19 o 8.4924 1.0672 77.378   14.380  74.344    16.119  89.207    31.830  8.4261 0.9565 8.5588 1.9081 -0.1326790     2.134451  
1 1 1 2  18 20 o 10.279 0.9243 111.458  15.949  108.317   18.122  122.245   33.588  10.197 0.8886 10.361 1.6209 -0.1637411     1.848518  
1 1 1 2  18 21 o 5.2571 1.2703 25.342   12.691  21.198    13.856  46.938    31.628  4.3783 1.4002 6.1360 2.1198 -1.757789      2.540522  
1 1 1 2  18 22 o 7.0840 1.1795 71.942   15.077  80.373    16.741  35.748    34.689  8.7074 0.9613 5.4606 2.1543 3.246819       2.359022  
1 1 1 2  18 23 o 6.9815 1.2722 54.601   14.691  49.965    16.187  76.265    34.993  6.6180 1.2691 7.3449 2.2053 -0.7269225     2.544408  
1 1 1 2  18 24 o 6.3781 1.2321 56.192   14.561  58.384    15.816  44.002    37.302  7.2671 1.0882 5.4891 2.2110 1.778017       2.464261  
1 1 1 2  18 25 o 3.5916 1.1383 5.1198   11.200  3.1651    11.896  20.390    33.248  2.7900 1.1949 4.3933 1.9377 -1.603332      2.276527  
1 1 1 2  18 26 o 4.5506 1.1426 31.094   12.960  33.820    14.107  16.346    32.809  5.0793 1.3611 4.0219 1.8357 1.057391       2.285280  
1 1 1 2  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  18 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  18 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  19 0  o 3.9864 1.3612 23.058   14.749  36.945    19.844  5.9202    22.046  5.0681 2.0221 2.9047 1.8229 -0.000000      0.000000  
1 1 1 2  19 1  o 16.375 0.5560 273.345  18.181  286.639   25.508  259.618   25.921  16.790 0.7596 15.960 0.8121 0.8298330      1.111991  
1 1 1 2  19 2  o 10.104 0.7507 101.763  13.977  96.083    16.591  115.648   25.940  9.6947 0.8557 10.513 1.2337 -0.8184338     1.501393  
1 1 1 2  19 3  o 12.120 0.7353 150.899  15.588  149.420   18.087  155.168   30.734  12.110 0.7468 12.131 1.2668 -0.2091217E-01 1.470538  
1 1 1 2  19 4  o 4.5878 1.1462 15.421   11.354  9.6161    12.789  37.009    24.663  3.4631 1.3240 5.7126 1.8715 -2.249524      2.292459  
1 1 1 2  19 5  o 10.654 0.8081 120.759  14.840  122.537   17.218  115.620   29.269  10.941 0.7868 10.366 1.4117 0.5750704      1.616190  
1 1 1 2  19 6  o 9.5859 0.8674 93.927   14.595  90.593    16.880  103.800   29.052  9.3774 0.9000 9.7944 1.4831 -0.4169474     1.734833  
1 1 1 2  19 7  o 4.1252 1.0756 16.721   11.137  20.068    12.617  4.9113    23.699  4.2963 1.3311 3.9541 1.6899 0.3422086      2.151164  
1 1 1 2  19 8  o 8.2816 1.0196 79.477   13.976  83.487    16.250  68.083    27.394  8.9775 0.9050 7.5857 1.8273 1.391794       2.039159  
1 1 1 2  19 9  o 7.8685 1.0398 63.223   13.940  57.668    15.938  81.299    28.752  7.4052 1.0761 8.3317 1.7795 -0.9264703     2.079607  
1 1 1 2  19 10 o 4.8827 1.1848 22.986   12.226  18.987    13.921  36.466    25.562  4.2019 1.4072 5.5635 1.9066 -1.361598      2.369696  
1 1 1 2  19 11 o 10.452 0.8331 106.137  15.535  93.581    17.869  144.999   31.437  9.4434 0.9461 11.462 1.3714 -2.018205      1.666117  
1 1 1 2  19 12 o 6.5060 1.1259 46.931   13.311  43.378    15.567  56.596    25.676  6.2170 1.2940 6.7950 1.8428 -0.5779753     2.251772  
1 1 1 2  19 13 o 4.8064 1.1791 25.604   12.587  25.590    14.349  25.651    26.215  4.7187 1.4111 4.8941 1.8894 -0.1754074     2.358175  
1 1 1 2  19 14 o 15.738 0.7811 275.870  20.633  286.618   23.856  243.964   41.102  16.679 0.7152 14.797 1.3889 1.882141       1.562180  
1 1 1 2  19 15 o 12.831 0.9186 196.058  18.406  210.481   20.997  148.187   38.253  14.307 0.7338 11.356 1.6842 2.950877       1.837161  
1 1 1 2  19 16 o 12.252 0.8391 163.811  17.294  165.981   19.871  157.035   35.116  12.671 0.7842 11.834 1.4837 0.8362179      1.678145  
1 1 1 2  19 17 o 9.5071 1.0803 106.140  15.681  108.570   17.669  97.127    34.025  10.205 0.8657 8.8093 1.9795 1.395687       2.160512  
1 1 1 2  19 18 o 4.0862 1.1649 11.803   11.450  10.889    12.463  16.745    28.986  3.5000 1.3141 4.6725 1.9238 -1.172477      2.329792  
1 1 1 2  19 19 o 7.2845 1.1578 56.302   14.318  51.946    16.155  72.249    30.911  6.9684 1.1592 7.6007 2.0046 -0.6323562     2.315665  
1 1 1 2  19 20 o 6.5032 1.1535 58.191   14.278  65.658    15.813  25.222    33.227  7.8881 1.0023 5.1183 2.0779 2.769850       2.307010  
1 1 1 2  19 21 o 3.8030 1.1315 0.3281   11.486  -5.6121   12.606  29.386    27.881  2.5122 1.1432 5.0937 1.9531 -2.581492      2.263098  
1 1 1 2  19 22 o 6.5942 1.3146 49.875   16.729  49.875    16.729  0.0000    0.0000  6.5942 1.3146 ?      ?      ?              ?         
1 1 1 2  19 23 o 7.6861 1.2891 61.860   15.620  52.605    17.088  108.883   38.518  6.7045 1.3213 8.6677 2.2140 -1.963192      2.578298  
1 1 1 2  19 24 o 3.9004 1.1617 14.874   12.483  16.003    13.327  6.7981    35.640  3.7272 1.3664 4.0736 1.8791 -0.3464613     2.323399  
1 1 1 2  19 25 o 3.8509 1.1371 16.697   13.511  20.305    14.561  -5.6483   36.235  3.9978 1.4335 3.7040 1.7657 0.2938492      2.274293  
1 1 1 2  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  19 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  20 0  o 2.9911 1.2878 9.7306   14.453  9.3175    20.015  10.181    20.893  2.9498 1.7986 3.0324 1.8436 -0.000000      0.000000  
1 1 1 2  20 1  o 10.891 0.6220 121.972  13.467  121.551   18.077  122.498   20.188  10.887 0.8302 10.896 0.9264 -0.9134293E-02 1.243976  
1 1 1 2  20 2  o 12.170 0.7228 147.701  16.134  138.774   19.069  170.191   30.267  11.633 0.8196 12.708 1.1909 -1.075171      1.445668  
1 1 1 2  20 3  o 15.445 0.6741 237.272  18.581  225.669   21.609  270.186   36.395  14.865 0.7269 16.026 1.1355 -1.161312      1.348216  
1 1 1 2  20 4  o 9.5585 1.0011 113.053  15.200  128.215   17.953  74.676    28.562  11.167 0.8039 7.9505 1.8337 3.216056       2.002131  
1 1 1 2  20 5  o 8.3434 0.9788 70.197   13.850  64.068    15.829  90.222    28.613  7.8278 1.0111 8.8590 1.6763 -1.031235      1.957593  
1 1 1 2  20 6  o 6.2111 1.1357 46.437   13.332  50.099    15.153  33.898    28.043  6.8996 1.0981 5.5227 1.9884 1.376846       2.271494  
1 1 1 2  20 7  o 8.3600 0.9752 72.723   14.200  67.888    16.538  86.290    27.701  8.0511 1.0270 8.6689 1.6582 -0.6178112     1.950461  
1 1 1 2  20 8  o 3.8789 1.1316 4.8317   12.053  -0.2316   13.602  23.343    26.007  2.8966 1.2593 4.8612 1.8804 -1.964620      2.263124  
1 1 1 2  20 9  o 12.194 0.7551 145.226  16.522  130.548   19.114  188.605   32.859  11.205 0.8529 13.184 1.2462 -1.979238      1.510114  
1 1 1 2  20 10 o 4.5560 1.1811 15.223   12.337  8.4422    13.987  38.985    26.184  3.4220 1.3622 5.6899 1.9298 -2.267861      2.362145  
1 1 1 2  20 11 o 4.7902 1.2336 22.973   13.289  20.469    15.009  32.062    28.588  4.3090 1.4610 5.2714 1.9881 -0.9623895     2.467202  
1 1 1 2  20 12 o 8.5675 1.0315 80.896   15.556  77.444    18.357  89.689    29.300  8.5137 1.0781 8.6212 1.7589 -0.1074295     2.062979  
1 1 1 2  20 13 o 10.642 0.9013 120.855  16.210  118.275   18.507  129.355   33.593  10.647 0.8691 10.637 1.5791 0.1007843E-01  1.802507  
1 1 1 2  20 14 o 7.0579 1.0868 71.664   14.426  86.890    16.588  24.431    29.218  9.1249 0.9090 4.9909 1.9745 4.134082       2.173675  
1 1 1 2  20 15 o 11.611 0.9081 154.702  17.516  162.684   20.275  131.218   34.778  12.528 0.8092 10.694 1.6261 1.834273       1.816285  
1 1 1 2  20 16 o 6.6812 1.1292 65.288   15.011  77.175    16.748  16.720    33.852  8.5574 0.9785 4.8049 2.0354 3.752435       2.258446  
1 1 1 2  20 17 o 4.1569 1.1764 12.845   12.704  11.574    14.317  17.548    27.550  3.6641 1.4009 4.6497 1.8904 -0.9855833     2.352877  
1 1 1 2  20 18 o 7.8595 1.1622 69.803   14.943  68.599    16.810  74.335    32.626  8.0592 1.0429 7.6598 2.0772 0.3993902      2.324360  
1 1 1 2  20 19 o 8.5157 1.1953 88.098   16.118  90.422    18.120  79.288    35.282  9.2652 0.9778 7.7662 2.1815 1.499050       2.390625  
1 1 1 2  20 20 o 4.2019 1.2335 9.9895   13.831  6.4128    15.370  25.213    31.710  3.3794 1.3971 5.0244 2.0333 -1.644965      2.467051  
1 1 1 2  20 21 o 4.8715 1.1317 30.758   13.623  38.112    14.938  -5.5709   33.201  5.7435 1.3271 3.9994 1.8334 1.744128       2.263307  
1 1 1 2  20 22 o 4.3738 1.2545 9.4004   12.908  2.9351    14.002  45.973    33.302  3.0251 1.2961 5.7226 2.1483 -2.697491      2.508943  
1 1 1 2  20 23 o 3.7490 1.1465 11.475   12.964  12.574    14.046  5.1533    33.692  3.5106 1.3752 3.9873 1.8349 -0.4766562     2.293021  
1 1 1 2  20 24 o 3.8674 1.2409 -3.1546  14.016  -11.6020  15.069  51.022    38.163  2.4356 1.1546 5.2993 2.1970 -2.863654      2.481881  
1 1 1 2  20 25 o 3.2146 1.0732 1.8966   13.043  4.0821    13.717  -18.7080  42.117  2.8869 1.2597 3.5423 1.7379 -0.6554658     2.146420  
1 1 1 2  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  20 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  21 0  o 2.5691 1.1501 0.7065   12.878  12.806    19.816  -8.1385   16.943  3.1156 1.8436 2.0226 1.3756 -0.000000      0.000000  
1 1 1 2  21 1  o 7.0423 1.0439 64.831   13.637  79.731    16.395  31.374    24.568  8.7641 0.9353 5.3204 1.8666 3.443707       2.087822  
1 1 1 2  21 2  o 10.763 0.8002 117.584  15.570  111.510   18.264  133.740   29.789  10.386 0.8792 11.139 1.3372 -0.7523909     1.600353  
1 1 1 2  21 3  o 8.7018 1.0190 84.549   14.655  85.566    16.919  81.494    29.324  9.0782 0.9319 8.3255 1.8125 0.7527218      2.038013  
1 1 1 2  21 4  o 19.680 0.6773 409.298  23.609  416.898   27.803  389.650   44.705  20.202 0.6881 19.157 1.1668 1.045225       1.354589  
1 1 1 2  21 5  o 9.0856 0.9297 82.190   15.576  71.742    18.311  109.538   29.626  8.2266 1.1129 9.9447 1.4895 -1.718081      1.859365  
1 1 1 2  21 6  o 9.1879 0.9628 91.148   15.026  88.626    17.434  98.433    29.630  9.1990 0.9476 9.1768 1.6762 0.2219486E-01  1.925504  
1 1 1 2  21 7  o 9.0845 1.0631 104.645  15.540  117.517   18.277  71.057    29.523  10.626 0.8600 7.5429 1.9446 3.083184       2.126288  
1 1 1 2  21 8  o 7.6319 1.0031 50.816   13.939  27.876    16.182  116.764   27.438  4.9337 1.5038 10.330 1.3280 -5.396549      2.006296  
1 1 1 2  21 9  o 7.3048 1.1271 69.363   14.632  77.532    16.985  45.845    28.819  8.5703 0.9909 6.0393 2.0247 2.530967       2.254139  
1 1 1 2  21 10 o 12.762 0.8509 181.924  18.728  187.893   21.905  165.705   36.105  13.440 0.8149 12.083 1.4940 1.356949       1.701786  
1 1 1 2  21 11 o 10.762 0.8749 121.214  16.812  115.043   19.600  138.398   32.707  10.456 0.9372 11.068 1.4776 -0.6115942     1.749752  
1 1 1 2  21 12 o 5.5566 1.1615 40.029   14.464  48.113    16.570  14.163    29.640  6.5480 1.3110 4.5652 1.9176 1.982739       2.322951  
1 1 1 2  21 13 o 11.587 0.8749 146.426  17.607  148.059   20.527  141.880   34.253  11.936 0.8599 11.238 1.5240 0.6975384      1.749807  
1 1 1 2  21 14 o 4.5342 1.1570 22.684   13.034  26.442    14.877  10.269    27.039  4.8018 1.4371 4.2666 1.8138 0.5352192      2.314097  
1 1 1 2  21 15 o 6.5401 1.2697 49.422   14.793  47.834    16.516  55.860    33.259  6.5230 1.3115 6.5572 2.1745 -0.3422546E-01 2.539371  
1 1 1 2  21 16 o 7.4325 1.1906 67.796   15.479  71.435    17.708  56.005    31.874  8.2142 1.0779 6.6508 2.1233 1.563405       2.381253  
1 1 1 2  21 17 o 3.6270 1.0779 6.6914   12.863  14.116    14.125  -29.3748  31.131  3.8279 1.4062 3.4261 1.6341 0.4017658      2.155864  
1 1 1 2  21 18 o 4.9933 1.3957 25.188   20.042  26.563    24.556  22.446    34.687  4.9415 1.8467 5.0450 2.0933 -0.1034465     2.791462  
1 1 1 2  21 19 o 11.863 0.8898 141.608  19.310  125.358   22.606  185.477   37.143  10.861 1.0407 12.865 1.4436 -2.003805      1.779616  
1 1 1 2  21 20 o 11.920 1.0131 161.475  19.131  161.846   21.508  160.068   41.865  12.412 0.8664 11.428 1.8317 0.9843216      2.026258  
1 1 1 2  21 21 o 10.857 1.1185 143.152  18.554  146.025   21.009  132.973   39.550  11.732 0.8953 9.9807 2.0499 1.751734       2.236920  
1 1 1 2  21 22 o 5.4012 1.2413 41.628   15.106  44.928    16.782  27.536    34.677  6.0387 1.4144 4.7637 2.0403 1.274959       2.482551  
1 1 1 2  21 23 o 10.534 1.1711 134.403  18.697  127.506   20.805  163.370   42.635  10.725 0.9699 10.343 2.1320 0.3821774      2.342273  
1 1 1 2  21 24 o 8.4512 1.3235 97.033   17.733  89.380    19.586  131.836   41.767  8.6884 1.1271 8.2140 2.3950 0.4743710      2.646999  
1 1 1 2  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  21 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  21 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  22 0  o 2.7202 1.2754 -2.5504  18.188  6.9899    20.995  -31.2470  36.412  2.8392 1.7806 2.6012 1.8264 -0.000000      0.000000  
1 1 1 2  22 1  f 4.5718 1.0808 23.928   12.264  30.924    14.726  8.0947    22.155  5.2050 1.3889 3.9386 1.6564 1.266338       2.161578  
1 1 1 2  22 2  o 8.2746 1.0260 81.815   14.510  88.450    17.283  65.966    26.711  9.1881 0.9405 7.3612 1.8237 1.826900       2.051939  
1 1 1 2  22 3  o 3.7635 1.0744 9.4414   13.160  18.419    15.155  -18.0760  26.533  4.1756 1.4660 3.3513 1.5710 0.8243222      2.148783  
1 1 1 2  22 4  o 5.6530 1.1289 40.511   13.203  45.917    15.242  24.260    26.429  6.4282 1.2304 4.8778 1.8931 1.550382       2.257813  
1 1 1 2  22 5  o 3.4739 0.9833 2.1540   13.017  19.833    14.903  -54.7326  26.733  4.2819 1.4559 2.6660 1.3221 1.615842       1.966617  
1 1 1 2  22 6  o 6.5814 1.1586 52.188   14.206  54.593    16.390  44.923    28.486  7.1402 1.1477 6.0225 2.0130 1.117785       2.317171  
1 1 1 2  22 7  o 11.027 0.9422 138.942  17.373  143.860   20.082  124.310   34.638  11.740 0.8552 10.314 1.6791 1.425910       1.884371  
1 1 1 2  22 8  f 9.0518 1.0302 91.703   15.513  90.338    17.890  95.841    31.143  9.2488 0.9671 8.8547 1.8194 0.3941002      2.060474  
1 1 1 2  22 9  o 11.218 1.0302 150.602  18.408  159.837   21.365  123.991   36.268  12.373 0.8634 10.064 1.8708 2.309226       2.060371  
1 1 1 2  22 10 o 6.8780 1.1537 61.206   15.105  69.094    17.670  39.791    29.114  8.0446 1.0982 5.7114 2.0292 2.333230       2.307345  
1 1 1 2  22 11 o 10.565 0.8894 113.861  16.745  105.787   19.409  137.365   33.115  10.042 0.9664 11.088 1.4933 -1.046363      1.778751  
1 1 1 2  22 12 o 7.8172 1.1974 78.767   16.058  85.445    18.371  57.147    33.055  8.9930 1.0214 6.6413 2.1661 2.351655       2.394869  
1 1 1 2  22 13 o 16.334 0.7573 279.527  21.889  273.451   25.529  296.388   42.531  16.244 0.7858 16.424 1.2948 -0.1805058     1.514578  
1 1 1 2  22 14 o 4.3159 1.1824 17.612   13.947  21.814    15.905  3.6261    29.018  4.4649 1.5041 4.1669 1.8248 0.2979650      2.364792  
1 1 1 2  22 15 o 4.7429 1.0917 26.840   13.516  37.369    15.446  -7.5697   27.923  5.7391 1.3655 3.7467 1.7037 1.992401       2.183363  
1 1 1 2  22 16 o 5.7858 1.2417 25.386   14.476  11.551    16.342  75.787    31.192  3.7748 1.4820 7.7968 1.9928 -4.021943      2.483440  
1 1 1 2  22 17 o 5.4137 1.3239 28.634   14.726  23.124    16.476  50.525    32.838  4.5556 1.5309 6.2719 2.1604 -1.716320      2.647810  
1 1 1 2  22 18 o 8.4191 1.2484 94.050   17.392  101.738   19.737  67.332    36.792  9.8026 1.0067 7.0357 2.2848 2.766873       2.496793  
1 1 1 2  22 19 o 7.3419 1.3172 60.164   16.564  53.291    18.578  86.808    36.578  6.7660 1.4182 7.9178 2.2202 -1.151786      2.634489  
1 1 1 2  22 20 o 4.0560 1.2602 8.2520   16.914  8.7212    18.997  6.4570    37.156  3.6789 1.5397 4.4331 1.9953 -0.7542033     2.520302  
1 1 1 2  22 21 o 4.0594 1.2849 7.1215   21.078  5.3325    27.200  9.8107    33.348  3.8725 1.7277 4.2463 1.9024 -0.3738136     2.569876  
1 1 1 2  22 22 o 4.4668 1.2590 25.486   15.793  27.744    17.509  15.627    36.585  4.6012 1.5779 4.3324 1.9622 0.2688875      2.517923  
1 1 1 2  22 23 o 8.0383 1.3427 94.461   17.923  91.169    19.840  109.070   41.794  8.8138 1.1255 7.2627 2.4382 1.551049       2.685461  
1 1 1 2  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  22 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  22 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 0  o 5.9637 1.8115 59.440   22.771  63.464    26.893  49.247    42.802  6.7597 2.2373 5.1676 2.8495 -0.000000      0.000000  
1 1 1 2  23 1  o 8.0921 1.0570 74.110   16.673  86.683    24.292  62.914    22.924  8.8642 1.3702 7.3199 1.6097 1.544307       2.113914  
1 1 1 2  23 2  o 8.8036 0.9848 85.650   15.364  84.090    18.333  89.330    28.157  8.9098 1.0288 8.6974 1.6795 0.2124376      1.969591  
1 1 1 2  23 3  o 10.645 0.9268 123.573  17.242  122.351   20.074  127.007   33.668  10.789 0.9303 10.501 1.6031 0.2882061      1.853509  
1 1 1 2  23 4  o 15.286 0.7549 255.827  20.237  263.507   23.824  235.929   38.348  15.963 0.7462 14.609 1.3125 1.354037       1.509779  
1 1 1 2  23 5  o 8.9112 1.1334 92.477   16.661  92.565    19.143  92.201    33.834  9.3309 1.0258 8.4915 2.0214 0.8394032      2.266747  
1 1 1 2  23 6  o 10.495 0.9805 128.791  16.837  135.404   19.671  110.672   32.560  11.389 0.8636 9.6006 1.7606 1.788793       1.961003  
1 1 1 2  23 7  o 7.2690 1.2254 59.995   15.570  55.951    17.815  73.078    32.039  7.0446 1.3127 7.4934 2.0695 -0.4488215     2.450724  
1 1 1 2  23 8  o 4.5488 1.2378 15.836   14.544  8.7442    17.037  34.892    27.926  3.6431 1.4845 5.4546 1.9812 -1.811454      2.475662  
1 1 1 2  23 9  o 14.463 0.8550 239.895  20.741  256.423   24.211  194.321   40.204  15.771 0.7676 13.156 1.5280 2.615001       1.709957  
1 1 1 2  23 10 o 6.6150 1.2460 51.381   15.550  49.844    18.208  55.520    29.886  6.6116 1.4194 6.6185 2.0483 -0.6935120E-02 2.492041  
1 1 1 2  23 11 o 8.8442 1.1658 91.934   17.185  92.592    19.809  89.932    34.556  9.3242 1.0622 8.3642 2.0756 0.9600487      2.331566  
1 1 1 2  23 12 o 5.4536 1.2702 31.470   14.405  26.228    16.626  47.254    28.850  4.7879 1.5340 6.1192 2.0250 -1.331285      2.540488  
1 1 1 2  23 13 o 8.6747 1.1896 96.274   17.192  106.339   19.971  67.472    33.785  10.073 0.9913 7.2760 2.1629 2.797401       2.379261  
1 1 1 2  23 14 f 4.8906 1.2792 12.485   15.037  0.6870    17.017  54.503    32.115  3.2439 1.4094 6.5374 2.1352 -3.293500      2.558481  
1 1 1 2  23 15 o 7.8803 1.2160 83.242   17.186  94.578    19.959  50.747    33.794  9.4487 1.0562 6.3119 2.1906 3.136799       2.431934  
1 1 1 2  23 16 o 3.7886 1.1224 5.3858   15.489  18.476    17.464  -42.8577  33.527  4.2596 1.5638 3.3177 1.6106 0.9418643      2.244838  
1 1 1 2  23 17 o 5.4334 1.2447 37.334   15.486  42.678    17.759  20.375    31.636  6.0404 1.4813 4.8265 2.0006 1.213949       2.489303  
1 1 1 2  23 18 o 4.4871 1.2306 21.224   16.141  29.186    17.967  -12.0951  36.754  4.9509 1.5956 4.0234 1.8739 0.9274726      2.461180  
1 1 1 2  23 19 o 5.1655 1.3813 24.351   16.441  15.862    18.412  57.753    36.521  4.0332 1.5760 6.2977 2.2690 -2.264506      2.762622  
1 1 1 2  23 20 o 3.9476 1.0981 13.959   14.944  27.316    16.642  -41.6469  33.955  4.6941 1.5373 3.2011 1.5684 1.493007       2.196168  
1 1 1 2  23 21 o 5.1471 1.3103 38.382   16.330  40.063    17.972  30.425    39.105  5.5125 1.5600 4.7817 2.1056 0.7308059      2.620524  
1 1 1 2  23 22 o 4.6780 1.3283 29.098   16.141  24.605    17.989  47.661    36.563  4.2677 1.5835 5.0883 2.1332 -0.8205199     2.656654  
1 1 1 2  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  23 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 0  o 14.028 1.2648 227.688  30.139  238.088   36.708  206.175   52.796  14.951 1.2476 13.106 2.2006 -0.000000      0.000000  
1 1 1 2  24 1  o 6.3631 1.2637 49.451   17.160  63.766    24.807  36.319    23.761  7.2499 1.7342 5.4763 1.8384 1.773575       2.527302  
1 1 1 2  24 2  o 4.1076 1.1237 15.545   12.619  15.223    15.449  16.190    21.871  3.9379 1.4662 4.2773 1.7032 -0.3393867     2.247353  
1 1 1 2  24 3  o 3.7511 1.1537 -3.2282  13.975  -11.1701  15.967  22.775    28.892  2.6575 1.2369 4.8448 1.9478 -2.187249      2.307330  
1 1 1 2  24 4  o 4.1026 1.1806 12.585   14.131  11.415    16.786  15.431    26.182  3.7687 1.4948 4.4364 1.8277 -0.6677873     2.361153  
1 1 1 2  24 5  o 6.9565 1.2851 52.980   16.046  46.613    18.358  73.587    33.027  6.3556 1.4730 7.5575 2.1063 -1.201898      2.570269  
1 1 1 2  24 6  o 11.991 0.8203 143.031  18.068  127.763   21.230  183.148   34.413  11.038 0.9617 12.944 1.3293 -1.906726      1.640680  
1 1 1 2  24 7  o 9.2870 1.0858 91.343   17.049  84.738    19.543  112.387   34.883  8.9266 1.0946 9.6474 1.8754 -0.7207747     2.171529  
1 1 1 2  24 8  o 6.3552 1.2007 34.364   15.695  14.059    18.297  90.906    30.533  4.0233 1.5714 8.6870 1.8158 -4.663733      2.401362  
1 1 1 2  24 9  o 5.8072 1.3363 38.451   15.727  35.863    17.799  47.662    33.581  5.5198 1.5491 6.0945 2.1778 -0.5746870     2.672559  
1 1 1 2  24 10 o 3.8700 1.1577 -5.4977  14.620  -18.5804  17.083  30.309    28.262  2.5435 1.2124 5.1964 1.9726 -2.652914      2.315435  
1 1 1 2  24 11 o 4.6895 1.2278 23.207   15.718  30.882    18.123  -0.0895   31.573  5.1800 1.5937 4.1989 1.8682 0.9811559      2.455660  
1 1 1 2  24 12 o 19.960 0.7340 428.345  25.953  438.759   30.644  401.921   48.813  20.655 0.7418 19.265 1.2669 1.389666       1.468051  
1 1 1 2  24 13 o 4.6262 1.3026 18.252   16.249  16.833    18.745  22.542    32.588  4.2229 1.6057 5.0295 2.0517 -0.8066158     2.605299  
1 1 1 2  24 14 o 17.845 0.7438 330.809  23.973  321.562   28.260  354.543   45.275  17.623 0.8018 18.066 1.2531 -0.4423046     1.487613  
1 1 1 2  24 15 o 4.4403 1.1775 18.368   16.180  32.006    18.376  -28.6609  34.126  5.2519 1.6029 3.6287 1.7252 1.623118       2.354920  
1 1 1 2  24 16 o 4.1071 1.2521 5.9642   15.515  1.6635    17.465  22.066    33.793  3.2883 1.4283 4.9258 2.0568 -1.637540      2.504122  
1 1 1 2  24 17 o 10.723 1.1126 134.579  19.844  134.778   23.068  134.014   38.916  11.213 1.0286 10.233 1.9731 0.9806519      2.225125  
1 1 1 2  24 18 o 5.9582 1.2822 51.494   18.207  61.522    20.601  15.713    38.913  7.1816 1.4834 4.7348 2.0919 2.446836       2.564447  
1 1 1 2  24 19 o 5.3497 1.3299 38.570   16.524  39.342    18.655  35.756    35.602  5.5469 1.5959 5.1525 2.1279 0.3943958      2.659828  
1 1 1 2  24 20 o 3.8423 1.2430 4.4306   15.887  0.9552    17.309  23.011    40.022  3.0931 1.3793 4.5915 2.0683 -1.498401      2.486042  
1 1 1 2  24 21 o 5.9540 1.4247 49.673   17.294  40.400    19.418  85.244    38.033  5.3162 1.6520 6.5917 2.3217 -1.275500      2.849463  
1 1 1 2  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  24 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 0  o 18.888 1.1044 403.872  37.018  439.354   45.502  334.416   63.662  20.543 1.1150 17.234 1.9067 -0.000000      0.000000  
1 1 1 2  25 1  o 4.5409 1.2687 18.695   17.039  19.712    23.716  17.610    24.496  4.5779 1.7887 4.5039 1.7996 0.7397461E-01  2.537332  
1 1 1 2  25 2  o 4.6385 1.2388 21.701   15.859  26.184    21.682  16.542    23.256  4.8795 1.7493 4.3976 1.7547 0.4818525      2.477676  
1 1 1 2  25 3  o 8.5207 1.0482 82.670   15.774  83.885    18.887  79.868    28.681  8.8969 1.0614 8.1445 1.8079 0.7524576      2.096491  
1 1 1 2  25 4  o 4.5317 1.1900 21.546   14.502  27.455    16.942  5.3482    28.050  4.9002 1.5463 4.1631 1.8092 0.7371416      2.379950  
1 1 1 2  25 5  o 3.4426 1.0964 -1.7089  14.227  2.7084    16.106  -17.3944  30.350  3.2585 1.3929 3.6266 1.6937 -0.3680866     2.192863  
1 1 1 2  25 6  o 5.1149 1.2861 30.184   15.984  32.238    18.951  25.123    29.755  5.2341 1.6329 4.9956 1.9875 0.2384706      2.572234  
1 1 1 2  25 7  o 4.9811 1.3218 24.272   15.208  21.044    17.073  36.672    33.459  4.4008 1.5550 5.5615 2.1379 -1.160674      2.643574  
1 1 1 2  25 8  o 7.6475 1.2340 65.057   17.361  55.452    20.762  87.388    31.657  6.8951 1.5440 8.4000 1.9255 -1.504965      2.468077  
1 1 1 2  25 9  o 18.095 0.7570 332.212  24.195  316.992   28.016  376.874   47.992  17.528 0.7992 18.662 1.2858 -1.133764      1.513914  
1 1 1 2  25 10 o 14.463 0.8229 224.622  20.897  225.938   24.447  221.053   40.269  14.774 0.8274 14.152 1.4228 0.6225271      1.645835  
1 1 1 2  25 11 o 14.417 0.8784 223.654  21.617  223.156   24.895  225.182   43.583  14.668 0.8486 14.165 1.5383 0.5027704      1.756894  
1 1 1 2  25 12 o 3.8736 1.1938 2.1352   15.708  -1.6860   18.517  11.939    29.661  3.2618 1.4420 4.4853 1.9030 -1.223457      2.387586  
1 1 1 2  25 13 o 11.892 1.0993 165.739  20.604  170.567   23.582  150.160   42.360  12.761 0.9240 11.023 1.9950 1.738851       2.198546  
1 1 1 2  25 14 o 3.7341 1.1720 0.6322   16.258  2.7513    19.251  -4.6372   30.357  3.5033 1.5106 3.9648 1.7923 -0.4615309     2.343967  
1 1 1 2  25 15 o 12.771 0.9508 176.942  21.329  171.051   24.769  193.842   41.952  12.691 0.9759 12.851 1.6322 -0.1607742     1.901679  
1 1 1 2  25 16 o 6.5068 1.3780 52.091   17.855  47.048    20.940  65.527    34.177  6.1781 1.6594 6.8355 2.2004 -0.6573372     2.756000  
1 1 1 2  25 17 o 4.0534 1.2709 6.4681   17.688  4.3337    20.186  13.527    36.710  3.5325 1.5350 4.5744 2.0259 -1.041873      2.541708  
1 1 1 2  25 18 o 4.1723 1.2160 16.125   18.178  29.658    21.096  -22.9090  35.828  4.7769 1.7240 3.5677 1.7153 1.209205       2.431948  
1 1 1 2  25 19 o 3.9971 1.2050 14.458   17.850  24.811    20.132  -23.5977  38.600  4.3992 1.6661 3.5951 1.7412 0.8041234      2.409905  
1 1 1 2  25 20 o 3.9612 1.2719 11.036   17.406  7.0161    19.203  29.544    41.207  3.3774 1.4817 4.5450 2.0678 -1.167548      2.543839  
1 1 1 2  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  25 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 0  o 5.7872 1.9055 33.994   24.491  9.9967    27.924  113.998   50.986  3.2309 2.0376 8.3436 3.2205 -0.000000      0.000000  
1 1 1 2  26 1  o 6.7899 1.3231 57.493   18.848  45.464    26.328  70.140    26.996  6.0216 1.9305 7.5582 1.8098 -1.536572      2.646213  
1 1 1 2  26 2  o 10.610 0.9114 123.700  19.313  126.875   26.884  120.315   27.762  10.781 1.2468 10.439 1.3298 0.3424520      1.822885  
1 1 1 2  26 3  o 4.9328 1.2687 21.507   17.957  -0.8350   24.410  47.856    26.509  3.6985 1.6443 6.1671 1.9325 -2.468536      2.537373  
1 1 1 2  26 4  o 4.1075 1.1361 15.093   13.711  20.724    16.637  3.1696    24.209  4.3757 1.5360 3.8393 1.6745 0.5363390      2.272241  
1 1 1 2  26 5  o 7.0685 1.3088 59.467   16.657  58.261    18.903  63.654    35.229  7.1902 1.3644 6.9468 2.2338 0.2434316      2.617528  
1 1 1 2  26 6  o 7.2975 1.3204 56.522   17.565  46.051    20.358  87.027    34.748  6.2750 1.6132 8.3199 2.0907 -2.044902      2.640782  
1 1 1 2  26 7  o 5.6889 1.2797 25.774   16.458  8.2004    19.357  71.623    31.265  3.7902 1.5675 7.5877 2.0232 -3.797447      2.559369  
1 1 1 2  26 8  o 5.5233 1.2791 37.004   16.068  41.093    18.889  26.296    30.567  5.9301 1.5685 5.1165 2.0211 0.8135996      2.558275  
1 1 1 2  26 9  o 11.144 0.9836 137.317  19.480  138.607   23.011  134.057   36.593  11.480 1.0022 10.808 1.6928 0.6716671      1.967260  
1 1 1 2  26 10 o 5.5493 1.3283 36.929   17.171  39.569    20.615  30.947    31.033  5.7714 1.6825 5.3272 2.0559 0.4442325      2.656617  
1 1 1 2  26 11 o 4.3384 1.2652 10.228   15.572  4.3637    17.893  28.533    31.611  3.4725 1.4758 5.2042 2.0554 -1.731687      2.530379  
1 1 1 2  26 12 o 4.8102 1.2910 13.510   16.698  -0.5988   19.812  48.120    31.029  3.4137 1.5011 6.2066 2.1008 -2.792957      2.581964  
1 1 1 2  26 13 o 5.5590 1.2916 40.192   17.776  49.920    20.976  15.403    33.484  6.4354 1.6284 4.6827 2.0052 1.752647       2.583111  
1 1 1 2  26 14 o 4.3363 1.2829 8.7545   17.706  -2.1639   21.365  32.696    31.637  3.4075 1.5249 5.2652 2.0636 -1.857720      2.565871  
1 1 1 2  26 15 o 5.0052 1.4183 24.466   19.755  17.008    23.306  43.505    37.237  4.2988 1.7420 5.7116 2.2387 -1.412796      2.836561  
1 1 1 2  26 16 o 3.3908 1.1310 -12.1388 17.183  -14.5112  19.953  -5.3290   33.805  2.8520 1.3449 3.9295 1.8188 -1.077563      2.262011  
1 1 1 2  26 17 o 3.0267 1.0468 -22.1765 17.493  -18.8880  19.814  -33.7988  37.250  2.6614 1.2785 3.3920 1.6579 -0.7306204     2.093610  
1 1 1 2  26 18 o 3.6191 1.1940 -3.9011  17.357  -10.2556  19.730  17.854    36.506  2.8704 1.3485 4.3678 1.9708 -1.497416      2.387965  
1 1 1 2  26 19 o 3.0482 1.0647 -19.3639 17.035  -19.2743  18.748  -19.7882  40.797  2.5129 1.2162 3.5834 1.7478 -1.070492      2.129350  
1 1 1 2  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  26 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 0  o 4.9519 1.9409 39.209   24.938  35.563    28.342  51.709    52.484  4.5901 2.3826 5.3138 3.0646 -0.000000      0.000000  
1 1 1 2  27 1  o 3.5894 1.1460 -6.6333  17.537  -11.2082  24.521  -1.8425   25.093  3.4189 1.5703 3.7599 1.6696 -0.3410046     2.292035  
1 1 1 2  27 2  o 8.5870 1.1154 83.805   18.723  77.156    26.434  90.499    26.522  8.1286 1.6815 9.0455 1.4661 -0.9168844     2.230838  
1 1 1 2  27 3  o 6.6867 1.6983 53.174   25.479  72.171    54.181  47.780    28.870  7.1548 2.7276 6.2187 2.0242 0.9361744      3.396642  
1 1 1 2  27 4  o 4.8180 1.3182 22.955   18.149  26.779    25.452  19.000    25.887  5.0060 1.8783 4.6301 1.8500 0.3758445      2.636381  
1 1 1 2  27 5  o 4.3240 1.1942 17.198   14.777  22.512    17.293  2.8179    28.447  4.5436 1.5676 4.1044 1.8019 0.4391856      2.388346  
1 1 1 2  27 6  o 9.5669 1.0739 87.747   18.355  68.297    21.193  146.115   36.714  7.7862 1.4130 11.348 1.6177 -3.561336      2.147889  
1 1 1 2  27 7  o 9.3327 1.1516 96.749   19.152  91.620    22.734  109.287   35.545  9.2106 1.2341 9.4548 1.9446 -0.2441969     2.303196  
1 1 1 2  27 8  o 10.330 1.1083 116.726  19.754  110.589   23.008  133.938   38.530  10.165 1.1318 10.494 1.9060 -0.3293762     2.216671  
1 1 1 2  27 9  o 3.4891 1.1181 -3.9413  15.806  2.7803    18.214  -24.4418  31.809  3.4242 1.4729 3.5540 1.6826 -0.1298170     2.236243  
1 1 1 2  27 10 o 4.7902 1.3465 20.796   17.869  19.896    21.020  23.144    33.934  4.4909 1.7021 5.0896 2.0869 -0.5986862     2.692957  
1 1 1 2  27 11 f 10.437 1.0539 113.608  20.382  97.877    24.046  153.758   38.415  9.4308 1.2749 11.443 1.6785 -2.012505      2.107742  
1 1 1 2  27 12 o 7.6119 1.3304 77.988   19.626  84.693    22.968  59.847    37.782  8.7161 1.3176 6.5078 2.3117 2.208314       2.660816  
1 1 1 2  27 13 o 3.6954 1.1490 -2.2700  18.123  16.045    21.726  -44.1618  32.858  4.2028 1.6893 3.1880 1.5579 1.014762       2.298021  
1 1 1 2  27 14 o 3.5464 1.1719 -20.8542 18.399  -35.7926  21.899  15.000    33.927  2.5444 1.2493 4.5483 1.9830 -2.003960      2.343711  
1 1 1 2  27 15 o 5.4024 1.3202 41.519   19.747  55.230    23.462  8.2113    36.568  6.4654 1.7650 4.3393 1.9638 2.126109       2.640399  
1 1 1 2  27 16 o 4.6811 1.2209 30.102   18.978  47.744    21.650  -28.4317  39.436  5.8292 1.7311 3.5329 1.7222 2.296216       2.441872  
1 1 1 2  27 17 o 7.8971 1.5242 86.457   22.246  67.712    25.639  143.551   44.746  6.8117 1.8390 8.9825 2.4313 -2.170784      3.048484  
1 1 1 2  27 18 o 4.2639 1.3059 25.128   19.888  27.480    22.997  18.149    39.614  4.3473 1.7413 4.1806 1.9466 0.1666121      2.611747  
1 1 1 2  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  27 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 0  o 4.1316 1.7040 26.287   25.137  38.096    27.920  -24.2467  57.757  4.7411 2.3868 3.5221 2.4326 -0.000000      0.000000  
1 1 1 2  28 1  o 6.6423 1.2550 51.611   19.075  20.348    26.336  86.109    27.666  4.7092 1.8710 8.5755 1.6731 -3.866284      2.509950  
1 1 1 2  28 2  f 7.1680 1.3325 63.795   19.746  49.458    28.469  77.086    27.411  6.2970 2.0063 8.0390 1.7542 -1.742052      2.665046  
1 1 1 2  28 3  o 9.6507 1.1304 107.837  20.942  115.988   28.143  97.724    31.349  10.265 1.3708 9.0362 1.7979 1.229032       2.260854  
1 1 1 2  28 4  o 13.850 0.8564 207.109  23.695  220.095   33.897  194.700   33.137  14.296 1.1856 13.404 1.2360 0.8915892      1.712702  
1 1 1 2  28 5  o 3.9222 1.2260 -3.7372  19.527  -20.1967  26.776  14.959    28.538  3.3117 1.5605 4.5327 1.8912 -1.220963      2.451921  
1 1 1 2  28 6  o 6.6993 1.2758 55.616   16.942  57.987    20.462  50.448    30.212  7.0941 1.4896 6.3044 2.0716 0.7897172      2.551569  
1 1 1 2  28 7  o 6.2687 1.4005 43.025   18.456  32.640    21.986  67.797    33.957  5.2979 1.7685 7.2394 2.1722 -1.941493      2.801054  
1 1 1 2  28 8  o 2.8557 1.0033 -49.8976 16.761  -62.6349  19.734  -16.9132  31.756  1.9983 1.0106 3.7130 1.7335 -1.714759      2.006567  
1 1 1 2  28 9  o 11.862 1.1017 170.425  21.496  180.758   25.328  143.814   40.647  13.058 0.9698 10.665 1.9784 2.392494       2.203317  
1 1 1 2  28 10 o 8.7767 1.3233 99.228   21.315  104.473   25.675  87.595    38.236  9.6706 1.3275 7.8828 2.2896 1.787894       2.646564  
1 1 1 2  28 11 o 8.5909 1.3492 93.382   21.388  92.808    25.558  94.722    39.067  9.0266 1.4157 8.1553 2.2972 0.8713512      2.698402  
1 1 1 2  28 12 o 5.5167 1.4483 39.579   20.528  39.536    24.640  39.678    37.112  5.5234 1.8720 5.5101 2.2103 0.1331234E-01  2.896543  
1 1 1 2  28 13 o 3.3281 1.1268 -23.7540 18.417  -33.7513  21.847  0.7974    34.236  2.5627 1.2561 4.0935 1.8710 -1.530739      2.253593  
1 1 1 2  28 14 o 3.9026 1.2524 7.0304   20.101  10.486    23.599  -2.1025   38.366  3.8110 1.6578 3.9941 1.8777 -0.1830757     2.504848  
1 1 1 2  28 15 o 3.8776 1.2482 -3.0669  18.919  -17.3576  22.235  34.418    36.011  2.8689 1.3719 4.8863 2.0856 -2.017401      2.496332  
1 1 1 2  28 16 o 2.7292 0.9649 -37.6501 18.195  -31.9269  20.794  -56.3437  37.582  2.4250 1.1959 3.0333 1.5145 -0.6082838     1.929726  
1 1 1 2  28 17 o 4.1423 1.2638 23.707   19.903  31.696    23.139  0.9877    39.020  4.5075 1.7653 3.7772 1.8092 0.7302823      2.527690  
1 1 1 2  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  28 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 0  o 4.0102 1.7485 21.758   26.361  29.296    29.399  -9.1647   59.544  4.1956 2.3442 3.8248 2.5950 -0.000000      0.000000  
1 1 1 2  29 1  o 7.9632 1.3251 77.012   20.714  74.778    28.319  79.582    30.379  7.8657 1.8339 8.0608 1.9131 -0.1950817     2.650104  
1 1 1 2  29 2  o 5.9908 1.3684 41.936   20.067  64.105    28.710  20.761    28.058  7.1887 1.9482 4.7930 1.9221 2.395735       2.736834  
1 1 1 2  29 3  o 4.9761 1.2858 22.158   19.530  47.172    25.872  -10.9762  29.777  6.1918 1.9040 3.7604 1.7284 2.431406       2.571538  
1 1 1 2  29 4  o 14.695 0.8514 233.589  24.772  194.171   34.301  276.563   35.815  13.319 1.2876 16.071 1.1143 -2.751844      1.702815  
1 1 1 2  29 5  o 7.9913 1.4090 82.043   22.428  83.676    30.709  80.176    32.834  8.1508 1.9161 7.8319 2.0663 0.3188639      2.817942  
1 1 1 2  29 6  o 3.9676 1.2486 1.6357   19.841  2.9672    26.313  -0.1191   30.208  3.9125 1.7248 4.0226 1.8058 -0.1100640     2.497211  
1 1 1 2  29 7  o 4.8515 1.3693 24.360   20.261  30.851    27.950  17.172    29.413  5.1348 1.9587 4.5683 1.9141 0.5664730      2.738691  
1 1 1 2  29 8  o 4.5499 1.2924 -5.5895  18.564  -30.0498  21.852  57.862    35.195  2.6729 1.2982 6.4268 2.2353 -3.753881      2.584895  
1 1 1 2  29 9  o 5.5740 1.4595 37.150   20.402  29.502    24.675  53.677    36.271  4.9799 1.8532 6.1681 2.2552 -1.188155      2.918954  
1 1 1 2  29 10 o 8.6901 1.3425 89.935   21.362  74.208    25.541  126.554   38.973  7.7008 1.7035 9.6795 2.0755 -1.978724      2.685038  
1 1 1 2  29 11 o 7.3149 1.4541 75.034   21.362  73.745    25.719  77.901    38.360  7.5842 1.7334 7.0456 2.3352 0.5385766      2.908253  
1 1 1 2  29 12 o 6.7068 1.4269 55.832   21.375  27.038    25.787  119.068   38.214  4.5944 1.8426 8.8193 2.1791 -4.224910      2.853757  
1 1 1 2  29 13 o 9.9487 1.2662 126.351  22.589  114.056   26.832  156.263   41.852  9.7029 1.3827 10.195 2.1217 -0.4916449     2.532465  
1 1 1 2  29 14 f 4.1036 1.3128 -0.0527  20.127  -17.8198  23.311  51.989    39.895  2.8962 1.3901 5.3111 2.2275 -2.414926      2.625698  
1 1 1 2  29 15 o 2.7925 0.9956 -48.3116 18.850  -62.1486  22.263  -13.2741  35.427  2.0957 1.0614 3.4894 1.6847 -1.393750      1.991147  
1 1 1 2  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  29 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 0  f 4.8140 1.8940 43.991   30.274  56.938    33.847  -7.8139   67.703  5.6955 2.6621 3.9326 2.6947 -0.000000      0.000000  
1 1 1 2  30 1  o 2.8561 0.9811 -33.5755 17.692  -31.1602  24.937  -36.0234  25.104  2.8966 1.4021 2.8156 1.3728 0.8108377E-01  1.962264  
1 1 1 2  30 2  o 4.5432 1.4752 5.6642   25.590  -39.3458  68.787  12.894    27.569  4.7624 2.3107 4.3239 1.8346 0.4384232      2.950446  
1 1 1 2  30 3  o 6.2799 1.4472 51.310   22.063  73.441    31.732  30.600    30.697  7.4076 2.0646 5.1521 2.0284 2.255505       2.894351  
1 1 1 2  30 4  o 3.7671 1.1810 -6.7929  19.341  18.131    26.398  -35.6762  28.417  4.4831 1.8397 3.0511 1.4815 1.432004       2.362072  
1 1 1 2  30 5  o 7.7235 1.4380 79.529   23.769  50.348    32.746  112.025   34.556  6.0688 2.1525 9.3782 1.9073 -3.309335      2.875973  
1 1 1 2  30 6  o 6.1757 1.4989 47.694   24.650  16.831    33.389  84.668    36.545  4.6387 1.9948 7.7127 2.2378 -3.073986      2.997838  
1 1 1 2  30 7  o 9.8391 1.2700 122.373  24.015  152.962   34.195  92.602    33.735  11.426 1.4964 8.2522 2.0525 3.173941       2.540056  
1 1 1 2  30 8  o 8.6654 1.3017 104.026  24.594  166.008   34.604  40.758    34.961  11.884 1.4559 5.4467 2.1583 6.437388       2.603400  
1 1 1 2  30 9  o 7.2114 1.3245 74.523   19.464  82.799    23.922  58.314    33.478  8.2387 1.5074 6.1841 2.1783 2.054651       2.648952  
1 1 1 2  30 10 o 4.0991 1.2983 3.7894   19.853  -10.7612  23.458  40.513    37.267  3.1112 1.4644 5.0869 2.1442 -1.975724      2.596572  
1 1 1 2  30 11 o 10.600 1.2062 140.765  22.552  130.241   26.669  167.183   42.253  10.518 1.2677 10.681 2.0525 -0.1629734     2.412462  
1 1 1 2  30 12 o 4.1720 1.2248 18.279   19.578  35.186    22.587  -32.8100  39.264  4.9183 1.7825 3.4257 1.6801 1.492551       2.449513  
1 1 1 2  30 13 o 5.2977 1.4695 39.992   21.032  22.111    24.770  86.196    39.817  4.1535 1.7493 6.4419 2.3618 -2.288367      2.939033  
1 1 1 2  30 14 o 8.1086 1.5495 105.342  23.499  87.096    27.405  156.007   45.667  7.5173 1.8381 8.6999 2.4951 -1.182602      3.099061  
1 1 1 2  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  30 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 0  o 3.7291 1.7794 3.9386   28.516  -2.9259   31.514  34.955    66.988  2.8923 1.9402 4.5660 2.9834 -0.000000      0.000000  
1 1 1 2  31 1  o 4.6306 1.3294 17.364   21.033  41.527    29.388  -8.0109   30.116  5.5510 2.0300 3.7101 1.7170 1.840837       2.658749  
1 1 1 2  31 2  o 4.1371 1.2911 5.5589   21.004  -6.1472   28.144  20.276    31.556  3.6432 1.6767 4.6309 1.9637 -0.9876921     2.582126  
1 1 1 2  31 3  o 5.2825 1.4002 30.311   22.618  -1.2925   31.457  64.136    32.544  3.9330 1.7960 6.6321 2.1485 -2.699192      2.800334  
1 1 1 2  31 4  o 4.2089 1.2884 7.6959   20.866  -11.6693  29.023  28.413    30.019  3.5310 1.6514 4.8868 1.9781 -1.355841      2.576836  
1 1 1 2  31 5  o 5.8668 1.3738 45.809   22.964  80.516    30.854  2.7076    34.383  7.6044 2.0014 4.1291 1.8826 3.475232       2.747680  
1 1 1 2  31 6  o 6.1918 1.4203 54.473   23.158  91.035    33.093  19.383    32.419  7.9035 2.0692 4.4802 1.9460 3.423374       2.840514  
1 1 1 2  31 7  o 5.6573 1.5261 53.908   23.959  55.192    35.124  52.790    32.767  5.6752 2.1880 5.6394 2.1280 0.3578997E-01  3.052215  
1 1 1 2  31 8  o 4.5877 1.3869 24.791   22.733  12.259    30.626  40.169    33.927  4.0863 1.8275 5.0890 2.0867 -1.002724      2.773762  
1 1 1 2  31 9  o 4.2803 1.3439 16.293   23.310  3.9489    32.799  28.891    33.135  3.9083 1.8028 4.6523 1.9935 -0.7440274     2.687802  
1 1 1 2  31 10 o 4.1382 1.3241 15.409   23.483  13.723    32.572  17.235    33.886  4.0759 1.8482 4.2005 1.8967 -0.1245642     2.648276  
1 1 1 2  31 11 o 4.3286 1.3434 18.090   20.371  3.6592    24.155  53.630    37.907  3.4508 1.5751 5.2064 2.1766 -1.755571      2.686706  
1 1 1 2  31 12 o 3.1824 1.0984 -15.7595 20.386  -13.4815  23.620  -22.4115  40.362  2.9217 1.4016 3.4431 1.6916 -0.5213430     2.196810  
1 1 1 2  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  31 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 0  o 3.1432 1.5716 -10.2012 29.537  -11.5994  32.492  -3.5451   70.891  2.6260 1.8163 3.6604 2.5654 -0.000000      0.000000  
1 1 1 2  32 1  o 3.2061 1.0838 -16.8865 19.577  -22.4380  27.177  -10.8983  28.226  3.0554 1.4753 3.3568 1.5880 -0.3014121     2.167532  
1 1 1 2  32 2  o 4.1296 1.3076 13.187   22.485  20.435    30.247  4.2319    33.618  4.3199 1.8780 3.9393 1.8199 0.3806109      2.615177  
1 1 1 2  32 3  o 5.6601 1.5085 52.309   24.394  72.657    34.693  32.410    34.307  6.5216 2.2213 4.7986 2.0416 1.723028       3.016983  
1 1 1 2  32 4  o 7.1585 1.5580 83.934   24.443  88.097    35.896  80.335    33.378  7.2679 2.2441 7.0490 2.1618 0.2189503      3.115994  
1 1 1 2  32 5  o 3.5452 1.1895 -15.5964 22.699  -34.7486  30.533  8.0698    33.941  3.0330 1.4863 4.0573 1.8577 -1.024340      2.379084  
1 1 1 2  32 6  o 5.7612 1.3943 47.610   23.213  6.5715    31.912  93.722    33.827  3.9085 1.7938 7.6139 2.1351 -3.705379      2.788623  
1 1 1 2  32 7  o 3.8285 1.2632 -0.2746  24.382  19.272    34.084  -20.7600  34.893  4.2514 1.9125 3.4055 1.6508 0.8459468      2.526483  
1 1 1 2  32 8  o 4.7322 1.4336 37.185   24.452  29.876    35.732  43.622    33.534  4.4969 1.9948 4.9675 2.0594 -0.4705982     2.867121  
1 1 1 2  32 9  o 3.7828 1.2388 8.5588   22.004  1.9852    29.292  17.072    33.335  3.5448 1.6582 4.0209 1.8410 -0.4761198     2.477681  
1 1 1 2  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  32 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 0  o 2.6739 1.3611 -24.5141 27.737  -13.9999  29.777  -93.4708  76.257  2.4352 1.6969 2.9126 2.1286 -0.000000      0.000000  
1 1 1 2  33 1  o 6.2882 1.6452 88.899   30.625  73.350    76.511  91.866    33.419  5.1947 2.4998 7.3817 2.1395 -2.187070      3.290360  
1 1 1 2  33 2  o 3.2709 1.1202 -21.6985 22.029  -35.6309  29.076  -2.9253   33.751  2.8744 1.4168 3.6673 1.7354 -0.7929270     2.240304  
1 1 1 2  33 3  f 2.9316 1.0195 -34.5468 21.047  -19.6575  29.188  -50.6752  30.378  3.1352 1.5174 2.7281 1.3621 0.4070272      2.039027  
1 1 1 2  33 4  o 5.2891 1.4537 49.778   24.367  20.205    34.893  77.927    34.042  4.1750 1.9008 6.4032 2.2000 -2.228144      2.907379  
1 1 1 2  33 5  o 4.0244 1.2948 8.3516   24.302  44.980    35.018  -25.6762  33.752  4.8624 2.0655 3.1864 1.5618 1.675986       2.589503  
1 1 1 2  33 6  o 3.6540 1.2104 1.9812   22.858  19.383    31.261  -18.0109  33.507  4.0288 1.8202 3.2791 1.5960 0.7496786      2.420834  
1 1 1 2  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  33 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  34 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  35 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  36 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  37 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 2  38 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  1  0  o 31.366 0.7167 989.282  44.848  968.195   63.401  1010.40   63.448  31.029 1.0242 31.704 1.0029 -0.000000      0.000000  
1 1 1 3  1  1  o 23.117 0.4704 535.446  21.750  532.525   30.760  538.366   30.759  23.054 0.6671 23.180 0.6635 -0.1263428     0.9408787 
1 1 1 3  1  2  f 36.866 0.5334 1362.73  39.321  1390.54   55.760  1335.22   55.459  37.241 0.7486 36.492 0.7599 0.7497444      1.066707  
1 1 1 3  1  3  o 11.939 0.4490 142.960  10.719  139.942   15.177  145.963   15.139  11.813 0.6424 12.065 0.6274 -0.2522240     0.8979422 
1 1 1 3  1  4  o 18.083 0.5504 318.850  19.103  364.109   32.759  295.527   23.516  19.014 0.8614 17.152 0.6855 1.861895       1.100887  
1 1 1 3  1  5  o 7.4496 0.4814 55.694   7.1665  52.951    10.117  58.456    10.153  7.2649 0.6963 7.6343 0.6649 -0.3694181     0.9628127 
1 1 1 3  1  6  o 25.962 0.4894 676.403  25.410  681.319   36.016  671.531   35.855  26.056 0.6911 25.868 0.6931 0.1881027      0.9787737 
1 1 1 3  1  7  o 14.186 0.4621 201.887  13.103  209.890   18.584  193.975   18.477  14.466 0.6423 13.905 0.6644 0.5606966      0.9241225 
1 1 1 3  1  8  o 14.223 0.4654 203.052  13.231  210.293   18.702  195.796   18.721  14.478 0.6459 13.968 0.6701 0.5096521      0.9307164 
1 1 1 3  1  9  o 9.6141 0.4865 92.899   9.3365  85.772    13.139  100.169   13.269  9.2399 0.7110 9.9883 0.6642 -0.7483263     0.9730121 
1 1 1 3  1  10 o 30.010 0.4646 904.484  27.379  910.548   35.571  895.669   42.885  30.141 0.5901 29.878 0.7177 0.2634277      0.9291072 
1 1 1 3  1  11 o 39.999 0.5078 1602.73  39.897  1591.79   51.693  1618.84   62.747  39.843 0.6487 40.155 0.7813 -0.3124313     1.015506  
1 1 1 3  1  12 o 30.415 0.4653 923.900  27.814  908.663   35.984  946.512   43.836  30.112 0.5975 30.718 0.7135 -0.6066971     0.9306626 
1 1 1 3  1  13 o 23.578 0.3461 557.319  16.307  540.591   23.285  573.421   22.846  23.229 0.5012 23.926 0.4774 -0.6970024     0.6921914 
1 1 1 3  1  14 o 5.7387 0.4195 32.859   4.7966  35.161    7.1689  30.992    6.4541  5.9193 0.6056 5.5581 0.5806 0.3611741      0.8389288 
1 1 1 3  1  15 o 30.924 0.3652 959.061  22.584  962.193   32.244  956.046   31.641  30.973 0.5205 30.875 0.5124 0.9767723E-01  0.7304119 
1 1 1 3  1  16 o 15.559 0.3430 243.097  10.670  245.575   15.302  240.751   14.887  15.635 0.4893 15.482 0.4808 0.1531096      0.6859777 
1 1 1 3  1  17 o 11.523 0.3590 133.797  8.2717  132.707   11.812  134.846   11.588  11.476 0.5146 11.571 0.5007 -0.9444809E-01 0.7180223 
1 1 1 3  1  18 o 19.301 0.3494 375.238  13.487  371.851   19.179  378.550   18.969  19.213 0.4991 19.388 0.4892 -0.1750603     0.6988641 
1 1 1 3  1  19 o 16.834 0.3403 286.697  11.398  277.180   16.830  294.761   15.493  16.567 0.5079 17.101 0.4530 -0.5345383     0.6805801 
1 1 1 3  1  20 o 9.6742 0.3870 95.049   7.4622  91.681    10.902  98.018    10.235  9.5065 0.5734 9.8420 0.5200 -0.3355789     0.7740772 
1 1 1 3  1  21 o 4.4921 0.5847 21.723   5.0280  24.002    6.6624  18.706    7.6636  4.8364 0.6888 4.1478 0.9449 0.6885247      1.169301  
1 1 1 3  1  22 o 10.806 0.3625 118.985  7.7845  122.028   10.517  115.299   11.577  10.970 0.4794 10.642 0.5439 0.3279343      0.7250323 
1 1 1 3  1  23 o 3.3500 0.6828 12.472   4.8915  14.686    6.1624  8.7020    8.0421  3.6889 0.8524 3.0111 1.0669 0.6777256      1.365563  
1 1 1 3  1  24 o 5.1600 0.6139 30.209   5.7134  35.490    7.2473  21.538    9.2867  5.8966 0.6145 4.4234 1.0629 1.473218       1.227795  
1 1 1 3  1  25 o 16.125 0.3514 263.169  11.262  261.801   15.092  264.888   16.917  16.089 0.4690 16.161 0.5234 -0.7228851E-01 0.7027931 
1 1 1 3  1  26 o 5.2176 0.6291 27.943   6.1694  25.944    7.6438  31.680    10.450  5.0191 0.7615 5.4161 1.0016 -0.3969545     1.258167  
1 1 1 3  1  27 f 5.3480 0.6572 30.184   6.4916  29.811    7.9886  30.908    11.138  5.3823 0.7421 5.3137 1.0848 0.6867695E-01  1.314343  
1 1 1 3  1  28 o 4.7095 0.7750 26.036   7.0766  29.682    8.6494  18.654    12.307  5.3331 0.8109 4.0858 1.3210 1.247228       1.550040  
1 1 1 3  1  29 o 9.6333 0.4837 97.707   8.7923  100.977   10.899  91.615    14.878  9.9296 0.5488 9.3370 0.7967 0.5926208      0.9674661 
1 1 1 3  1  30 o 4.6387 0.7478 30.177   7.2237  38.780    8.5273  8.3163    13.594  6.0622 0.7033 3.2151 1.3199 2.847021       1.495567  
1 1 1 3  1  31 o 8.2934 0.5622 68.121   8.8543  54.045    10.669  99.268    15.871  7.0757 0.7539 9.5111 0.8343 -2.435447      1.124491  
1 1 1 3  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  2  0  o 5.5552 0.7905 34.789   7.6629  40.417    10.788  29.058    10.886  6.1454 0.9440 4.9649 1.2682 -0.000000      0.000000  
1 1 1 3  2  1  o 36.141 0.5240 1309.88  37.878  1317.06   53.598  1302.72   53.536  36.240 0.7395 36.042 0.7427 0.1982765      1.048053  
1 1 1 3  2  2  o 13.606 0.4424 185.617  12.039  186.108   17.017  185.125   17.035  13.624 0.6245 13.588 0.6268 0.3615284E-01  0.8848463 
1 1 1 3  2  3  o 17.982 0.4523 324.705  16.264  331.691   23.017  317.738   22.984  18.176 0.6332 17.788 0.6461 0.3878593      0.9045975 
1 1 1 3  2  4  o 19.143 0.4556 367.582  17.444  372.929   24.714  362.274   24.624  19.282 0.6409 19.004 0.6479 0.2780704      0.9112840 
1 1 1 3  2  5  o 14.262 0.5553 203.628  14.873  202.433   18.120  206.094   26.038  14.209 0.6377 14.316 0.9094 -0.1077900     1.110675  
1 1 1 3  2  6  o 19.403 0.5737 381.033  20.893  386.064   25.568  370.920   36.247  19.615 0.6517 19.191 0.9444 0.4244709      1.147457  
1 1 1 3  2  7  o 23.124 0.5920 544.312  25.886  515.673   43.924  559.552   32.041  22.633 0.9704 23.616 0.6784 -0.9835396     1.183982  
1 1 1 3  2  8  o 29.719 0.6157 888.000  34.775  891.301   59.288  886.269   42.937  29.732 0.9970 29.706 0.7227 0.2641106E-01  1.231401  
1 1 1 3  2  9  o 4.0983 0.8042 17.683   6.5386  15.523    11.834  18.632    7.8449  3.9791 1.2960 4.2175 0.9526 -0.2383556     1.608395  
1 1 1 3  2  10 o 26.826 0.5002 721.992  26.832  740.253   38.190  704.190   37.707  27.161 0.7030 26.490 0.7117 0.6709881      1.000393  
1 1 1 3  2  11 o 25.566 0.4546 655.492  22.829  656.256   29.630  654.375   35.809  25.591 0.5789 25.542 0.7010 0.4905891E-01  0.9091463 
1 1 1 3  2  12 o 25.672 0.4539 660.108  22.900  657.086   29.710  664.530   35.945  25.606 0.5801 25.738 0.6983 -0.1322079     0.9078296 
1 1 1 3  2  13 o 16.215 0.4413 262.508  14.094  256.977   18.314  270.543   22.073  16.010 0.5720 16.419 0.6722 -0.4091988     0.8825763 
1 1 1 3  2  14 o 45.853 0.5431 2113.29  48.913  2107.59   63.435  2121.64   76.817  45.801 0.6925 45.904 0.8367 -0.1030426     1.086112  
1 1 1 3  2  15 o 25.526 0.4576 654.818  22.952  654.533   29.809  655.232   35.971  25.532 0.5838 25.521 0.7047 0.1018906E-01  0.9151127 
1 1 1 3  2  16 o 17.687 0.3485 314.467  12.319  309.592   17.700  319.047   17.155  17.552 0.5042 17.822 0.4813 -0.2698517     0.6970384 
1 1 1 3  2  17 o 16.962 0.3748 289.132  12.674  277.247   17.108  303.586   18.867  16.581 0.5159 17.343 0.5439 -0.7617054     0.7496714 
1 1 1 3  2  18 o 6.1052 0.4776 38.236   5.7517  34.707    8.6267  41.060    7.7174  5.8402 0.7386 6.3703 0.6057 -0.5300999     0.9551879 
1 1 1 3  2  19 o 11.420 0.3659 132.170  8.2914  129.060   12.449  134.650   11.116  11.290 0.5513 11.549 0.4812 -0.2588263     0.7317858 
1 1 1 3  2  20 o 7.4306 0.4412 56.074   6.5254  57.238    9.7506  55.130    8.7819  7.4947 0.6505 7.3664 0.5961 0.1282845      0.8823017 
1 1 1 3  2  21 o 11.420 0.3819 132.944  8.6641  128.176   12.878  136.887   11.711  11.220 0.5739 11.619 0.5039 -0.3986692     0.7637427 
1 1 1 3  2  22 o 2.3993 0.6333 2.7606   4.1888  -0.8522   5.1950  9.4738    7.0816  1.7667 0.7730 3.0319 1.0033 -1.265200      1.266502  
1 1 1 3  2  23 o 3.1269 0.7011 10.142   4.8367  9.8133    6.1902  10.658    7.7500  3.0473 0.9304 3.2065 1.0490 -0.1592360     1.402155  
1 1 1 3  2  24 o 3.8001 0.7160 15.196   5.4369  12.855    6.9013  19.024    8.8275  3.4444 0.9639 4.1559 1.0590 -0.7115755     1.431949  
1 1 1 3  2  25 o 15.370 0.3563 238.871  10.896  235.811   14.641  242.668   16.311  15.269 0.4794 15.471 0.5271 -0.2021408     0.7125627 
1 1 1 3  2  26 o 15.516 0.3833 244.057  11.641  242.654   14.979  246.197   18.498  15.484 0.4837 15.549 0.5948 -0.6505680E-01 0.7666804 
1 1 1 3  2  27 o 8.0265 0.5242 71.825   7.6616  86.200    9.7576  48.712    12.373  9.2175 0.5293 6.8355 0.9050 2.382065       1.048436  
1 1 1 3  2  28 o 12.340 0.4181 158.152  10.014  166.775   12.928  145.221   15.832  12.805 0.5048 11.875 0.6666 0.9299135      0.8361480 
1 1 1 3  2  29 o 6.6943 0.7009 49.733   7.9454  50.795    9.3230  46.914    15.188  7.0012 0.6658 6.3875 1.2335 0.6137290      1.401745  
1 1 1 3  2  30 o 11.696 0.4654 148.828  10.247  163.880   12.965  123.779   16.725  12.619 0.5137 10.773 0.7762 1.846037       0.9308267 
1 1 1 3  2  31 o 4.0061 0.8512 21.507   7.6057  24.899    8.8812  12.177    14.730  4.6089 0.9928 3.4034 1.3828 1.205526       1.702309  
1 1 1 3  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  2  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  3  0  o 30.978 0.7046 966.856  43.549  948.149   61.556  985.600   61.618  30.675 1.0058 31.281 0.9872 -0.000000      0.000000  
1 1 1 3  3  1  o 10.143 0.4421 103.270  8.9660  105.007   12.653  101.519   12.707  10.229 0.6185 10.057 0.6318 0.1721125      0.8841267 
1 1 1 3  3  2  f 3.3832 0.5869 11.980   3.9457  11.096    5.5642  12.874    5.5961  3.2593 0.8461 3.5071 0.8136 -0.2477973     1.173824  
1 1 1 3  3  3  o 21.528 0.4592 464.970  19.769  473.644   27.995  456.344   27.919  21.729 0.6442 21.328 0.6545 0.4016113      0.9183664 
1 1 1 3  3  4  o 16.040 0.4472 257.951  14.347  258.818   20.295  257.086   20.283  16.067 0.6316 16.013 0.6333 0.5395889E-01  0.8944569 
1 1 1 3  3  5  o 10.873 0.4467 118.603  9.7080  114.050   13.704  123.191   13.755  10.663 0.6426 11.083 0.6205 -0.4202080     0.8933081 
1 1 1 3  3  6  o 14.767 0.5654 220.593  15.555  223.268   18.902  214.981   27.377  14.920 0.6334 14.615 0.9366 0.3051310      1.130712  
1 1 1 3  3  7  o 27.867 0.6028 780.659  31.549  780.342   38.497  781.307   55.053  27.884 0.6903 27.849 0.9884 0.3524208E-01  1.205599  
1 1 1 3  3  8  o 9.0285 0.5850 78.569   9.8343  73.136    11.733  91.401    18.032  8.5342 0.6874 9.5227 0.9468 -0.9885664     1.170009  
1 1 1 3  3  9  o 26.719 0.6069 722.120  30.449  730.755   37.266  704.778   52.815  26.986 0.6905 26.453 0.9983 0.5333977      1.213806  
1 1 1 3  3  10 o 25.825 0.4996 669.406  25.794  647.341   36.390  691.687   36.568  25.396 0.7165 26.254 0.6964 -0.8581467     0.9991519 
1 1 1 3  3  11 o 22.186 0.4932 494.061  21.852  462.580   30.884  525.623   30.923  21.476 0.7191 22.896 0.6753 -1.420706      0.9864342 
1 1 1 3  3  12 f 24.643 0.5001 609.245  24.634  636.186   35.084  583.049   34.596  25.181 0.6966 24.104 0.7176 1.076971       1.000132  
1 1 1 3  3  13 o 48.653 0.6144 2382.41  59.742  2272.54   84.069  2494.50   84.914  47.514 0.8847 49.792 0.8527 -2.277966      1.228717  
1 1 1 3  3  14 o 16.334 0.4950 268.352  16.154  258.482   23.048  277.883   22.648  16.036 0.7186 16.632 0.6809 -0.5952759     0.9899563 
1 1 1 3  3  15 o 23.943 0.5019 578.189  23.992  542.784   34.125  612.796   33.738  23.211 0.7351 24.675 0.6836 -1.463955      1.003860  
1 1 1 3  3  16 o 3.4691 0.8331 11.348   7.0065  8.1519    9.9561  14.484    9.8619  3.1732 1.1779 3.7649 1.1785 -0.5917437     1.666204  
1 1 1 3  3  17 o 5.2505 0.8176 29.811   8.3861  35.743    12.049  24.238    11.679  5.7823 1.0817 4.7188 1.2263 1.063453       1.635174  
1 1 1 3  3  18 o 7.2021 0.5207 52.976   7.4511  52.207    11.149  53.597    10.017  7.1462 0.7801 7.2579 0.6901 -0.1117516     1.041479  
1 1 1 3  3  19 o 9.3854 0.4620 88.578   8.5858  97.827    13.327  82.015    11.226  9.7914 0.6805 8.9793 0.6251 0.8121376      0.9240523 
1 1 1 3  3  20 o 8.0802 0.4920 68.430   7.4557  61.628    12.639  72.060    9.2332  7.7305 0.8175 8.4299 0.5476 -0.6994419     0.9839838 
1 1 1 3  3  21 o 5.1477 0.6236 26.953   6.0091  45.382    9.4613  14.493    7.7797  6.6463 0.7118 3.6491 1.0241 2.997176       1.247190  
1 1 1 3  3  22 o 8.5815 0.4035 75.656   6.8669  82.002    9.4063  68.414    10.048  8.9827 0.5236 8.1802 0.6141 0.8024588      0.8070401 
1 1 1 3  3  23 o 7.3277 0.4444 54.430   6.4830  50.998    8.6710  58.780    9.7624  7.0713 0.6131 7.5841 0.6436 -0.5127859     0.8888985 
1 1 1 3  3  24 o 9.3098 0.4299 88.910   7.8347  90.565    10.153  86.474    12.318  9.4384 0.5379 9.1811 0.6708 0.2572918      0.8598401 
1 1 1 3  3  25 o 3.2930 0.6397 12.403   5.1056  18.864    6.2945  -0.0212   8.7293  4.2209 0.7742 2.3651 1.0185 1.855760       1.279345  
1 1 1 3  3  26 o 16.600 0.3619 279.935  11.944  285.270   16.130  273.458   17.772  16.789 0.4804 16.411 0.5415 0.3777771      0.7238379 
1 1 1 3  3  27 o 3.1723 0.7801 9.3699   5.8274  7.8119    7.1874  12.359    9.9552  2.8640 1.0092 3.4806 1.1899 -0.6166532     1.560237  
1 1 1 3  3  28 o 10.776 0.4589 126.367  9.2707  149.358   12.017  92.565    14.571  12.121 0.4957 9.4321 0.7724 2.688508       0.9177844 
1 1 1 3  3  29 o 7.9939 0.5491 69.815   8.2036  76.537    10.294  58.118    13.580  8.6212 0.5970 7.3667 0.9217 1.254508       1.098174  
1 1 1 3  3  30 o 4.6278 0.8160 25.924   7.2335  27.166    8.7285  23.199    12.925  4.9261 0.9198 4.3294 1.3482 0.5966988      1.632040  
1 1 1 3  3  31 o 4.0512 0.9359 20.687   8.7482  15.987    11.544  27.027    13.407  3.5958 1.2778 4.5065 1.3678 -0.9106669     1.871756  
1 1 1 3  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  3  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  4  0  o 37.711 0.7542 1431.87  56.775  1455.95   80.416  1407.93   80.168  38.029 1.0591 37.392 1.0740 -0.000000      0.000000  
1 1 1 3  4  1  o 20.580 0.4572 424.877  18.818  419.572   26.584  430.204   26.640  20.451 0.6499 20.709 0.6432 -0.2581711     0.9143982 
1 1 1 3  4  2  o 9.8837 0.4500 97.964   8.8931  94.899    12.540  101.065   12.614  9.7278 0.6445 10.040 0.6282 -0.3117495     0.9000508 
1 1 1 3  4  3  o 9.9084 0.4511 98.435   8.9374  96.008    12.584  100.907   12.696  9.7849 0.6430 10.032 0.6328 -0.2469692     0.9021479 
1 1 1 3  4  4  o 8.7670 0.4633 77.145   8.1187  74.437    11.515  79.823    11.448  8.6134 0.6684 8.9207 0.6417 -0.3073187     0.9265880 
1 1 1 3  4  5  o 26.329 0.4790 695.688  25.226  697.398   35.703  693.984   35.646  26.361 0.6772 26.297 0.6778 0.6467056E-01  0.9580879 
1 1 1 3  4  6  o 31.230 0.5002 978.866  31.245  984.696   44.241  973.065   44.132  31.323 0.7062 31.137 0.7087 0.1859341      1.000467  
1 1 1 3  4  7  o 3.3607 0.6308 11.816   4.3715  14.286    6.0718  9.1579    6.2989  3.6961 0.8404 3.0254 0.9410 0.6707277      1.261655  
1 1 1 3  4  8  o 19.601 0.5794 390.285  21.135  397.111   25.698  376.016   37.156  19.891 0.6460 19.311 0.9620 0.5791111      1.158778  
1 1 1 3  4  9  o 11.677 0.5759 131.914  12.471  124.200   14.856  150.321   22.949  11.128 0.6675 12.225 0.9386 -1.097077      1.151743  
1 1 1 3  4  10 o 22.057 0.5549 486.311  21.238  484.136   24.526  492.829   42.462  21.981 0.5579 22.133 0.9593 -0.1520844     1.109701  
1 1 1 3  4  11 o 8.4039 0.6000 65.218   8.5576  60.686    9.6453  81.980    18.549  7.7813 0.6198 9.0264 1.0275 -1.245066      1.199958  
1 1 1 3  4  12 o 37.668 0.6723 1427.46  47.965  1426.47   59.026  1429.39   82.298  37.687 0.7831 37.649 1.0930 0.3798294E-01  1.344540  
1 1 1 3  4  13 o 16.200 0.4992 264.004  16.145  247.313   22.910  280.471   22.756  15.688 0.7302 16.712 0.6808 -1.023893      0.9983390 
1 1 1 3  4  14 o 16.902 0.4995 287.429  16.866  275.630   24.035  298.876   23.673  16.558 0.7258 17.247 0.6863 -0.6889839     0.9989143 
1 1 1 3  4  15 o 35.523 0.5491 1275.34  38.954  1190.65   54.925  1361.05   55.255  34.325 0.8001 36.722 0.7523 -2.396313      1.098241  
1 1 1 3  4  16 o 18.602 0.5040 350.351  18.717  329.720   26.631  370.492   26.312  18.052 0.7376 19.151 0.6870 -1.098391      1.007953  
1 1 1 3  4  17 o 7.6843 0.6243 60.398   9.5824  63.362    13.995  57.782    13.147  7.8597 0.8903 7.5088 0.8755 0.3509746      1.248642  
1 1 1 3  4  18 o 2.8770 0.8126 4.1571   7.0882  8.5222    10.875  0.9336    9.3459  3.2349 1.2247 2.5192 1.0685 0.7156439      1.625278  
1 1 1 3  4  19 o 7.7305 0.6728 62.040   10.385  67.206    15.037  57.330    14.359  8.0426 0.9349 7.4183 0.9678 0.6243811      1.345619  
1 1 1 3  4  20 o 8.5510 0.5589 75.409   9.5582  74.049    13.455  76.794    13.580  8.4720 0.7941 8.6300 0.7868 -0.1579990     1.117883  
1 1 1 3  4  21 o 3.4848 0.7218 13.491   6.3974  -1.8757   11.050  21.238    7.8461  2.5323 1.1170 4.4374 0.9145 -1.905019      1.443599  
1 1 1 3  4  22 o 5.2019 0.8039 30.399   8.0363  27.881    12.512  32.167    10.485  4.9624 1.2588 5.4415 1.0003 -0.4790883     1.607804  
1 1 1 3  4  23 o 9.5043 0.5337 94.343   9.8145  87.328    15.672  98.870    12.589  9.1706 0.8544 9.8380 0.6398 -0.6674194     1.067450  
1 1 1 3  4  24 o 4.3815 0.7260 21.039   6.1485  20.803    7.9001  21.401    9.7919  4.3761 0.9312 4.3869 1.1140 -0.1080418E-01 1.451951  
1 1 1 3  4  25 o 12.356 0.4272 155.857  10.514  160.630   14.376  150.367   15.417  12.572 0.5717 12.141 0.6349 0.4309139      0.8544012 
1 1 1 3  4  26 o 6.4934 0.6082 43.828   7.6835  43.797    9.8064  43.878    12.365  6.5196 0.7521 6.4672 0.9560 0.5246592E-01  1.216368  
1 1 1 3  4  27 o 4.2627 0.7433 21.858   6.6669  27.938    8.1559  9.6149    11.574  5.1966 0.7847 3.3287 1.2626 1.867970       1.486629  
1 1 1 3  4  28 f 10.526 0.4928 114.900  10.201  116.867   13.345  112.135   15.821  10.668 0.6255 10.384 0.7618 0.2838058      0.9856960 
1 1 1 3  4  29 o 6.8708 0.8414 55.832   10.793  36.954    15.803  72.338    14.777  5.5169 1.4229 8.2247 0.8983 -2.707782      1.682764  
1 1 1 3  4  30 o 3.8410 0.9915 17.479   9.9200  16.398    14.469  18.438    13.627  3.7714 1.4160 3.9106 1.3884 -0.1392050     1.983082  
1 1 1 3  4  31 o 4.5430 0.9335 26.629   10.699  7.0371    15.305  45.355    14.963  3.1254 1.3473 5.9606 1.2924 -2.835114      1.866965  
1 1 1 3  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  4  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  5  0  o 40.202 0.7755 1626.26  62.248  1626.78   88.073  1625.73   87.992  40.208 1.0971 40.195 1.0964 -0.000000      0.000000  
1 1 1 3  5  1  o 26.827 0.4817 721.971  25.845  726.687   36.575  717.268   36.525  26.915 0.6795 26.740 0.6830 0.1754379      0.9633892 
1 1 1 3  5  2  o 11.447 0.4540 131.450  10.387  137.819   14.743  125.172   14.636  11.723 0.6288 11.171 0.6551 0.5521784      0.9080491 
1 1 1 3  5  3  o 7.8585 0.4841 62.340   7.5435  71.561    10.660  53.091    10.676  8.4461 0.6311 7.2708 0.7342 1.175268       0.9681274 
1 1 1 3  5  4  o 27.458 0.4850 756.627  26.633  768.713   37.701  744.586   37.630  27.677 0.6811 27.238 0.6908 0.4391651      0.9700508 
1 1 1 3  5  5  o 10.731 0.4614 115.673  9.8800  106.695   13.960  124.683   13.985  10.312 0.6769 11.150 0.6271 -0.8380384     0.9227071 
1 1 1 3  5  6  o 25.203 0.4794 637.563  24.165  645.158   34.131  629.929   34.217  25.354 0.6731 25.052 0.6829 0.3023682      0.9588673 
1 1 1 3  5  7  o 25.418 0.4811 648.815  24.458  650.524   34.478  647.084   34.700  25.453 0.6773 25.384 0.6835 0.6835365E-01  0.9622444 
1 1 1 3  5  8  o 38.146 0.5403 1460.92  41.222  1446.14   57.949  1476.06   58.651  37.951 0.7635 38.341 0.7648 -0.3903580     1.080684  
1 1 1 3  5  9  o 17.905 0.4687 321.559  16.779  320.371   23.407  322.815   24.064  17.871 0.6549 17.938 0.6708 -0.6667137E-01 0.9374226 
1 1 1 3  5  10 o 18.546 0.5822 338.289  20.749  321.245   25.684  370.315   35.206  17.896 0.7176 19.196 0.9170 -1.299738      1.164420  
1 1 1 3  5  11 o 24.479 0.5726 605.793  24.202  609.789   27.958  593.845   48.343  24.668 0.5667 24.290 0.9951 0.3776703      1.145158  
1 1 1 3  5  12 o 27.302 0.5926 765.674  27.836  782.143   32.230  717.328   55.221  27.931 0.5770 26.672 1.0352 1.258465       1.185116  
1 1 1 3  5  13 o 20.765 0.5661 435.928  20.297  437.982   23.439  429.771   40.587  20.896 0.5608 20.634 0.9835 0.2618942      1.132154  
1 1 1 3  5  14 o 18.843 0.6947 358.761  26.170  345.266   36.662  372.780   37.368  18.480 0.9919 19.206 0.9728 -0.7262173     1.389336  
1 1 1 3  5  15 o 13.222 0.7725 178.769  20.418  177.854   29.294  179.634   28.474  13.184 1.1109 13.260 1.0736 -0.7573032E-01 1.544946  
1 1 1 3  5  16 o 8.2763 0.6224 71.611   9.9728  52.197    14.283  90.082    13.931  7.1299 1.0016 9.4226 0.7392 -2.292731      1.244869  
1 1 1 3  5  17 o 7.2335 0.6799 54.783   9.6276  45.544    14.269  62.506    13.045  6.6389 1.0746 7.8280 0.8332 -1.189141      1.359794  
1 1 1 3  5  18 o 13.443 0.6484 187.446  16.714  190.584   20.987  182.006   27.636  13.657 0.7683 13.228 1.0446 0.4298344      1.296777  
1 1 1 3  5  19 o 9.1824 0.6264 87.101   11.472  88.390    16.908  86.002    15.615  9.2350 0.9154 9.1298 0.8552 0.1051798      1.252743  
1 1 1 3  5  20 o 4.6071 0.8913 23.373   9.2007  10.682    13.029  35.998    12.995  3.5104 1.3377 5.7037 1.1782 -2.193354      1.782560  
1 1 1 3  5  21 o 10.993 0.5833 127.724  12.423  114.524   19.544  136.673   16.092  10.450 0.9351 11.535 0.6975 -1.085454      1.166607  
1 1 1 3  5  22 o 4.5865 0.8835 23.284   8.7815  34.003    12.690  13.434    12.165  5.5163 1.1855 3.6566 1.3103 1.859663       1.767042  
1 1 1 3  5  23 o 2.9625 0.8250 4.6632   6.8577  11.416    12.137  1.4965    8.3116  3.5127 1.3012 2.4123 1.0145 1.100428       1.649911  
1 1 1 3  5  24 o 6.1816 0.7965 48.394   8.8037  22.980    14.426  63.475    11.113  4.5093 1.4273 7.8538 0.7075 -3.344491      1.593024  
1 1 1 3  5  25 o 14.467 0.4610 211.721  13.177  227.826   20.571  200.516   17.159  14.910 0.6898 14.024 0.6118 0.8858500      0.9220358 
1 1 1 3  5  26 o 9.3552 0.5953 92.517   10.776  83.768    17.059  98.327    13.901  8.9301 0.9552 9.7804 0.7107 -0.8503170     1.190531  
1 1 1 3  5  27 o 11.242 0.5525 133.262  12.133  118.654   18.621  144.040   15.994  10.646 0.8745 11.837 0.6756 -1.191060      1.105094  
1 1 1 3  5  28 o 11.813 0.5659 150.460  12.879  121.438   19.714  172.070   17.011  10.705 0.9208 12.922 0.6582 -2.217072      1.131882  
1 1 1 3  5  29 o 3.2868 0.9268 6.3993   9.4657  17.700    14.783  -1.4532   12.323  3.9540 1.4407 2.6195 1.1662 1.334428       1.853557  
1 1 1 3  5  30 o 5.6920 0.9346 41.915   10.806  29.483    16.706  50.859    14.170  4.6928 1.5404 6.6912 1.0588 -1.998422      1.869216  
1 1 1 3  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  6  0  o 31.358 0.7143 990.369  44.694  999.210   63.295  981.577   63.119  31.498 1.0071 31.217 1.0134 -0.000000      0.000000  
1 1 1 3  6  1  o 20.329 0.4628 414.708  18.814  418.078   26.543  411.305   26.672  20.412 0.6502 20.246 0.6587 0.1669426      0.9255373 
1 1 1 3  6  2  o 35.110 0.5209 1237.86  36.576  1243.40   51.694  1232.30   51.759  35.189 0.7345 35.031 0.7388 0.1582565      1.041770  
1 1 1 3  6  3  o 13.985 0.4581 196.163  12.813  197.060   18.110  195.263   18.129  14.017 0.6460 13.953 0.6497 0.6429386E-01  0.9162008 
1 1 1 3  6  4  o 27.101 0.4861 736.983  26.348  724.638   37.120  749.518   37.406  26.872 0.6907 27.331 0.6843 -0.4582901     0.9722890 
1 1 1 3  6  5  o 10.824 0.4686 117.786  10.125  125.101   14.233  110.294   14.406  11.167 0.6373 10.482 0.6871 0.6844082      0.9371842 
1 1 1 3  6  6  o 15.032 0.4627 226.849  13.908  229.107   19.559  224.540   19.782  15.108 0.6473 14.955 0.6614 0.1525621      0.9254109 
1 1 1 3  6  7  o 28.975 0.4977 842.930  28.837  854.745   40.573  830.869   40.993  29.182 0.6952 28.769 0.7125 0.4131451      0.9954240 
1 1 1 3  6  8  o 14.285 0.4647 204.605  13.273  197.832   18.604  211.629   18.943  14.044 0.6623 14.526 0.6521 -0.4821358     0.9294386 
1 1 1 3  6  9  o 27.271 0.4958 745.992  27.032  743.463   37.744  748.654   38.733  27.225 0.6932 27.317 0.7089 -0.9295082E-01 0.9915299 
1 1 1 3  6  10 o 30.735 0.5910 945.128  31.549  941.682   36.455  955.408   62.965  30.655 0.5946 30.815 1.0217 -0.1602459     1.182090  
1 1 1 3  6  11 o 36.064 0.6172 1299.21  38.726  1290.77   44.763  1324.35   77.215  35.879 0.6238 36.249 1.0651 -0.3702316     1.234300  
1 1 1 3  6  12 o 15.695 0.5820 250.063  15.518  252.135   17.800  243.501   31.680  15.857 0.5613 15.533 1.0197 0.3232822      1.163996  
1 1 1 3  6  13 f 23.155 0.5787 543.760  22.974  547.645   26.456  531.847   46.326  23.364 0.5662 22.945 1.0095 0.4193516      1.157419  
1 1 1 3  6  14 o 16.365 0.5648 265.206  15.917  260.497   18.259  280.114   32.487  16.104 0.5669 16.626 0.9770 -0.5219116     1.129592  
1 1 1 3  6  15 o 14.631 0.5989 222.696  14.733  227.821   16.899  206.458   30.081  15.048 0.5615 14.214 1.0581 0.8332081      1.197862  
1 1 1 3  6  16 o 4.6505 0.8057 29.643   7.2578  35.235    7.9366  1.0880    17.936  5.8922 0.6735 3.4088 1.4638 2.483429       1.611326  
1 1 1 3  6  17 o 13.824 0.6718 195.692  17.527  193.388   21.456  200.313   30.386  13.768 0.7792 13.880 1.0946 -0.1113377     1.343639  
1 1 1 3  6  18 o 19.377 0.5198 383.885  20.135  373.792   28.636  393.756   28.318  19.117 0.7490 19.637 0.7210 -0.5198727     1.039627  
1 1 1 3  6  19 o 11.167 0.6743 125.924  14.516  144.144   24.598  116.189   17.981  11.723 1.0491 10.611 0.8473 1.111670       1.348524  
1 1 1 3  6  20 o 9.4642 0.6503 93.652   12.233  94.649    18.379  92.858    16.390  9.4863 0.9687 9.4421 0.8679 0.4424286E-01  1.300645  
1 1 1 3  6  21 o 9.2254 0.6860 91.906   12.344  75.608    18.347  105.385   16.685  8.3944 1.0928 10.056 0.8296 -1.662069      1.371991  
1 1 1 3  6  22 o 9.8307 0.6470 101.895  12.357  98.414    19.745  104.137   15.844  9.6345 1.0247 10.027 0.7901 -0.3923416     1.293939  
1 1 1 3  6  23 o 10.129 0.6418 105.787  12.731  113.850   20.454  100.689   16.265  10.402 0.9831 9.8552 0.8252 0.5473127      1.283551  
1 1 1 3  6  24 o 7.6493 0.7267 61.909   11.081  55.790    15.518  68.275    15.827  7.2456 1.0709 8.0530 0.9826 -0.8074489     1.453412  
1 1 1 3  6  25 o 4.7837 0.9820 25.463   9.8309  28.903    15.364  23.079    12.793  5.0292 1.4486 4.5382 1.3261 0.4910102      1.963969  
1 1 1 3  6  26 o 8.1303 0.6636 70.437   10.236  65.484    17.061  73.223    12.794  7.8378 1.0884 8.4229 0.7595 -0.5850301     1.327147  
1 1 1 3  6  27 o 6.0899 0.8722 40.628   9.9172  46.506    16.700  37.426    12.326  6.3611 1.3542 5.8187 1.0995 0.5424104      1.744326  
1 1 1 3  6  28 o 3.6392 0.9590 10.589   9.2890  21.860    15.582  4.3746    11.570  4.3623 1.4886 2.9161 1.2094 1.446197       1.917971  
1 1 1 3  6  29 o 3.8318 0.8971 16.532   9.7990  -4.7304   16.268  28.640    12.276  2.7996 1.2834 4.8640 1.2539 -2.064388      1.794273  
1 1 1 3  6  30 o 3.0398 0.9246 2.8435   9.9247  13.347    16.453  -3.1652   12.444  3.5876 1.4600 2.4920 1.1348 1.095509       1.849117  
1 1 1 3  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  7  0  f 3.2242 1.0543 14.999   7.6332  11.832    10.456  18.613    11.169  2.8333 1.4529 3.6151 1.5281 -0.000000      0.000000  
1 1 1 3  7  1  o 26.043 0.4841 680.604  25.206  699.609   35.681  661.673   35.612  26.407 0.6756 25.679 0.6934 0.7281780      0.9681256 
1 1 1 3  7  2  o 18.957 0.4651 360.582  17.631  367.606   24.868  353.482   25.001  19.143 0.6495 18.770 0.6660 0.3728676      0.9302680 
1 1 1 3  7  3  o 19.136 0.4653 367.429  17.807  362.307   25.140  372.585   25.226  19.002 0.6615 19.271 0.6545 -0.2683372     0.9305791 
1 1 1 3  7  4  o 9.5569 0.4839 91.710   9.2468  93.377    13.054  90.032    13.100  9.6445 0.6768 9.4694 0.6917 0.1751585      0.9677036 
1 1 1 3  7  5  o 16.628 0.4674 277.596  15.543  276.254   21.882  278.962   22.081  16.588 0.6596 16.669 0.6623 -0.8082199E-01 0.9347459 
1 1 1 3  7  6  o 9.8474 0.4894 97.412   9.6281  99.843    13.424  94.837    13.817  9.9750 0.6729 9.7199 0.7108 0.2551785      0.9787454 
1 1 1 3  7  7  o 2.4900 0.6584 4.5116   4.4541  2.9597    6.2284  6.1358    6.3721  2.3126 0.9127 2.6675 0.9492 -0.3549106     1.316769  
1 1 1 3  7  8  o 19.286 0.4730 372.970  18.240  369.223   25.416  376.949   26.191  19.187 0.6623 19.385 0.6755 -0.1985512     0.9460670 
1 1 1 3  7  9  o 19.428 0.4411 377.187  16.841  372.549   21.808  384.039   26.507  19.284 0.5654 19.571 0.6772 -0.2873173     0.8822252 
1 1 1 3  7  10 o 10.662 0.5887 113.261  10.821  112.346   12.445  116.097   21.909  10.587 0.5878 10.737 1.0202 -0.1503458     1.177396  
1 1 1 3  7  11 o 13.224 0.6026 180.587  13.442  184.881   15.434  167.094   27.357  13.580 0.5683 12.869 1.0629 0.7109098      1.205286  
1 1 1 3  7  12 o 14.196 0.5990 207.156  14.360  210.997   16.473  195.005   29.303  14.503 0.5679 13.890 1.0548 0.6134109      1.198019  
1 1 1 3  7  13 o 36.135 0.6256 1311.26  39.293  1305.61   45.428  1328.06   78.297  36.056 0.6300 36.214 1.0810 -0.1584740     1.251187  
1 1 1 3  7  14 o 12.087 0.6243 141.765  14.116  131.205   16.900  166.130   25.670  11.399 0.7413 12.775 1.0047 -1.375852      1.248619  
1 1 1 3  7  15 o 14.506 0.5799 204.776  14.480  196.583   16.529  231.812   30.024  13.963 0.5919 15.050 0.9975 -1.086542      1.159881  
1 1 1 3  7  16 o 9.4225 0.6905 87.147   10.438  84.331    11.611  99.008    23.829  9.1245 0.6363 9.7204 1.2257 -0.5958757     1.381036  
1 1 1 3  7  17 o 8.2018 0.7297 69.336   9.6781  68.832    10.867  71.268    21.281  8.2269 0.6604 8.1768 1.3013 0.5017853E-01  1.459303  
1 1 1 3  7  18 o 10.996 0.7738 147.820  12.772  163.645   14.540  94.355    26.724  12.700 0.5724 9.2930 1.4379 3.406515       1.547630  
1 1 1 3  7  19 o 8.0637 1.0074 81.622   14.085  98.700    17.356  48.670    24.108  9.7506 0.8900 6.3767 1.8075 3.373926       2.014733  
1 1 1 3  7  20 o 11.932 0.5966 148.551  14.136  139.676   20.857  156.092   19.226  11.570 0.9014 12.294 0.7819 -0.7245789     1.193263  
1 1 1 3  7  21 o 13.927 0.5826 201.070  16.185  211.265   23.973  192.529   21.941  14.239 0.8418 13.616 0.8057 0.6229525      1.165275  
1 1 1 3  7  22 o 4.0787 0.9596 13.541   9.7627  31.325    15.962  2.9120    12.340  5.2167 1.4680 2.9407 1.2364 2.276026       1.919270  
1 1 1 3  7  23 o 10.634 0.7780 120.752  16.373  120.457   21.670  121.143   24.993  10.669 1.0155 10.599 1.1790 0.7048702E-01  1.556068  
1 1 1 3  7  24 o 17.189 0.5571 302.556  18.852  316.016   29.632  293.403   24.435  17.467 0.8482 16.911 0.7225 0.5562000      1.114175  
1 1 1 3  7  25 o 4.1441 1.0439 15.376   10.927  26.978    17.745  8.2902    13.868  4.8792 1.5869 3.4090 1.3566 1.470273       2.087736  
1 1 1 3  7  26 o 8.3571 0.7556 74.264   12.579  68.588    18.052  79.621    17.537  8.0199 1.1254 8.6943 1.0085 -0.6744537     1.511213  
1 1 1 3  7  27 o 8.9081 0.6729 85.026   11.421  80.706    18.965  87.484    14.306  8.6458 1.0968 9.1704 0.7800 -0.5245180     1.345858  
1 1 1 3  7  28 o 10.807 0.6202 125.042  12.881  119.029   21.011  128.663   16.305  10.504 1.0001 11.110 0.7338 -0.6056566     1.240426  
1 1 1 3  7  29 o 7.2341 0.8428 61.750   11.166  58.945    18.817  63.274    13.872  6.8653 1.4174 7.6030 0.9123 -0.7377219     1.685635  
1 1 1 3  7  30 o 7.9464 0.7772 72.433   11.970  77.731    19.646  69.305    15.094  8.0436 1.2212 7.8493 0.9615 0.1942568      1.554327  
1 1 1 3  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  8  0  o 2.7046 0.9547 9.3753   7.2406  1.4930    10.322  17.011    10.160  1.9516 1.2341 3.4576 1.4570 -0.000000      0.000000  
1 1 1 3  8  1  o 9.5829 0.4987 92.288   9.5475  87.700    13.523  96.848    13.482  9.3442 0.7236 9.8216 0.6863 -0.4773960     0.9973164 
1 1 1 3  8  2  o 17.485 0.4694 306.896  16.415  309.598   23.176  304.176   23.252  17.562 0.6598 17.407 0.6679 0.1552639      0.9388457 
1 1 1 3  8  3  o 15.505 0.4675 241.430  14.494  246.550   20.407  236.219   20.589  15.672 0.6511 15.338 0.6712 0.3336840      0.9350542 
1 1 1 3  8  4  o 9.3342 0.5002 87.538   9.3283  92.623    13.248  82.538    13.137  9.6041 0.6897 9.0642 0.7246 0.5398474      1.000413  
1 1 1 3  8  5  o 7.8180 0.5426 61.862   8.3074  46.759    11.569  77.943    11.937  6.8213 0.8480 8.8147 0.6771 -1.993413      1.085144  
1 1 1 3  8  6  o 23.515 0.4836 554.602  22.739  539.865   31.877  569.869   32.445  23.197 0.6871 23.834 0.6807 -0.6366253     0.9671626 
1 1 1 3  8  7  o 5.3542 0.6406 29.680   6.5964  23.689    9.3902  35.517    9.2684  4.7610 1.0170 5.9474 0.7792 -1.186368      1.281220  
1 1 1 3  8  8  o 13.272 0.4802 176.362  12.738  168.428   17.650  184.988   18.402  12.961 0.6809 13.583 0.6774 -0.6223907     0.9604732 
1 1 1 3  8  9  o 16.406 0.6162 271.956  19.123  275.102   23.572  265.900   32.707  16.559 0.7118 16.253 1.0062 0.3060570      1.232492  
1 1 1 3  8  10 o 9.6498 0.6648 95.871   10.590  97.611    12.035  89.905    22.288  9.8663 0.6099 9.4333 1.1813 0.4329748      1.329503  
1 1 1 3  8  11 o 19.982 0.5586 393.764  19.608  385.521   22.703  417.969   38.905  19.604 0.5790 20.359 0.9555 -0.7544384     1.117225  
1 1 1 3  8  12 o 15.721 0.6260 251.553  18.526  256.573   22.779  241.747   31.838  15.977 0.7129 15.465 1.0293 0.5113497      1.252071  
1 1 1 3  8  13 o 12.841 0.6150 168.221  13.408  169.639   15.381  163.732   27.362  12.992 0.5920 12.689 1.0782 0.3021841      1.229974  
1 1 1 3  8  14 o 5.8319 0.8896 35.824   8.6227  36.007    9.7225  35.150    18.664  5.9622 0.8153 5.7015 1.5814 0.2606969      1.779219  
1 1 1 3  8  15 o 10.382 0.7329 120.606  12.808  130.688   14.994  93.396    24.633  11.353 0.6603 9.4115 1.3087 1.942027       1.465844  
1 1 1 3  8  16 o 14.900 0.6739 236.757  18.209  250.935   22.006  205.977   32.424  15.726 0.6997 14.074 1.1519 1.651886       1.347794  
1 1 1 3  8  17 o 5.3647 0.9070 27.953   7.4628  26.579    8.0820  35.904    19.441  5.0957 0.7930 5.6337 1.6315 -0.5379820     1.814046  
1 1 1 3  8  18 o 1.6104 0.5902 -1.0049  1.6149  -0.7693   1.6242  -21.4426  15.124  0.9326 0.4187 2.2881 1.1037 -1.355493      1.180458  
1 1 1 3  8  19 o 7.2741 0.7196 54.381   10.468  54.381    10.468  0.0000    0.0000  7.2741 0.7196 ?      ?      ?              ?         
1 1 1 3  8  20 f 15.445 0.7023 270.961  17.332  287.416   19.783  216.614   35.953  16.793 0.5890 14.098 1.2751 2.695220       1.404584  
1 1 1 3  8  21 o 17.799 0.6784 353.767  19.829  372.193   22.790  296.372   40.223  19.092 0.5969 16.505 1.2185 2.586824       1.356817  
1 1 1 3  8  22 o 4.3697 1.0478 20.209   10.623  23.472    17.518  18.311    13.360  4.6148 1.5784 4.1245 1.3786 0.4902372      2.095647  
1 1 1 3  8  23 o 6.4764 1.0221 48.424   12.762  48.928    19.816  48.066    16.683  6.4401 1.5559 6.5128 1.3258 -0.7267952E-01 2.044158  
1 1 1 3  8  24 o 17.535 0.5612 319.097  19.326  306.122   29.943  328.362   25.302  17.173 0.8718 17.898 0.7068 -0.7256660     1.122343  
1 1 1 3  8  25 o 4.2553 1.0914 18.230   11.788  21.346    18.642  16.154    15.216  4.4926 1.6207 4.0180 1.4620 0.4746542      2.182716  
1 1 1 3  8  26 o 4.2724 1.0609 13.888   12.009  34.981    19.425  0.8369    15.279  5.4486 1.6447 3.0962 1.3404 2.352397       2.121726  
1 1 1 3  8  27 o 6.0792 1.1157 42.926   13.669  57.979    21.560  32.808    17.676  6.9366 1.5883 5.2217 1.5673 1.714903       2.231396  
1 1 1 3  8  28 o 3.7027 1.0542 10.681   12.259  18.950    17.839  3.2824    16.875  4.1558 1.5697 3.2496 1.4077 0.9062417      2.108466  
1 1 1 3  8  29 o 5.4941 0.9332 42.298   10.782  19.350    19.554  52.324    12.925  4.0810 1.6150 6.9073 0.9356 -2.826304      1.866456  
1 1 1 3  8  30 o 4.0992 1.0016 23.334   10.609  11.671    19.454  28.271    12.656  3.5287 1.5201 4.6698 1.3048 -1.141057      2.003237  
1 1 1 3  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  8  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  9  0  o 42.738 0.8075 1840.76  68.907  1853.66   97.274  1827.76   97.624  42.890 1.1358 42.585 1.1481 -0.000000      0.000000  
1 1 1 3  9  1  o 26.325 0.4923 695.876  25.917  682.162   36.582  709.695   36.722  26.064 0.7018 26.586 0.6906 -0.5225353     0.9846060 
1 1 1 3  9  2  o 21.347 0.4781 457.316  20.410  446.139   28.772  468.639   28.958  21.084 0.6823 21.610 0.6700 -0.5265293     0.9562936 
1 1 1 3  9  3  o 18.893 0.4755 358.244  17.955  373.479   25.362  342.936   25.423  19.298 0.6571 18.489 0.6875 0.8084660      0.9510630 
1 1 1 3  9  4  o 11.301 0.4921 128.129  11.124  128.273   15.702  127.985   15.761  11.308 0.6943 11.295 0.6977 0.1287270E-01  0.9842823 
1 1 1 3  9  5  o 10.226 0.5019 104.881  10.260  100.620   14.341  109.349   14.686  10.013 0.7162 10.439 0.7034 -0.4259520     1.003847  
1 1 1 3  9  6  o 13.794 0.4863 190.752  13.411  184.440   18.745  197.370   19.194  13.560 0.6912 14.028 0.6842 -0.4677076     0.9725381 
1 1 1 3  9  7  o 11.770 0.4922 138.746  11.577  134.630   15.986  143.285   16.788  11.587 0.6898 11.953 0.7022 -0.3660946     0.9843586 
1 1 1 3  9  8  o 43.440 0.5775 1895.13  50.172  1886.33   70.427  1904.20   71.493  43.339 0.8125 43.542 0.8210 -0.2028618     1.155062  
1 1 1 3  9  9  o 19.984 0.5544 389.790  19.528  377.751   22.599  425.269   38.796  19.412 0.5821 20.556 0.9436 -1.144070      1.108734  
1 1 1 3  9  10 o 19.093 0.5818 371.966  19.189  377.325   22.219  356.240   38.065  19.397 0.5728 18.789 1.0130 0.6076794      1.163687  
1 1 1 3  9  11 f 10.808 0.6360 114.699  11.939  111.709   13.726  123.985   24.194  10.547 0.6507 11.069 1.0928 -0.5223198     1.271901  
1 1 1 3  9  12 o 12.844 0.5868 160.533  13.366  154.179   15.496  179.003   26.420  12.388 0.6254 13.301 0.9932 -0.9129000     1.173689  
1 1 1 3  9  13 o 15.634 0.5939 245.101  16.036  242.620   18.459  252.735   32.377  15.525 0.5945 15.742 1.0284 -0.2172985     1.187827  
1 1 1 3  9  14 o 6.2723 0.9047 40.460   8.8191  39.756    9.7461  43.641    20.719  6.2585 0.7786 6.2861 1.6332 -0.2760553E-01 1.809305  
1 1 1 3  9  15 o 12.300 0.6148 146.872  12.995  139.674   14.801  171.082   27.146  11.745 0.6301 12.855 1.0559 -1.110062      1.229580  
1 1 1 3  9  16 o 3.6808 0.8419 15.269   6.8651  18.398    7.4963  -1.0027   17.093  4.1433 0.9277 3.2183 1.4052 0.9249861      1.683825  
1 1 1 3  9  17 o 4.7771 0.8454 31.107   8.2226  37.532    9.0667  1.3403    19.516  6.0513 0.7492 3.5029 1.5157 2.548345       1.690701  
1 1 1 3  9  18 o 7.1305 0.8933 49.020   9.7243  45.389    10.678  66.668    23.541  6.6390 0.8042 7.6220 1.5955 -0.9830108     1.786693  
1 1 1 3  9  19 o 3.8533 0.9422 5.0492   6.5892  1.0401    7.0062  35.750    19.388  2.2051 0.9296 5.5016 1.6392 -3.296500      1.884449  
1 1 1 3  9  20 o 11.462 0.7033 138.231  13.513  137.329   15.403  141.247   28.152  11.562 0.6661 11.362 1.2389 0.2005978      1.406601  
1 1 1 3  9  21 o 8.6113 1.0211 101.032  12.275  111.807   13.717  57.730    27.498  10.447 0.6565 6.7759 1.9338 3.670775       2.042205  
1 1 1 3  9  22 o 4.9491 1.0585 24.851   8.1340  24.324    8.5713  29.620    25.794  4.7479 0.9359 5.1504 1.8990 -0.4024758     2.117097  
1 1 1 3  9  23 o 4.1436 0.9306 19.359   6.4155  20.492    6.6530  4.3433    24.224  4.3921 0.7863 3.8950 1.6870 0.4970639      1.861209  
1 1 1 3  9  24 o 10.087 0.7517 106.357  15.032  118.726   23.196  97.401    19.738  10.567 1.0976 9.6067 1.0273 0.9605036      1.503306  
1 1 1 3  9  25 o 6.2688 1.1312 45.379   14.168  55.855    21.875  37.809    18.596  6.8740 1.6180 5.6635 1.5813 1.210460       2.262388  
1 1 1 3  9  26 o 12.439 0.7576 170.635  18.181  132.838   27.111  201.525   24.509  11.016 1.2305 13.862 0.8841 -2.845237      1.515128  
1 1 1 3  9  27 o 8.0111 1.0282 74.262   15.742  81.728    24.168  68.760    20.748  8.3217 1.5076 7.7006 1.3987 0.6210523      2.056487  
1 1 1 3  9  28 o 7.5822 1.0864 77.728   16.485  36.767    24.724  110.508   22.118  5.2034 1.8677 9.9609 1.1102 -4.757500      2.172789  
1 1 1 3  9  29 o 3.5743 1.1011 8.8140   14.661  8.1965    22.577  9.2642    19.278  3.6231 1.5974 3.5255 1.5159 0.9762979E-01  2.202209  
1 1 1 3  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  9  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  10 0  o 43.579 0.8164 1911.33  71.040  1877.59   99.758  1946.05   101.190 43.188 1.1568 43.971 1.1524 -0.000000      0.000000  
1 1 1 3  10 1  o 30.707 0.5118 946.328  31.428  935.388   44.345  957.368   44.548  30.529 0.7263 30.886 0.7212 -0.3573837     1.023504  
1 1 1 3  10 2  o 18.489 0.4800 342.968  17.747  338.014   25.077  347.939   25.120  18.355 0.6831 18.623 0.6744 -0.2683067     0.9599593 
1 1 1 3  10 3  o 29.651 0.5070 882.405  30.064  878.840   42.407  886.008   42.628  29.591 0.7166 29.711 0.7174 -0.1203079     1.013942  
1 1 1 3  10 4  f 10.626 0.5109 113.307  10.836  103.940   15.168  123.071   15.486  10.177 0.7452 11.076 0.6991 -0.8994131     1.021801  
1 1 1 3  10 5  o 13.747 0.4932 189.462  13.555  182.496   19.000  196.682   19.345  13.489 0.7043 14.004 0.6907 -0.5152597     0.9864196 
1 1 1 3  10 6  o 10.032 0.5206 101.231  10.414  106.227   14.433  95.805    15.042  10.292 0.7012 9.7711 0.7697 0.5207863      1.041197  
1 1 1 3  10 7  o 19.367 0.4853 376.446  18.786  390.238   26.489  362.490   26.647  19.725 0.6715 19.008 0.7009 0.7167702      0.9706427 
1 1 1 3  10 8  o 20.350 0.4873 415.570  19.830  417.828   27.886  413.261   28.204  20.406 0.6833 20.293 0.6949 0.1130066      0.9745778 
1 1 1 3  10 9  o 11.843 0.6194 140.739  14.671  140.739   14.671  0.0000    0.0000  11.843 0.6194 ?      ?      ?              ?         
1 1 1 3  10 10 o 13.136 0.6036 170.777  13.751  167.813   15.829  179.895   27.764  12.930 0.6121 13.341 1.0405 -0.4110146     1.207207  
1 1 1 3  10 11 o 16.289 0.5794 264.650  16.627  261.733   19.329  272.951   32.606  16.146 0.5986 16.432 0.9922 -0.2857800     1.158737  
1 1 1 3  10 12 o 9.8837 0.6968 99.865   11.528  100.339   13.136  98.278    24.046  9.9799 0.6581 9.7875 1.2284 0.1923361      1.393576  
1 1 1 3  10 13 o 29.247 0.6002 847.474  30.651  826.479   35.359  910.936   61.475  28.637 0.6174 29.858 1.0294 -1.221739      1.200378  
1 1 1 3  10 14 f 11.627 0.6642 135.576  12.858  132.719   14.537  145.844   27.560  11.443 0.6352 11.811 1.1667 -0.3673429     1.328407  
1 1 1 3  10 15 o 8.1478 0.7480 62.937   10.130  58.663    11.336  79.872    22.568  7.5913 0.7467 8.7043 1.2964 -1.113049      1.496022  
1 1 1 3  10 16 o 3.4686 0.9636 7.8639   7.0748  7.2852    7.5636  11.912    20.004  2.8581 1.0322 4.0791 1.6275 -1.220967      1.927161  
1 1 1 3  10 17 o 8.6991 0.8538 84.971   11.107  87.521    12.446  74.996    24.612  9.2649 0.6717 8.1333 1.5699 1.131527       1.707572  
1 1 1 3  10 18 o 6.6411 0.9611 54.352   9.9279  57.784    11.063  40.160    22.496  7.4943 0.7381 5.7879 1.7748 1.706365       1.922148  
1 1 1 3  10 19 f 18.436 0.6705 377.119  20.573  397.711   23.777  315.791   41.034  19.751 0.6019 17.121 1.1984 2.630272       1.341071  
1 1 1 3  10 20 o 4.6646 1.0571 22.533   8.4877  22.239    9.0269  24.776    24.934  4.4975 1.0262 4.8317 1.8483 -0.3342004     2.114105  
1 1 1 3  10 21 o 9.0493 0.7980 76.693   11.960  69.163    13.311  108.238   27.244  8.1751 0.8141 9.9235 1.3727 -1.748341      1.595978  
1 1 1 3  10 22 o 2.9604 0.9478 -2.6976  6.3276  -3.8561   6.5799  11.545    23.072  1.8002 0.8218 4.1205 1.7082 -2.320271      1.895654  
1 1 1 3  10 23 f 3.7525 1.0508 -0.3477  6.5863  -2.9149   6.8099  36.833    25.916  1.9010 0.8551 5.6041 1.9198 -3.703143      2.101586  
1 1 1 3  10 24 o 3.1240 1.0147 0.7350   6.6454  0.7429    6.8220  0.5881    29.397  2.1587 0.9141 4.0893 1.8119 -1.930535      2.029391  
1 1 1 3  10 25 o 7.8535 1.1077 72.710   12.043  73.663    13.020  67.070    31.677  8.4515 0.7703 7.2556 2.0772 1.195885       2.215426  
1 1 1 3  10 26 f 10.631 0.8133 123.853  17.021  115.283   25.799  130.458   22.650  10.215 1.2628 11.047 1.0252 -0.8316603     1.626556  
1 1 1 3  10 27 o 3.1290 1.0021 -5.1288  13.753  -17.0715  21.907  2.6402    17.669  2.9561 1.3986 3.3019 1.4354 -0.3458028     2.004128  
1 1 1 3  10 28 o 5.9089 1.1613 43.121   15.801  81.033    25.056  18.089    20.360  7.8028 1.6568 4.0150 1.6277 3.787830       2.322580  
1 1 1 3  10 29 o 5.9039 1.1458 52.820   16.232  22.996    25.250  73.823    21.190  4.2318 1.7733 7.5759 1.4513 -3.344154      2.291534  
1 1 1 3  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  11 0  o 31.314 0.7327 987.160  45.771  995.607   64.434  978.556   65.030  31.451 1.0268 31.176 1.0456 -0.000000      0.000000  
1 1 1 3  11 1  o 42.042 0.5692 1774.72  47.857  1793.16   67.764  1756.38   67.598  42.261 0.8017 41.824 0.8081 0.4371071      1.138345  
1 1 1 3  11 2  o 30.616 0.5143 940.456  31.492  954.149   44.522  926.745   44.550  30.840 0.7218 30.393 0.7329 0.4475975      1.028674  
1 1 1 3  11 3  o 32.449 0.5212 1056.30  33.822  1062.23   47.786  1050.34   47.876  32.541 0.7342 32.358 0.7398 0.1833458      1.042306  
1 1 1 3  11 4  o 10.904 0.5201 119.280  11.339  119.227   15.817  119.335   16.263  10.902 0.7254 10.906 0.7456 -0.4028320E-02 1.040223  
1 1 1 3  11 5  o 21.177 0.5902 447.637  23.784  459.554   40.667  441.443   29.322  21.375 0.9513 20.978 0.6989 0.3976345      1.180394  
1 1 1 3  11 6  o 22.587 0.4919 512.038  22.209  529.066   31.384  494.957   31.433  22.965 0.6833 22.209 0.7076 0.7551613      0.9837119 
1 1 1 3  11 7  o 12.684 0.5063 161.592  12.839  165.236   18.046  157.855   18.271  12.830 0.7033 12.539 0.7286 0.2915802      1.012624  
1 1 1 3  11 8  o 11.578 0.5528 135.008  12.685  133.095   19.205  136.488   16.894  11.501 0.8350 11.655 0.7247 -0.1546392     1.105612  
1 1 1 3  11 9  o 11.181 0.6498 130.669  12.543  135.647   14.618  116.770   24.424  11.624 0.6288 10.738 1.1373 0.8865128      1.299568  
1 1 1 3  11 10 o 15.805 0.6047 257.134  16.649  263.025   19.407  240.719   32.398  16.186 0.5995 15.423 1.0503 0.7635736      1.209362  
1 1 1 3  11 11 f 5.4029 0.9689 31.276   9.0405  32.322    10.032  26.757    20.854  5.6487 0.8880 5.1570 1.7223 0.4916782      1.937789  
1 1 1 3  11 12 o 27.305 0.6207 767.589  29.202  778.538   33.792  735.294   58.036  27.802 0.6077 26.809 1.0824 0.9922485      1.241323  
1 1 1 3  11 13 o 9.9729 0.7705 108.083  12.354  112.015   14.007  94.309    26.219  10.512 0.6662 9.4339 1.3896 1.077923       1.541090  
1 1 1 3  11 14 o 24.989 0.6113 634.554  26.348  631.319   30.363  644.416   53.016  24.994 0.6074 24.984 1.0610 0.9826660E-02  1.222578  
1 1 1 3  11 15 o 11.832 0.6902 144.286  13.603  143.714   15.453  146.254   28.673  11.894 0.6496 11.770 1.2180 0.1240387      1.380439  
1 1 1 3  11 16 o 6.4623 0.9615 40.445   10.338  35.375    11.630  59.536    22.568  5.7288 1.0538 7.1959 1.6086 -1.467116      1.923037  
1 1 1 3  11 17 o 10.184 0.7897 110.833  14.551  112.404   17.362  107.124   26.674  10.433 0.8321 9.9356 1.3424 0.4971304      1.579318  
1 1 1 3  11 18 o 10.984 0.7688 134.248  13.718  139.335   15.647  117.356   28.517  11.661 0.6709 10.306 1.3835 1.354815       1.537563  
1 1 1 3  11 19 o 3.0674 0.8798 7.2530   6.9432  9.7314    7.3184  -15.0736  21.965  3.0719 1.0201 3.0628 1.4338 0.9118319E-02  1.759615  
1 1 1 3  11 20 o 5.2527 1.0775 27.517   9.5572  25.062    10.417  40.566    24.020  4.7517 1.1153 5.7538 1.8439 -1.002057      2.154971  
1 1 1 3  11 21 o 3.1656 0.9742 -6.1565  6.7368  -8.7941   7.0402  22.481    23.198  1.6301 0.7774 4.7011 1.7865 -3.070966      1.948346  
1 1 1 3  11 22 o 5.0183 1.1459 22.860   8.9446  21.110    9.4074  39.337    28.874  4.3677 1.0824 5.6690 2.0201 -1.301241      2.291840  
1 1 1 3  11 23 o 5.1061 1.1088 29.294   9.4405  30.073    9.9337  22.034    30.338  5.2820 0.9763 4.9301 1.9911 0.3518658      2.217570  
1 1 1 3  11 24 o 9.7162 1.0523 110.565  14.328  112.909   15.774  99.500    34.266  10.466 0.7536 8.9666 1.9650 1.499104       2.104546  
1 1 1 3  11 25 o 14.913 0.7687 227.616  18.437  221.156   20.584  253.830   41.467  14.670 0.7015 15.156 1.3680 -0.4860792     1.537381  
1 1 1 3  11 26 o 4.9190 1.2750 13.538   10.139  9.1968    10.581  62.249    35.444  3.1996 1.2088 6.6384 2.2453 -3.438829      2.549976  
1 1 1 3  11 27 f 6.5241 1.1618 50.785   10.679  50.187    11.271  56.042    33.411  6.8945 0.8174 6.1536 2.1752 0.7408929      2.323651  
1 1 1 3  11 28 o 8.7418 1.0828 100.199  17.509  76.209    27.088  117.416   22.948  7.3397 1.8468 10.144 1.1311 -2.804190      2.165661  
1 1 1 3  11 29 o 5.0054 1.2550 40.170   16.494  29.225    26.067  47.477    21.300  4.4055 1.8202 5.6053 1.7283 -1.199751      2.510002  
1 1 1 3  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  11 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  12 0  o 32.684 0.7443 1075.34  48.532  1084.09   68.266  1066.40   69.009  32.821 1.0424 32.548 1.0627 -0.000000      0.000000  
1 1 1 3  12 1  o 25.702 0.4985 662.654  25.621  676.824   36.310  648.603   36.158  25.976 0.6989 25.428 0.7110 0.5486679      0.9969932 
1 1 1 3  12 2  o 25.809 0.5007 668.300  25.838  644.049   36.388  692.961   36.695  25.336 0.7181 26.283 0.6981 -0.9468536     1.001486  
1 1 1 3  12 3  o 11.774 0.5148 139.148  12.117  144.211   17.147  134.098   17.124  11.988 0.7152 11.559 0.7407 0.4294176      1.029646  
1 1 1 3  12 4  o 9.1086 0.5597 83.325   10.195  82.989    14.396  83.663    14.441  9.0901 0.7919 9.1270 0.7911 -0.3690815E-01 1.119334  
1 1 1 3  12 5  o 7.7284 0.6037 60.045   9.3311  59.320    13.092  60.793    13.303  7.6811 0.8522 7.7757 0.8554 -0.9462547E-01 1.207481  
1 1 1 3  12 6  o 14.894 0.5003 222.846  14.894  231.548   21.090  214.189   21.036  15.185 0.6944 14.603 0.7203 0.5826006      1.000507  
1 1 1 3  12 7  o 24.370 0.5035 596.770  24.539  593.501   34.640  600.063   34.767  24.303 0.7127 24.437 0.7114 -0.1341877     1.006928  
1 1 1 3  12 8  o 13.462 0.6368 185.724  14.933  189.021   17.383  176.438   29.173  13.721 0.6335 13.203 1.1048 0.5182018      1.273523  
1 1 1 3  12 9  o 11.689 0.6908 144.919  13.640  151.601   15.776  125.136   27.143  12.284 0.6421 11.094 1.2234 1.190625       1.381659  
1 1 1 3  12 10 o 14.595 0.6506 223.711  16.192  231.487   18.750  200.906   32.111  15.167 0.6181 14.023 1.1450 1.143985       1.301163  
1 1 1 3  12 11 o 8.9877 0.8066 82.398   11.997  82.064    13.585  83.581    25.577  9.0092 0.7539 8.9662 1.4263 0.4295731E-01  1.613297  
1 1 1 3  12 12 o 11.828 0.7202 144.296  14.218  144.498   16.182  143.610   29.778  11.942 0.6775 11.713 1.2711 0.2283888      1.440394  
1 1 1 3  12 13 o 6.5799 0.9394 64.933   11.128  80.680    12.617  9.7935    23.610  8.9158 0.7076 4.2439 1.7405 4.671867       1.878817  
1 1 1 3  12 14 o 10.865 0.7477 119.074  13.516  115.828   15.266  130.848   29.074  10.657 0.7163 11.074 1.3128 -0.4171410     1.495453  
1 1 1 3  12 15 o 10.615 0.7900 118.890  13.356  119.047   14.963  118.273   29.625  10.800 0.6927 10.431 1.4200 0.3684664      1.579969  
1 1 1 3  12 16 o 3.3148 0.8992 9.7579   7.0974  12.116    7.5391  -8.6179   21.045  3.3828 1.0254 3.2468 1.4774 0.1359892      1.798372  
1 1 1 3  12 17 o 4.3934 1.0192 10.080   8.9114  3.0455    9.7781  44.569    21.650  2.6894 1.1133 6.0974 1.7075 -3.407954      2.038378  
1 1 1 3  12 18 o 3.3332 0.9599 8.1577   8.5058  10.579    9.1648  -6.8865   22.844  3.2653 1.1404 3.4012 1.5444 -0.1358736     1.919791  
1 1 1 3  12 19 o 4.2711 1.0827 14.907   9.0705  12.173    9.8507  30.147    23.256  3.4436 1.1834 5.0985 1.8134 -1.654861      2.165365  
1 1 1 3  12 20 o 4.6244 1.1010 21.305   9.8119  20.249    10.717  26.772    24.390  4.2729 1.2031 4.9759 1.8442 -0.7029481     2.201932  
1 1 1 3  12 21 o 3.4835 0.9208 11.841   6.9785  13.679    7.3278  -6.0712   22.875  3.5451 0.9936 3.4218 1.5505 0.1233792      1.841524  
1 1 1 3  12 22 o 6.3187 1.1102 52.567   11.524  56.332    12.394  28.537    31.309  7.3764 0.8401 5.2611 2.0553 2.115256       2.220405  
1 1 1 3  12 23 o 9.7897 0.8700 90.152   13.452  82.579    14.768  127.064   32.605  8.9315 0.8267 10.648 1.5310 -1.716442      1.739972  
1 1 1 3  12 24 o 5.4740 1.1033 36.591   10.794  38.777    11.521  20.900    30.870  6.0785 0.9477 4.8695 1.9928 1.209027       2.206680  
1 1 1 3  12 25 o 6.2113 1.0583 59.358   11.773  66.236    12.524  7.0658    34.531  7.9819 0.7845 4.4407 1.9658 3.541240       2.116595  
1 1 1 3  12 26 o 3.6215 1.1326 3.6240   8.0443  2.5459    8.2901  21.000    33.281  2.4632 1.0228 4.7798 2.0211 -2.316608      2.265200  
1 1 1 3  12 27 f 6.4398 1.1455 62.427   12.681  66.254    13.508  34.034    36.795  7.8607 0.8592 5.0189 2.1238 2.841882       2.291074  
1 1 1 3  12 28 o 4.2547 1.2160 16.983   10.107  15.192    10.513  38.806    36.697  3.5928 1.2228 4.9167 2.1021 -1.323890      2.431900  
1 1 1 3  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  12 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  13 0  o 10.827 1.1131 121.404  23.519  121.404   23.519  0.0000    0.0000  10.827 1.1131 10.827 1.1131 -0.000000      0.000000  
1 1 1 3  13 1  o 6.6185 0.6537 44.070   8.6415  47.179    12.352  41.088    12.094  6.8481 0.9018 6.3889 0.9465 0.4592638      1.307352  
1 1 1 3  13 2  o 13.945 0.6130 195.026  16.122  193.942   19.729  197.205   27.972  13.900 0.7097 13.990 0.9997 -0.9011841E-01 1.226020  
1 1 1 3  13 3  o 20.443 0.4970 419.749  20.313  430.813   28.632  408.537   28.823  20.716 0.6911 20.170 0.7145 0.5453777      0.9940174 
1 1 1 3  13 4  o 16.397 0.5003 270.154  16.396  258.677   23.195  281.615   23.179  16.047 0.7227 16.746 0.6921 -0.6995182     1.000629  
1 1 1 3  13 5  o 15.594 0.5087 244.412  15.860  251.756   22.422  237.059   22.436  15.829 0.7082 15.358 0.7304 0.4712954      1.017415  
1 1 1 3  13 6  o 12.118 0.5403 147.823  13.083  142.226   18.622  153.278   18.385  11.890 0.7831 12.347 0.7445 -0.4568872     1.080521  
1 1 1 3  13 7  o 14.192 0.5199 202.576  14.734  188.019   20.686  217.567   20.992  13.672 0.7565 14.712 0.7134 -1.039865      1.039873  
1 1 1 3  13 8  o 16.355 0.6231 262.628  17.791  255.094   20.498  285.634   35.819  15.930 0.6434 16.780 1.0673 -0.8500805     1.246222  
1 1 1 3  13 9  o 10.348 0.7732 110.383  13.449  111.318   15.371  107.327   27.776  10.501 0.7319 10.195 1.3623 0.3065348      1.546397  
1 1 1 3  13 10 o 15.032 0.6179 219.246  16.392  208.587   18.922  251.304   32.815  14.381 0.6579 15.684 1.0462 -1.302509      1.235817  
1 1 1 3  13 11 o 3.7671 1.0446 9.3218   9.2878  8.4347    10.241  13.434    22.048  3.2005 1.1933 4.3337 1.7150 -1.133243      2.089296  
1 1 1 3  13 12 o 14.805 0.6722 225.952  16.916  226.563   19.407  224.018   34.511  14.955 0.6489 14.655 1.1774 0.2995663      1.344396  
1 1 1 3  13 13 o 9.7065 0.7614 95.615   12.657  93.090    14.479  103.798   26.063  9.5451 0.7584 9.8680 1.3206 -0.3228970     1.522886  
1 1 1 3  13 14 o 12.572 0.7197 161.516  15.201  158.911   17.283  170.420   31.948  12.487 0.6921 12.656 1.2621 -0.1698561     1.439408  
1 1 1 3  13 15 o 13.789 0.7004 191.039  16.259  185.019   18.434  212.124   34.501  13.466 0.6845 14.113 1.2223 -0.6475382     1.400899  
1 1 1 3  13 16 o 7.3965 0.9023 46.844   11.049  37.551    12.230  88.133    25.778  5.8750 1.0806 8.9179 1.4453 -3.042906      1.804603  
1 1 1 3  13 17 o 11.927 0.8137 161.230  15.388  168.527   17.453  135.757   32.610  12.825 0.6804 11.029 1.4784 1.796325       1.627476  
1 1 1 3  13 18 o 5.2366 1.0978 31.282   10.496  31.406    11.515  30.677    25.513  5.3241 1.1171 5.1490 1.8901 0.1750445      2.195530  
1 1 1 3  13 19 o 7.2269 1.0311 55.121   11.983  52.167    13.377  67.125    26.966  7.0484 0.9489 7.4053 1.8310 -0.3568954     2.062294  
1 1 1 3  13 20 o 3.2244 0.9322 7.2864   8.3975  10.734    9.0059  -15.6754  23.242  3.2752 1.1312 3.1737 1.4821 0.1014795      1.864495  
1 1 1 3  13 21 o 8.9521 0.9442 81.974   13.247  77.144    14.747  102.157   30.146  8.6044 0.8570 9.2997 1.6828 -0.6952810     1.888403  
1 1 1 3  13 22 o 3.0304 0.9806 0.1348   7.9160  0.9148    8.2648  -8.5262   27.540  2.3659 1.0042 3.6949 1.6847 -1.329021      1.961259  
1 1 1 3  13 23 o 2.3525 0.8477 -10.4684 6.1332  -9.6878   6.2948  -25.0909  27.243  1.4654 0.7081 3.2395 1.5405 -1.774031      1.695469  
1 1 1 3  13 24 o 13.135 0.8323 179.425  17.412  175.520   19.415  195.475   39.361  13.055 0.7436 13.214 1.4894 -0.1585789     1.664675  
1 1 1 3  13 25 o 10.903 0.9453 107.356  15.685  94.903    16.974  180.122   41.031  9.4891 0.8944 12.317 1.6656 -2.828318      1.890547  
1 1 1 3  13 26 o 4.4491 1.1228 22.085   9.7225  22.920    10.182  13.454    32.721  4.4760 1.1356 4.4221 1.9372 0.5389261E-01  2.245502  
1 1 1 3  13 27 o 6.9606 1.2363 60.499   13.274  57.672    14.274  78.566    36.089  7.2060 0.9904 6.7151 2.2656 0.4908428      2.472667  
1 1 1 3  13 28 o 3.7786 1.0291 16.399   8.0001  17.441    8.1959  -4.6240   36.820  3.8367 1.0414 3.7205 1.7753 0.1162341      2.058182  
1 1 1 3  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  14 0  o 8.9340 0.9134 85.216   15.027  71.370    20.760  100.455   21.780  8.0714 1.4165 9.7965 1.1536 -0.000000      0.000000  
1 1 1 3  14 1  o 25.193 0.5083 637.797  25.609  634.787   36.066  640.858   36.370  25.134 0.7175 25.253 0.7201 -0.1194382     1.016535  
1 1 1 3  14 2  o 10.845 0.5421 118.277  11.758  118.995   16.758  117.580   16.501  10.877 0.7703 10.813 0.7630 0.6428242E-01  1.084258  
1 1 1 3  14 3  o 10.879 0.5504 119.104  11.957  110.478   16.803  127.951   17.017  10.478 0.8018 11.280 0.7543 -0.8022299     1.100873  
1 1 1 3  14 4  o 18.581 0.5045 347.020  18.746  352.277   26.568  341.807   26.453  18.722 0.7095 18.441 0.7172 0.2813187      1.008903  
1 1 1 3  14 5  o 15.612 0.5145 245.125  16.058  254.266   22.728  236.014   22.691  15.904 0.7145 15.319 0.7406 0.5844011      1.029096  
1 1 1 3  14 6  o 9.1499 0.5941 84.373   10.867  80.988    15.195  87.918    15.548  8.9614 0.8478 9.3383 0.8325 -0.3769379     1.188192  
1 1 1 3  14 7  o 6.3671 0.8648 44.496   10.314  33.981    16.583  51.130    13.171  5.6315 1.4601 7.1026 0.9272 -1.471152      1.729635  
1 1 1 3  14 8  o 13.260 0.6685 177.805  15.284  176.814   17.604  180.842   30.807  13.242 0.6647 13.279 1.1600 -0.3740215E-01 1.336946  
1 1 1 3  14 9  f 23.684 0.6110 560.076  25.340  549.928   29.325  589.990   50.347  23.354 0.6278 24.014 1.0483 -0.6599464     1.221931  
1 1 1 3  14 10 o 14.512 0.6553 215.191  16.735  214.064   19.492  218.350   32.639  14.530 0.6708 14.494 1.1260 0.3598881E-01  1.310633  
1 1 1 3  14 11 o 4.2893 1.0490 16.501   9.3419  15.043    10.468  22.205    20.702  3.8159 1.2167 4.7627 1.7091 -0.9468148     2.097950  
1 1 1 3  14 12 o 3.5607 1.0311 7.7442   9.6079  8.5905    10.553  3.6452    23.225  3.2184 1.2091 3.9030 1.6706 -0.6846104     2.062253  
1 1 1 3  14 13 o 18.033 0.6371 331.858  20.097  328.046   23.304  342.919   39.700  17.966 0.6486 18.100 1.0967 -0.1340847     1.274106  
1 1 1 3  14 14 o 19.539 0.6408 392.867  21.823  390.245   25.294  400.503   43.166  19.578 0.6460 19.500 1.1068 0.7805824E-01  1.281552  
1 1 1 3  14 15 o 5.2652 1.1405 25.733   10.725  21.530    11.815  45.413    25.567  4.4047 1.2708 6.1256 1.8943 -1.720898      2.281081  
1 1 1 3  14 16 f 6.8883 1.0030 44.419   11.350  36.886    12.667  75.088    25.559  5.7900 1.1345 7.9867 1.6545 -2.196659      2.006086  
1 1 1 3  14 17 o 6.8190 1.0498 64.996   12.287  73.854    13.829  31.796    26.773  8.4222 0.8210 5.2159 1.9324 3.206325       2.099590  
1 1 1 3  14 18 o 7.4822 1.0236 51.480   12.302  42.469    13.613  91.606    28.727  6.2049 1.1389 8.7595 1.7011 -2.554553      2.047167  
1 1 1 3  14 19 o 10.368 0.8305 108.283  14.272  102.919   16.039  128.680   31.276  9.9761 0.8039 10.759 1.4534 -0.7833757     1.660919  
1 1 1 3  14 20 o 8.2309 0.9431 68.601   12.655  63.035    14.233  89.615    27.656  7.7503 0.9182 8.7115 1.6477 -0.9611521     1.886289  
1 1 1 3  14 21 o 3.2794 1.0347 0.6646   10.242  1.3234    11.075  -3.2250   26.912  2.7256 1.1598 3.8333 1.7138 -1.107689      2.069350  
1 1 1 3  14 22 o 3.1213 0.9859 1.6553   9.5806  4.8707    10.164  -23.9500  28.683  2.8651 1.1541 3.3775 1.5987 -0.5123918     1.971767  
1 1 1 3  14 23 o 4.0988 1.0389 18.417   9.9690  22.227    10.594  -11.0636  29.467  4.4677 1.1713 3.7299 1.7162 0.7377944      2.077820  
1 1 1 3  14 24 f 25.758 0.6913 682.422  30.229  663.108   34.459  746.920   62.971  25.378 0.6789 26.139 1.2045 -0.7610207     1.382699  
1 1 1 3  14 25 o 3.3206 1.0462 5.4353   8.7864  7.3028    9.0545  -24.7088  36.378  2.9257 1.1151 3.7155 1.7706 -0.7897804     2.092463  
1 1 1 3  14 26 o 6.4770 1.2636 47.717   12.677  44.352    13.546  71.453    35.974  6.2411 1.1267 6.7128 2.2620 -0.4716907     2.527116  
1 1 1 3  14 27 o 2.9662 1.0239 -6.0661  10.199  -5.8102   10.623  -9.0818   36.467  2.2033 1.0197 3.7292 1.7759 -1.525978      2.047854  
1 1 1 3  14 28 o 3.8418 1.1600 14.462   10.096  13.477    10.463  27.764    38.451  3.3663 1.2142 4.3173 1.9769 -0.9510019     2.320005  
1 1 1 3  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  14 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  15 0  o 15.382 0.7686 241.327  23.301  217.984   32.387  266.374   33.548  14.589 1.1254 16.175 1.0471 -0.000000      0.000000  
1 1 1 3  15 1  o 16.656 0.5146 278.655  17.128  295.218   24.641  263.171   23.826  17.135 0.7190 16.176 0.7364 0.9588909      1.029241  
1 1 1 3  15 2  o 8.7193 0.6192 76.655   10.795  79.139    15.338  74.217    15.197  8.8601 0.8656 8.5786 0.8858 0.2815647      1.238451  
1 1 1 3  15 3  o 11.950 0.6691 138.796  15.097  160.900   26.900  128.633   18.241  12.601 1.0674 11.299 0.8072 1.302352       1.338232  
1 1 1 3  15 4  f 13.138 0.5445 173.937  14.298  172.211   19.807  175.815   20.662  13.072 0.7576 13.205 0.7824 -0.1326694     1.089067  
1 1 1 3  15 5  o 12.701 0.6914 157.407  16.366  147.030   19.558  181.647   29.890  12.061 0.8108 13.341 1.1202 -1.280391      1.382858  
1 1 1 3  15 6  o 8.6971 0.6310 76.625   10.964  73.383    15.096  80.245    15.949  8.5034 0.8877 8.8908 0.8970 -0.3873615     1.261943  
1 1 1 3  15 7  f 8.7435 0.9105 83.898   12.544  87.092    14.297  73.212    26.149  9.2778 0.7705 8.2091 1.6499 1.068725       1.820961  
1 1 1 3  15 8  o 9.9321 0.7742 101.561  12.988  101.473   14.847  101.849   26.803  10.003 0.7421 9.8612 1.3590 0.1417465      1.548452  
1 1 1 3  15 9  o 13.524 0.6735 182.544  15.798  176.768   18.150  200.604   32.091  13.191 0.6879 13.856 1.1580 -0.6644478     1.346960  
1 1 1 3  15 10 o 8.1609 1.0002 76.517   12.469  80.090    14.028  63.074    27.210  8.8698 0.7908 7.4519 1.8373 1.417907       2.000304  
1 1 1 3  15 11 f 9.0044 0.8294 79.148   12.798  73.666    14.519  98.254    27.105  8.4629 0.8578 9.5459 1.4197 -1.083049      1.658753  
1 1 1 3  15 12 o 4.1282 0.8867 19.388   10.165  30.923    11.419  -24.6553  22.314  5.3451 1.1047 2.9114 1.3872 2.433636       1.773342  
1 1 1 3  15 13 o 3.6365 0.9365 12.203   9.8230  19.964    10.793  -25.2299  23.704  4.2704 1.2091 3.0026 1.4304 1.267792       1.872938  
1 1 1 3  15 14 o 4.8720 1.0376 11.988   10.428  0.9743    11.625  57.366    23.597  2.7650 1.1827 6.9790 1.7051 -4.213959      2.075143  
1 1 1 3  15 15 o 9.9359 0.7813 90.125   13.834  74.086    15.801  142.770   28.627  8.4052 0.9400 11.467 1.2483 -3.061420      1.562593  
1 1 1 3  15 16 o 4.7424 1.0312 28.772   11.109  34.658    12.207  0.3984    26.801  5.5976 1.1293 3.8871 1.7258 1.710490       2.062459  
1 1 1 3  15 17 f 8.5679 1.0022 78.245   13.560  74.853    15.191  91.547    30.081  8.4527 0.8986 8.6832 1.7916 -0.2304811     2.004314  
1 1 1 3  15 18 o 7.2994 1.1063 56.988   12.641  54.557    13.931  68.321    30.077  7.2112 0.9659 7.3876 1.9907 -0.1764464     2.212695  
1 1 1 3  15 19 o 4.4737 1.0842 23.306   11.148  27.429    12.060  -0.9134   29.231  4.9429 1.2259 4.0046 1.7885 0.9383588      2.168328  
1 1 1 3  15 20 o 5.2464 1.1477 30.779   11.123  30.941    12.110  29.900    28.131  5.2790 1.1770 5.2138 1.9707 0.6524897E-01  2.295460  
1 1 1 3  15 21 o 4.2680 1.2570 20.204   11.453  20.204    11.453  0.0000    0.0000  4.2680 1.2570 ?      ?      ?              ?         
1 1 1 3  15 22 o 5.6773 1.1373 40.692   12.245  44.065    13.210  20.103    32.637  6.4550 1.0232 4.8997 2.0315 1.555331       2.274668  
1 1 1 3  15 23 o 7.2150 1.1845 51.561   13.213  46.539    14.366  79.114    33.653  6.6069 1.0872 7.8230 2.1048 -1.216107      2.368980  
1 1 1 3  15 24 o 10.401 0.9763 113.433  15.805  108.293   17.444  136.978   37.338  10.155 0.8589 10.646 1.7536 -0.4906435     1.952615  
1 1 1 3  15 25 o 7.3483 1.1640 87.882   14.957  97.932    16.182  28.959    39.183  9.6230 0.8408 5.0735 2.1708 4.549488       2.327908  
1 1 1 3  15 26 o 4.3678 1.2613 17.263   11.623  14.419    12.237  43.523    37.180  3.5763 1.3096 5.1593 2.1561 -1.582975      2.522682  
1 1 1 3  15 27 o 4.3607 1.1451 26.227   12.241  28.487    12.938  6.9630    37.782  4.7293 1.3184 3.9922 1.8725 0.7371483      2.290100  
1 1 1 3  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  15 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  16 0  o 17.765 0.7558 322.137  26.589  324.164   36.694  319.897   38.580  17.835 1.0368 17.695 1.0999 -0.000000      0.000000  
1 1 1 3  16 1  o 6.3133 0.8535 42.128   10.374  42.327    15.042  41.947    14.327  6.3212 1.2341 6.3054 1.1795 0.1582718E-01  1.707059  
1 1 1 3  16 2  o 5.5290 0.8425 33.425   9.6111  14.227    13.817  51.422    13.378  3.9438 1.3983 7.1142 0.9402 -3.170365      1.684991  
1 1 1 3  16 3  o 16.327 0.5311 269.581  17.331  279.014   24.410  259.993   24.611  16.619 0.7344 16.035 0.7674 0.5839443      1.062201  
1 1 1 3  16 4  o 6.2392 0.8121 40.651   9.8919  45.341    14.067  36.065    13.913  6.6619 1.0558 5.8165 1.2342 0.8454175      1.624163  
1 1 1 3  16 5  o 10.142 0.6078 104.464  12.319  99.800    17.435  109.114   17.408  9.9121 0.8795 10.372 0.8392 -0.4594526     1.215634  
1 1 1 3  16 6  o 12.758 0.5670 165.444  14.465  165.135   20.309  165.762   20.607  12.747 0.7966 12.768 0.8069 -0.2149391E-01 1.133917  
1 1 1 3  16 7  o 5.9729 1.0723 38.931   11.624  38.532    13.410  40.136    23.313  5.9857 1.1620 5.9601 1.8024 0.2559566E-01  2.144528  
1 1 1 3  16 8  o 16.669 0.6691 287.060  19.115  288.473   22.026  282.749   38.473  16.872 0.6527 16.466 1.1683 0.4058609      1.338247  
1 1 1 3  16 9  o 11.756 0.7435 131.153  14.969  121.002   16.939  167.348   31.986  10.896 0.7773 12.617 1.2676 -1.721204      1.486955  
1 1 1 3  16 10 o 6.1527 1.0852 40.722   11.464  39.563    12.876  45.157    25.179  6.0706 1.1010 6.2347 1.8704 -0.1640406     2.170425  
1 1 1 3  16 11 o 15.155 0.7023 232.288  18.291  225.686   20.947  253.481   37.532  14.866 0.7045 15.443 1.2152 -0.5762157     1.404662  
1 1 1 3  16 12 o 7.7758 1.0246 66.956   12.913  67.008    14.650  66.775    27.339  8.0421 0.9108 7.5095 1.8357 0.5326653      2.049282  
1 1 1 3  16 13 o 3.8845 1.0923 8.8852   10.360  5.9816    11.504  21.342    23.828  3.0732 1.2314 4.6957 1.8044 -1.622486      2.184503  
1 1 1 3  16 14 o 5.8864 1.1500 39.553   12.045  39.040    13.386  41.737    27.611  5.9441 1.1677 5.8287 1.9816 0.1153703      2.300084  
1 1 1 3  16 15 o 6.2589 1.1305 40.360   12.279  35.059    13.849  59.850    26.556  5.5751 1.2703 6.9427 1.8705 -1.367558      2.261043  
1 1 1 3  16 16 o 12.686 0.7809 163.788  16.510  156.911   18.625  189.023   35.675  12.321 0.7558 13.051 1.3668 -0.7293224     1.561861  
1 1 1 3  16 17 o 4.8281 1.1213 27.117   11.659  29.760    12.968  15.973    26.627  5.1434 1.2686 4.5129 1.8493 0.6304913      2.242582  
1 1 1 3  16 18 o 6.7524 1.1314 53.404   12.474  54.011    13.752  50.590    29.626  7.1732 0.9585 6.3316 2.0498 0.8416553      2.262852  
1 1 1 3  16 19 o 2.4343 0.8522 -11.7184 7.9992  -10.0168  8.4026  -28.1750  26.131  1.7909 0.8527 3.0776 1.4758 -1.286747      1.704436  
1 1 1 3  16 20 o 5.1716 1.2339 25.753   11.683  23.557    12.603  39.159    31.139  4.5880 1.3091 5.7551 2.0918 -1.167082      2.467700  
1 1 1 3  16 21 o 4.3498 1.1924 4.8590   11.493  -1.9150   12.433  44.651    30.134  2.6855 1.1847 6.0141 2.0697 -3.328530      2.384743  
1 1 1 3  16 22 o 4.1403 1.1997 10.850   11.992  9.2882    12.988  19.872    31.217  3.4121 1.3264 4.8685 1.9995 -1.456332      2.399442  
1 1 1 3  16 23 o 4.5563 1.1662 23.483   11.908  26.069    12.707  4.8676    34.099  4.7644 1.2982 4.3482 1.9376 0.4162345      2.332315  
1 1 1 3  16 24 o 6.6828 1.1713 62.766   13.398  67.178    14.487  36.693    35.218  7.9596 0.9100 5.4061 2.1586 2.553576       2.342580  
1 1 1 3  16 25 o 7.4240 1.2657 56.023   14.404  46.689    15.604  109.828   37.462  6.2782 1.2860 8.5699 2.1804 -2.291664      2.531373  
1 1 1 3  16 26 o 5.3303 1.0686 45.414   13.593  52.156    14.420  -8.3657   40.725  6.7847 1.0626 3.8759 1.8543 2.908795       2.137192  
1 1 1 3  16 27 o 4.8717 1.2901 33.345   13.721  30.498    14.696  52.679    38.303  4.7253 1.4315 5.0180 2.1466 -0.2926421     2.580126  
1 1 1 3  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  16 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  17 0  f 7.4291 1.2634 67.336   16.224  45.477    22.679  90.247    23.218  5.7274 2.1294 9.1307 1.3603 -0.000000      0.000000  
1 1 1 3  17 1  o 2.8588 0.8619 -0.0337  8.8115  -4.3924   12.789  3.9058    12.158  2.6619 1.1864 3.0558 1.2506 -0.3939736     1.723797  
1 1 1 3  17 2  o 15.941 0.5471 258.202  17.405  239.154   24.631  277.198   24.598  15.344 0.8026 16.538 0.7437 -1.193616      1.094221  
1 1 1 3  17 3  o 9.7363 0.6527 97.869   12.586  107.743   17.287  86.733    18.359  10.282 0.8406 9.1903 0.9988 1.092171       1.305468  
1 1 1 3  17 4  o 8.9541 0.6880 82.679   12.215  69.531    17.028  96.615    17.531  8.2017 1.0381 9.7065 0.9030 -1.504779      1.375907  
1 1 1 3  17 5  o 7.4813 0.7818 58.046   11.272  46.177    15.059  73.165    16.997  6.5519 1.1932 8.4108 1.0104 -1.858891      1.563546  
1 1 1 3  17 6  o 15.594 0.6779 254.935  18.510  260.760   21.665  239.192   35.617  16.037 0.6755 15.150 1.1755 0.8866453      1.355713  
1 1 1 3  17 7  o 6.9020 1.0032 46.248   11.772  41.512    13.352  62.779    24.947  6.3362 1.0537 7.4679 1.7074 -1.131713      2.006371  
1 1 1 3  17 8  o 8.7111 0.8194 69.939   12.832  58.828    14.755  104.415   25.992  7.5306 0.9797 9.8916 1.3138 -2.360998      1.638894  
1 1 1 3  17 9  o 9.6772 0.8485 92.274   13.980  86.774    15.842  111.632   29.721  9.1881 0.8621 10.166 1.4617 -0.9781446     1.697036  
1 1 1 3  17 10 o 6.2267 1.1435 37.095   11.937  31.698    13.225  60.825    27.731  5.3464 1.2578 7.1070 1.9100 -1.760591      2.286933  
1 1 1 3  17 11 o 12.145 0.7681 155.173  15.972  155.312   18.404  154.747   32.149  12.313 0.7473 11.976 1.3422 0.3363590      1.536214  
1 1 1 3  17 12 o 3.5750 1.0906 3.9902   10.968  3.2920    11.994  7.5571    27.109  2.9365 1.2257 4.2135 1.8042 -1.277000      2.181195  
1 1 1 3  17 13 o 13.459 0.7577 198.262  17.166  204.075   19.803  180.690   34.431  14.096 0.7025 12.822 1.3427 1.273890       1.515356  
1 1 1 3  17 14 o 3.9161 1.0996 6.3973   10.505  1.2980    11.626  29.080    24.522  2.7657 1.1829 5.0666 1.8540 -2.300897      2.199242  
1 1 1 3  17 15 o 16.513 0.7246 291.780  20.273  294.193   23.310  284.289   41.075  16.918 0.6889 16.109 1.2749 0.8089161      1.449165  
1 1 1 3  17 16 o 4.3473 0.9532 22.027   11.855  35.415    13.300  -29.7261  26.150  5.6374 1.2154 3.0573 1.4687 2.580073       1.906443  
1 1 1 3  17 17 o 14.288 0.7521 199.869  18.308  185.732   20.713  250.359   39.145  13.416 0.7720 15.161 1.2910 -1.744839      1.504186  
1 1 1 3  17 18 o 9.4459 0.9196 90.270   14.086  84.917    15.687  112.549   32.003  9.0169 0.8698 9.8749 1.6204 -0.8580265     1.839108  
1 1 1 3  17 19 o 6.7496 1.1066 63.548   13.402  72.436    14.912  26.208    30.565  8.3499 0.8929 5.1493 2.0251 3.200637       2.213237  
1 1 1 3  17 20 o 5.0125 0.9296 34.633   12.275  48.046    13.370  -37.3160  30.966  6.7634 0.9884 3.2615 1.5748 3.501875       1.859269  
1 1 1 3  17 21 o 12.754 0.9663 197.426  18.627  211.322   21.051  147.297   39.983  14.324 0.7348 11.185 1.7874 3.138820       1.932531  
1 1 1 3  17 22 o 6.0570 1.2606 38.877   13.187  35.110    14.430  57.949    32.469  5.5346 1.3218 6.5794 2.1469 -1.044791      2.521196  
1 1 1 3  17 23 o 3.5826 1.0321 10.000   11.261  16.172    12.066  -31.7255  31.371  3.8536 1.3100 3.3115 1.5954 0.5420394      2.064291  
1 1 1 3  17 24 o 4.0719 1.2389 6.5857   12.303  2.7037    13.114  35.102    35.542  2.9282 1.2544 5.2156 2.1368 -2.287362      2.477814  
1 1 1 3  17 25 o 6.3736 1.3464 44.863   14.178  37.020    15.315  91.892    37.502  5.4235 1.4017 7.3237 2.2991 -1.900215      2.692713  
1 1 1 3  17 26 o 3.9972 1.2445 3.2763   12.464  -3.8256   13.236  58.945    37.056  2.5247 1.1574 5.4696 2.2035 -2.944889      2.488981  
1 1 1 3  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  17 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  18 0  o 7.0290 1.3789 62.275   17.054  78.694    24.811  47.568    23.482  8.2537 1.7021 5.8042 2.1698 -0.000000      0.000000  
1 1 1 3  18 1  o 3.3718 0.9084 5.1247   9.5649  -8.0278   13.655  17.794    13.402  2.5837 1.1812 4.1599 1.3804 -1.576136      1.816799  
1 1 1 3  18 2  o 4.8182 0.9715 24.058   10.853  39.462    15.388  8.8122    15.309  6.0177 1.3153 3.6186 1.4300 2.399088       1.942912  
1 1 1 3  18 3  o 14.801 0.5684 223.285  16.814  227.310   23.510  219.070   24.057  14.943 0.7866 14.658 0.8206 0.2847567      1.136754  
1 1 1 3  18 4  o 10.970 0.6410 123.181  14.058  118.735   19.574  127.918   20.204  10.765 0.9091 11.175 0.9040 -0.4100103     1.282078  
1 1 1 3  18 5  o 21.885 0.5349 488.640  23.414  487.140   33.041  490.152   33.185  21.852 0.7560 21.919 0.7570 -0.6689644E-01 1.069873  
1 1 1 3  18 6  f 13.584 0.7303 194.927  17.247  198.080   20.092  186.097   33.623  13.934 0.7209 13.234 1.2703 0.7001371      1.460623  
1 1 1 3  18 7  o 7.9090 1.0570 79.149   13.463  88.580    15.485  49.956    27.245  9.2924 0.8332 6.5256 1.9429 2.766793       2.114035  
1 1 1 3  18 8  o 7.5223 0.9858 50.364   13.016  37.747    14.812  93.113    27.266  5.8291 1.3033 9.2155 1.4793 -3.386436      1.971538  
1 1 1 3  18 9  o 7.9110 1.0958 75.350   13.545  79.124    15.204  60.836    29.814  8.7528 0.8685 7.0692 2.0122 1.683575       2.191678  
1 1 1 3  18 10 o 7.1477 1.1032 59.931   13.509  62.154    15.445  52.692    27.867  7.7089 1.0017 6.5864 1.9659 1.122519       2.206373  
1 1 1 3  18 11 o 4.1715 1.1509 11.654   15.872  28.359    19.924  -17.3539  26.256  4.9869 1.6834 3.3561 1.5700 1.630747       2.301881  
1 1 1 3  18 12 f 6.3105 1.1694 41.222   12.949  35.794    14.625  60.926    27.865  5.6238 1.3225 6.9972 1.9290 -1.373486      2.338770  
1 1 1 3  18 13 o 7.8231 1.1064 76.425   14.090  81.052    16.040  60.790    29.484  8.7864 0.9128 6.8598 2.0157 1.926609       2.212770  
1 1 1 3  18 14 o 5.3070 1.2322 31.235   12.917  30.211    14.284  35.828    30.259  5.1280 1.3676 5.4861 2.0501 -0.3581271     2.464349  
1 1 1 3  18 15 o 17.917 0.6938 328.472  21.553  319.200   24.803  357.055   43.549  17.631 0.7034 18.203 1.1962 -0.5716362     1.387697  
1 1 1 3  18 16 o 4.9058 1.1358 28.880   12.365  32.966    13.668  10.453    29.023  5.4117 1.2824 4.3998 1.8750 1.011827       2.271609  
1 1 1 3  18 17 o 14.737 0.8065 245.051  19.677  256.295   22.681  210.828   39.569  15.771 0.7191 13.703 1.4438 2.067836       1.612959  
1 1 1 3  18 18 o 11.110 0.9158 133.797  17.471  134.159   20.208  132.726   34.767  11.364 0.8892 10.856 1.6012 0.5075541      1.831553  
1 1 1 3  18 19 o 14.361 0.7761 208.402  18.904  199.178   21.463  240.309   39.919  13.900 0.7720 14.822 1.3466 -0.9219055     1.552222  
1 1 1 3  18 20 o 5.0650 1.2258 27.723   12.678  27.273    13.943  29.867    30.463  4.8901 1.3706 5.2400 2.0328 -0.3499227     2.451697  
1 1 1 3  18 21 o 5.4402 1.0745 40.264   14.044  50.921    15.455  -10.2349  33.641  6.8953 1.1207 3.9852 1.8337 2.910172       2.149048  
1 1 1 3  18 22 o 6.0408 1.3400 42.123   15.766  42.123    15.766  0.0000    0.0000  6.0408 1.3400 ?      ?      ?              ?         
1 1 1 3  18 23 o 5.1322 1.3090 22.095   13.520  14.706    14.749  60.982    33.834  3.7977 1.4289 6.4667 2.1936 -2.669034      2.617953  
1 1 1 3  18 24 o 5.3297 1.3378 33.840   14.249  28.668    15.527  61.440    35.869  4.7188 1.4790 5.9405 2.2296 -1.221690      2.675573  
1 1 1 3  18 25 o 3.6431 1.1886 -1.2587  12.162  -6.0348   12.877  38.199    37.011  2.4209 1.1212 4.8653 2.0962 -2.444377      2.377233  
1 1 1 3  18 26 o 4.6290 1.2994 28.941   14.184  25.188    15.271  52.510    38.272  4.2656 1.4730 4.9924 2.1409 -0.7267661     2.598744  
1 1 1 3  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  18 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  19 0  o 2.3892 1.1028 -3.3644  13.310  7.2576    18.925  -13.7611  18.724  2.7872 1.7224 1.9912 1.3776 -0.000000      0.000000  
1 1 1 3  19 1  o 8.6315 0.7594 77.999   13.073  84.172    18.437  71.757    18.539  8.9922 1.0251 8.2708 1.1208 0.7213402      1.518894  
1 1 1 3  19 2  o 12.152 0.6138 151.946  14.916  153.631   21.066  150.252   21.123  12.222 0.8618 12.082 0.8742 0.1399755      1.227546  
1 1 1 3  19 3  o 4.6985 1.0309 23.809   10.890  29.752    15.432  17.915    15.369  5.1740 1.4390 4.2229 1.4766 0.9511070      2.061830  
1 1 1 3  19 4  o 20.969 0.5420 449.495  22.697  419.878   31.940  479.709   32.260  20.258 0.7883 21.680 0.7440 -1.422081      1.083972  
1 1 1 3  19 5  o 6.1712 1.1012 44.188   12.597  46.448    14.426  36.935    25.844  6.6556 1.0838 5.6869 1.9173 0.9687195      2.202371  
1 1 1 3  19 6  o 4.3564 1.0725 20.339   12.047  27.225    14.066  1.3769    23.341  4.9316 1.3746 3.7811 1.6468 1.150516       2.145080  
1 1 1 3  19 7  o 12.375 0.8132 173.848  16.893  187.092   19.744  137.652   32.640  13.522 0.7300 11.228 1.4534 2.294057       1.626481  
1 1 1 3  19 8  o 5.0762 1.2209 25.314   12.866  22.101    14.555  36.792    27.511  4.4948 1.4348 5.6576 1.9758 -1.162843      2.441828  
1 1 1 3  19 9  o 9.0006 1.0033 94.312   14.407  98.287    16.559  81.931    29.226  9.7356 0.8504 8.2656 1.8174 1.469975       2.006526  
1 1 1 3  19 10 o 6.0107 1.2036 39.549   13.126  36.561    14.774  50.744    28.597  5.6785 1.3251 6.3428 2.0097 -0.6642737     2.407243  
1 1 1 3  19 11 o 9.6640 0.8745 94.352   14.936  87.193    17.212  116.183   30.057  9.1236 0.9433 10.204 1.4728 -1.080789      1.748932  
1 1 1 3  19 12 f 10.246 0.9308 108.691  16.373  101.828   18.656  131.706   34.162  9.8230 0.9496 10.668 1.6011 -0.8451214     1.861552  
1 1 1 3  19 13 o 4.3959 1.1828 17.246   12.283  14.861    13.816  26.242    26.834  3.8418 1.3938 4.9499 1.9113 -1.108052      2.365579  
1 1 1 3  19 14 o 13.730 0.7877 197.314  18.576  193.813   21.353  208.209   37.673  13.701 0.7792 13.758 1.3692 -0.5615139E-01 1.575370  
1 1 1 3  19 15 o 4.9070 1.2495 24.052   13.120  22.463    14.513  31.156    30.681  4.4868 1.4328 5.3272 2.0474 -0.8403625     2.498933  
1 1 1 3  19 16 o 5.3659 1.1667 18.495   12.678  5.9070    14.142  70.031    28.613  3.2598 1.3431 7.4720 1.9080 -4.212122      2.333346  
1 1 1 3  19 17 o 4.1824 1.2209 6.1089   12.699  1.4640    13.864  30.303    31.641  3.0119 1.2900 5.3530 2.0731 -2.341171      2.441712  
1 1 1 3  19 18 o 9.9705 0.9692 96.537   15.935  87.594    17.740  133.882   36.254  9.1371 0.9708 10.804 1.6778 -1.666827      1.938410  
1 1 1 3  19 19 o 16.170 0.7904 286.419  21.438  293.517   24.670  264.524   43.327  16.887 0.7304 15.452 1.4019 1.434559       1.580826  
1 1 1 3  19 20 o 16.392 0.7560 267.454  21.323  251.508   24.288  321.066   44.534  15.612 0.7779 17.173 1.2966 -1.561174      1.512058  
1 1 1 3  19 21 o 5.6784 1.2352 42.326   14.693  46.226    16.199  24.233    34.890  6.3545 1.3179 5.0024 2.0895 1.352162       2.470358  
1 1 1 3  19 22 o 3.7871 1.1968 -0.1533  13.000  -3.9336   14.032  22.751    34.541  2.7128 1.2231 4.8615 2.0575 -2.148670      2.393638  
1 1 1 3  19 23 o 5.3586 1.0262 44.728   13.515  54.245    14.395  -26.0721  39.263  7.0292 1.0239 3.6880 1.7788 3.341226       2.052440  
1 1 1 3  19 24 o 4.0280 1.1109 19.698   13.379  26.100    14.344  -23.1759  37.117  4.5309 1.4218 3.5251 1.7073 1.005774       2.221812  
1 1 1 3  19 25 o 3.1339 1.1087 -18.8570 11.726  -23.6406  12.275  31.072    39.657  1.8165 0.9000 4.4512 2.0264 -2.634680      2.217311  
1 1 1 3  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  19 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  20 0  o 4.2638 1.4541 27.313   16.854  44.208    23.029  7.8263    24.733  5.4617 2.1782 3.0659 1.9269 -0.000000      0.000000  
1 1 1 3  20 1  o 2.2347 0.7595 -18.8983 9.9155  -20.2722  13.983  -17.5088  14.062  2.1908 1.0579 2.2785 1.0900 -0.8774948E-01 1.518919  
1 1 1 3  20 2  o 12.695 0.6181 166.870  15.668  176.079   22.042  157.463   22.277  13.063 0.8437 12.326 0.9037 0.7378054      1.236265  
1 1 1 3  20 3  o 7.3999 0.9482 62.060   13.316  80.552    18.422  41.827    19.270  8.7652 1.0509 6.0346 1.5786 2.730563       1.896355  
1 1 1 3  20 4  o 10.281 0.6350 107.846  12.946  90.902    17.268  129.589   19.562  9.3628 0.9222 11.200 0.8733 -1.836784      1.270084  
1 1 1 3  20 5  o 5.4071 1.2142 27.984   13.558  20.206    15.808  49.624    26.369  4.3774 1.4994 6.4369 1.9102 -2.059557      2.428415  
1 1 1 3  20 6  o 15.969 0.7014 267.372  19.657  268.127   22.937  265.284   38.142  16.184 0.7086 15.753 1.2106 0.4313498      1.402764  
1 1 1 3  20 7  o 7.3273 1.1122 58.335   14.079  55.108    16.132  68.648    28.840  7.1914 1.1216 7.4631 1.9209 -0.2716851     2.224373  
1 1 1 3  20 8  o 8.2756 0.9585 67.908   14.566  57.577    17.025  96.128    28.138  7.3200 1.1629 9.2313 1.5241 -1.911301      1.917070  
1 1 1 3  20 9  o 8.5037 0.9949 79.217   14.106  77.703    16.240  83.868    28.468  8.6139 0.9427 8.3935 1.7524 0.2204113      1.989858  
1 1 1 3  20 10 o 8.3829 1.0462 78.116   14.897  75.857    17.251  84.743    29.543  8.4529 1.0204 8.3128 1.8268 0.1401129      2.092453  
1 1 1 3  20 11 o 3.3175 1.0492 -0.0520  12.229  1.9708    13.736  -7.7825   26.854  3.0031 1.2851 3.6320 1.6589 -0.6288919     2.098452  
1 1 1 3  20 12 o 5.5996 1.2878 28.304   14.107  19.653    15.772  62.913    31.547  4.2676 1.4957 6.9316 2.0968 -2.663949      2.575589  
1 1 1 3  20 13 o 10.525 1.0139 131.813  16.573  139.656   19.024  107.121   33.756  11.615 0.8190 9.4349 1.8550 2.179626       2.027772  
1 1 1 3  20 14 o 3.5694 1.0018 8.2789   11.824  18.401    12.905  -44.6651  29.515  4.1164 1.3540 3.0224 1.4769 1.093985       2.003641  
1 1 1 3  20 15 o 6.1358 1.2540 46.131   14.763  47.083    16.625  42.581    32.105  6.4403 1.3346 5.8314 2.1233 0.6089487      2.507915  
1 1 1 3  20 16 f 5.3808 1.3095 23.748   14.517  15.415    16.217  57.344    32.562  4.0290 1.5017 6.7327 2.1458 -2.703673      2.619069  
1 1 1 3  20 17 o 5.0137 1.2789 23.972   13.843  20.498    15.469  37.941    31.017  4.3534 1.4832 5.6741 2.0839 -1.320699      2.557820  
1 1 1 3  20 18 o 6.8771 1.2113 49.385   14.110  43.710    15.790  71.878    31.438  6.2326 1.3084 7.5215 2.0388 -1.288840      2.422535  
1 1 1 3  20 19 o 4.8433 1.1691 27.968   13.834  34.513    15.195  -3.7352   33.440  5.5064 1.3819 4.1801 1.8861 1.326298       2.338196  
1 1 1 3  20 20 o 7.1688 1.2301 64.728   15.685  66.714    17.741  57.619    33.567  7.8465 1.1305 6.4911 2.1851 1.355402       2.460186  
1 1 1 3  20 21 o 11.788 0.9675 154.385  18.611  152.281   21.041  161.950   39.893  12.017 0.8755 11.559 1.7257 0.4575748      1.935044  
1 1 1 3  20 22 o 5.1280 1.2600 34.793   15.033  37.711    16.549  21.026    35.949  5.5449 1.4689 4.7110 2.0477 0.8338943      2.520077  
1 1 1 3  20 23 o 6.0640 1.3865 39.555   15.481  28.307    16.984  94.806    37.641  4.6552 1.5543 7.4729 2.2964 -2.817702      2.772974  
1 1 1 3  20 24 o 6.4620 1.1907 72.822   16.495  79.035    17.775  34.286    44.268  8.2763 1.0739 4.6478 2.1256 3.628516       2.381470  
1 1 1 3  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  20 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  21 0  o 5.2264 1.3166 37.917   18.058  -0.7241   26.561  71.130    24.625  2.8297 1.8593 7.6231 1.8647 -0.000000      0.000000  
1 1 1 3  21 1  o 9.2409 0.7712 89.966   14.231  95.098    20.853  85.492    19.470  9.4828 1.0995 8.9989 1.0818 0.4838715      1.542479  
1 1 1 3  21 2  o 9.0320 0.7944 86.765   14.210  72.592    19.843  101.684   20.358  8.2337 1.2050 9.8302 1.0355 -1.596527      1.588770  
1 1 1 3  21 3  o 8.8930 0.7710 83.810   13.707  80.445    19.153  87.344    19.626  8.7056 1.1000 9.0803 1.0807 -0.3747597     1.542068  
1 1 1 3  21 4  o 4.8412 1.2027 23.957   12.704  22.021    14.426  30.644    26.815  4.4513 1.4292 5.2312 1.9348 -0.7799211     2.405411  
1 1 1 3  21 5  o 7.9030 1.0613 67.963   14.668  64.135    17.108  78.588    28.500  7.7535 1.1032 8.0525 1.8133 -0.2990031     2.122513  
1 1 1 3  21 6  o 13.296 0.7864 188.454  18.033  188.315   20.862  188.863   35.860  13.504 0.7724 13.088 1.3700 0.4167252      1.572763  
1 1 1 3  21 7  o 9.1015 1.0470 97.780   15.931  103.423   18.759  83.177    30.175  9.9369 0.9439 8.2660 1.8691 1.670851       2.093910  
1 1 1 3  21 8  o 7.7988 1.1710 78.486   15.459  84.718    17.676  58.217    31.877  8.9487 0.9876 6.6489 2.1235 2.299817       2.341933  
1 1 1 3  21 9  o 8.8627 1.0220 88.788   15.100  88.565    17.478  89.443    29.980  9.1660 0.9534 8.5594 1.8080 0.6065502      2.043966  
1 1 1 3  21 10 o 5.3252 1.0779 37.584   14.195  51.138    16.503  -0.9723   27.834  6.7519 1.2687 3.8984 1.7429 2.853480       2.155727  
1 1 1 3  21 11 o 12.186 0.8997 167.814  18.360  174.569   21.240  147.855   36.512  12.979 0.8183 11.392 1.6025 1.586756       1.799314  
1 1 1 3  21 12 o 10.365 1.0209 122.564  17.116  125.236   19.711  114.374   34.509  10.959 0.8993 9.7715 1.8331 1.187308       2.041865  
1 1 1 3  21 13 o 7.1173 1.2105 65.194   15.246  69.666    17.117  48.029    33.534  8.0974 1.0569 6.1373 2.1781 1.960067       2.421003  
1 1 1 3  21 14 o 3.5475 1.1241 -4.3335  13.412  -8.7002   15.102  11.973    29.183  2.6626 1.2264 4.4324 1.8843 -1.769815      2.248287  
1 1 1 3  21 15 o 5.0471 1.1214 32.134   14.243  42.456    15.788  -12.9823  33.008  6.1604 1.3211 3.9338 1.8124 2.226617       2.242785  
1 1 1 3  21 16 o 7.0601 1.2098 59.275   15.414  60.451    17.656  55.505    31.607  7.5108 1.1753 6.6093 2.1149 0.9014845      2.419530  
1 1 1 3  21 17 o 11.972 0.9097 151.611  18.623  147.236   21.330  165.640   38.196  11.875 0.8981 12.070 1.5823 -0.1951151     1.819407  
1 1 1 3  21 18 o 7.1967 1.3327 56.586   16.274  51.920    18.068  76.642    37.459  6.7823 1.3790 7.6112 2.2809 -0.8289247     2.665349  
1 1 1 3  21 19 o 15.737 0.9847 278.257  30.929  255.620   42.793  303.016   44.754  15.029 1.4237 16.446 1.3606 -1.417227      1.969323  
1 1 1 3  21 20 o 7.9582 1.3186 88.116   19.876  97.679    23.228  61.970    38.407  9.3915 1.2367 6.5248 2.3293 2.866682       2.637271  
1 1 1 3  21 21 o 3.4783 1.0024 5.4742   13.211  19.894    14.533  -63.1263  31.700  4.1536 1.4369 2.8030 1.3982 1.350550       2.004853  
1 1 1 3  21 22 o 7.6018 1.3074 85.015   17.059  86.220    18.800  79.397    40.594  8.7306 1.0767 6.4730 2.3829 2.257618       2.614895  
1 1 1 3  21 23 o 5.4812 1.3235 46.192   15.989  46.181    17.236  46.261    42.811  5.9408 1.4609 5.0215 2.2074 0.9192972      2.647007  
1 1 1 3  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  21 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  22 0  o 5.6060 1.7319 50.513   20.268  46.443    28.224  54.846    29.125  5.3102 2.4334 5.9018 2.4652 -0.000000      0.000000  
1 1 1 3  22 1  o 10.640 0.7250 119.799  15.396  122.021   21.227  117.333   22.363  10.766 0.9858 10.514 1.0635 0.2518272      1.450100  
1 1 1 3  22 2  o 4.9125 1.0641 25.459   12.684  43.762    18.354  8.7264    17.550  6.1435 1.5055 3.6816 1.5041 2.461867       2.128177  
1 1 1 3  22 3  o 7.2730 0.8941 58.696   12.527  69.419    17.589  47.660    17.844  8.0816 1.0882 6.4644 1.4191 1.617196       1.788293  
1 1 1 3  22 4  o 10.088 1.0135 120.357  16.532  127.703   19.272  99.886    32.170  11.075 0.8701 9.1012 1.8308 1.973783       2.027005  
1 1 1 3  22 5  o 4.2740 1.1567 18.149   13.480  21.981    15.750  7.6543    26.064  4.4419 1.4967 4.1061 1.7640 0.3358536      2.313411  
1 1 1 3  22 6  o 10.509 0.9360 120.441  16.752  118.806   19.245  125.551   34.033  10.636 0.9047 10.383 1.6389 0.2535448      1.872028  
1 1 1 3  22 7  o 4.1470 1.1633 14.884   13.174  15.123    15.281  14.194    25.998  3.9257 1.4588 4.3683 1.8124 -0.4426918     2.326562  
1 1 1 3  22 8  o 14.057 0.8139 211.941  19.820  210.822   22.968  215.205   39.226  14.247 0.8061 13.868 1.4143 0.3791199      1.627848  
1 1 1 3  22 9  o 4.0195 1.1543 9.6899   12.781  5.8426    14.717  21.494    25.778  3.3138 1.3683 4.7252 1.8593 -1.411409      2.308539  
1 1 1 3  22 10 o 13.450 0.8235 189.325  19.339  184.591   22.377  203.293   38.440  13.342 0.8386 13.559 1.4175 -0.2172718     1.646992  
1 1 1 3  22 11 o 9.2036 1.0740 99.228   16.617  103.203   19.521  88.770    31.663  9.9022 0.9857 8.5050 1.9084 1.397193       2.147900  
1 1 1 3  22 12 o 5.1834 1.3286 27.069   15.536  22.186    17.707  43.402    32.383  4.4955 1.5841 5.8713 2.1333 -1.375748      2.657166  
1 1 1 3  22 13 o 7.0505 1.2211 62.195   16.288  66.982    18.973  48.781    31.760  7.8842 1.2032 6.2167 2.1253 1.667509       2.442224  
1 1 1 3  22 14 o 12.440 0.8932 156.788  19.357  146.487   22.178  189.740   39.666  11.845 0.9362 13.036 1.5214 -1.191154      1.786388  
1 1 1 3  22 15 o 9.7612 1.2409 131.407  17.962  145.748   20.250  78.486    38.900  11.852 0.8543 7.6703 2.3302 4.181722       2.481825  
1 1 1 3  22 16 o 5.0430 1.1757 31.417   15.157  41.329    17.230  -2.5192   31.880  5.9813 1.4544 4.1046 1.8478 1.876637       2.351492  
1 1 1 3  22 17 o 3.8594 1.2076 -11.8444 14.251  -20.5596  15.672  29.808    34.260  2.3562 1.1332 5.3625 2.1329 -3.006311      2.415228  
1 1 1 3  22 18 o 7.1699 1.2702 49.835   16.380  34.011    18.622  103.952   34.437  5.3153 1.6117 9.0245 1.9638 -3.709224      2.540428  
1 1 1 3  22 19 f 3.6798 1.1599 3.3724   15.112  7.3827    16.774  -13.9049  34.816  3.4936 1.4531 3.8661 1.8083 -0.3725464     2.319821  
1 1 1 3  22 20 o 4.2551 1.1819 19.332   15.355  27.455    17.188  -12.7903  34.179  4.7364 1.5628 3.7737 1.7736 0.9626412      2.363869  
1 1 1 3  22 21 f 4.7005 1.3544 22.218   15.757  15.027    17.296  57.327    38.216  3.7620 1.5090 5.6389 2.2495 -1.876931      2.708766  
1 1 1 3  22 22 f 4.6721 1.4131 25.093   22.893  6.1564    28.470  59.743    38.512  3.7557 1.7126 5.5885 2.2481 -1.832721      2.826128  
1 1 1 3  22 23 o 3.4628 1.1232 7.0925   14.443  8.2111    15.669  0.7714    37.249  3.2026 1.3716 3.7231 1.7790 -0.5204828     2.246338  
1 1 1 3  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  22 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  22 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  23 0  o 14.087 0.9773 216.313  26.603  192.354   38.199  238.876   37.071  13.216 1.4944 14.957 1.2598 -0.000000      0.000000  
1 1 1 3  23 1  o 3.4887 1.0358 4.4311   12.545  12.672    17.859  -3.5957   17.625  3.8902 1.5422 3.0871 1.3831 0.8030427      2.071562  
1 1 1 3  23 2  o 10.980 0.7011 126.822  15.347  117.314   20.728  138.361   22.834  10.532 0.9840 11.428 0.9990 -0.8962612     1.402244  
1 1 1 3  23 3  o 3.5981 1.1008 -3.5618  13.745  -13.3315  16.418  19.324    25.129  2.6318 1.2344 4.5644 1.8231 -1.932637      2.201685  
1 1 1 3  23 4  o 4.0429 1.1762 12.299   13.865  14.038    15.798  6.4708    28.927  3.8762 1.4740 4.2096 1.8333 -0.3334212     2.352402  
1 1 1 3  23 5  o 10.221 0.9061 107.993  17.201  97.414    20.435  133.707   31.860  9.5502 1.0698 10.891 1.4627 -1.340911      1.812168  
1 1 1 3  23 6  f 5.4812 1.2636 31.662   14.192  26.327    16.319  48.216    28.746  4.7921 1.5182 6.1703 2.0204 -1.378195      2.527226  
1 1 1 3  23 7  o 5.1785 1.2583 26.213   14.616  18.523    17.233  45.928    27.592  4.2618 1.5551 6.0952 1.9786 -1.833458      2.516578  
1 1 1 3  23 8  o 5.9966 1.1383 47.259   15.609  60.038    18.263  12.617    30.069  7.4589 1.2242 4.5342 1.9194 2.924631       2.276597  
1 1 1 3  23 9  o 6.1384 1.1247 50.589   15.977  66.280    18.805  9.8846    30.289  7.8426 1.1989 4.4341 1.9032 3.408437       2.249321  
1 1 1 3  23 10 o 3.4800 1.0949 -10.3307 13.385  -19.5727  15.371  18.665    27.225  2.3418 1.1253 4.6182 1.8786 -2.276363      2.189857  
1 1 1 3  23 11 o 3.9257 1.1740 4.1734   14.688  -2.7791   17.460  20.999    27.162  3.1178 1.3881 4.7336 1.8937 -1.615810      2.347996  
1 1 1 3  23 12 o 8.7693 1.1962 86.115   17.556  83.646    20.077  94.134    36.184  8.8723 1.1315 8.6663 2.1079 0.2059555      2.392336  
1 1 1 3  23 13 o 7.5227 1.2394 66.347   16.725  65.966    19.336  67.480    33.330  7.8142 1.2372 7.2312 2.1480 0.5829916      2.478869  
1 1 1 3  23 14 o 15.036 0.8341 233.583  21.639  224.925   24.819  261.026   44.189  14.727 0.8427 15.346 1.4398 -0.6191750     1.668242  
1 1 1 3  23 15 o 14.257 0.8540 215.505  20.964  211.339   24.137  228.301   42.301  14.255 0.8466 14.259 1.4834 -0.3718376E-02 1.707945  
1 1 1 3  23 16 o 10.754 1.1533 138.152  19.991  143.656   23.141  121.968   39.684  11.675 0.9910 9.8320 2.0829 1.843144       2.306642  
1 1 1 3  23 17 o 7.3546 1.3454 64.853   17.728  60.693    20.222  78.663    36.846  7.2183 1.4511 7.4910 2.2661 -0.2727275     2.690878  
1 1 1 3  23 18 o 5.4951 1.1679 42.360   17.262  58.344    19.450  -16.9248  37.458  7.0612 1.4263 3.9290 1.8497 3.132169       2.335767  
1 1 1 3  23 19 o 3.8753 1.2310 3.5791   17.154  1.7633    19.599  9.5245    35.464  3.3713 1.4873 4.3793 1.9619 -1.007978      2.461943  
1 1 1 3  23 20 o 4.9227 1.3577 32.293   17.016  28.720    19.208  45.321    36.680  4.6241 1.6477 5.2212 2.1584 -0.5970473     2.715374  
1 1 1 3  23 21 o 3.5457 1.1679 1.5633   16.298  1.6245    17.972  1.2801    38.674  3.1259 1.3988 3.9654 1.8707 -0.8395500     2.335831  
1 1 1 3  23 22 o 2.7699 0.9605 -16.4502 14.842  -11.0881  16.362  -41.3517  35.259  2.5117 1.1943 3.0281 1.5045 -0.5164003     1.920921  
1 1 1 3  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  23 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  24 0  o 5.0437 1.7219 43.062   20.307  40.161    29.818  45.572    27.732  4.8241 2.4580 5.2634 2.4121 -0.000000      0.000000  
1 1 1 3  24 1  o 4.6072 1.1394 23.132   13.007  26.727    18.470  19.594    18.321  4.8511 1.6209 4.3632 1.6017 0.4878840      2.278767  
1 1 1 3  24 2  o 7.3516 1.1725 76.018   17.145  94.011    20.198  29.627    32.432  9.4087 1.0734 5.2945 2.0848 4.114228       2.344915  
1 1 1 3  24 3  o 4.5127 1.1293 21.317   14.542  33.691    17.223  -9.4124   27.142  5.3891 1.5278 3.6362 1.6635 1.752918       2.258636  
1 1 1 3  24 4  o 4.2977 0.9439 15.151   13.713  40.178    15.773  -62.3236  27.752  5.9568 1.3546 2.6386 1.3149 3.318140       1.887815  
1 1 1 3  24 5  o 9.5979 0.9863 95.297   17.191  87.013    20.120  117.697   33.085  9.0364 1.1133 10.159 1.6283 -1.123012      1.972500  
1 1 1 3  24 6  o 5.7729 1.2189 41.942   14.981  46.976    17.323  27.008    29.838  6.4301 1.3877 5.1156 2.0043 1.314484       2.437810  
1 1 1 3  24 7  o 10.752 0.9699 128.106  17.910  128.807   20.762  126.065   35.406  11.082 0.9368 10.421 1.6987 0.6602755      1.939875  
1 1 1 3  24 8  o 3.9840 1.1136 11.066   14.929  24.639    17.328  -28.0311  29.409  4.6628 1.5699 3.3052 1.5797 1.357548       2.227176  
1 1 1 3  24 9  o 5.7573 1.3120 36.129   15.532  30.455    18.013  52.578    30.668  5.1122 1.5915 6.4024 2.0864 -1.290150      2.624099  
1 1 1 3  24 10 o 10.103 1.1316 124.022  18.202  132.527   21.082  99.121    36.075  11.271 0.9352 8.9348 2.0608 2.336339       2.263102  
1 1 1 3  24 11 o 10.095 1.1626 129.380  18.687  143.208   21.844  91.648    36.084  11.706 0.9330 8.4832 2.1299 3.222771       2.325295  
1 1 1 3  24 12 o 8.3490 1.2249 91.029   17.582  101.006   20.389  62.090    34.725  9.7804 1.0424 6.9175 2.2171 2.862846       2.449869  
1 1 1 3  24 13 o 12.599 0.9194 164.763  20.315  155.690   23.421  192.332   40.824  12.174 0.9619 13.024 1.5672 -0.8497562     1.838851  
1 1 1 3  24 14 o 8.5085 1.2203 82.690   18.053  80.121    20.961  90.071    35.529  8.6186 1.2160 8.3983 2.1161 0.2202797      2.440648  
1 1 1 3  24 15 o 17.198 0.8846 345.323  25.155  369.012   29.231  277.696   49.388  18.872 0.7744 15.524 1.5907 3.347986       1.769192  
1 1 1 3  24 16 o 6.0298 1.3235 48.943   17.914  55.219    20.911  31.629    34.730  6.7871 1.5715 5.2725 2.1300 1.514594       2.646953  
1 1 1 3  24 17 o 4.4939 1.2534 21.034   17.103  29.385    19.486  -6.9817   35.690  4.9324 1.6648 4.0555 1.8742 0.8768129      2.506809  
1 1 1 3  24 18 o 6.0802 1.3821 52.665   18.538  55.520    20.902  42.147    40.125  6.6732 1.5889 5.4871 2.2618 1.186080       2.764166  
1 1 1 3  24 19 o 8.3962 1.3044 112.379  19.322  122.029   21.902  78.504    41.035  10.406 1.0523 6.3862 2.3871 4.020004       2.608800  
1 1 1 3  24 20 f 4.2646 1.2946 20.096   16.391  18.967    17.858  26.128    41.285  3.9692 1.5518 4.5599 2.0727 -0.5906870     2.589277  
1 1 1 3  24 21 o 3.8004 1.1873 15.171   15.937  17.022    17.587  6.6753    37.683  3.7383 1.5138 3.8624 1.8294 -0.1240685     2.374551  
1 1 1 3  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  24 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 0  o 15.117 0.9661 245.087  28.650  251.684   41.217  238.920   39.853  15.314 1.3710 14.920 1.3617 -0.000000      0.000000  
1 1 1 3  25 1  o 10.729 0.9132 121.707  17.948  115.963   21.301  135.766   33.325  10.477 1.0166 10.982 1.5173 -0.5048428     1.826337  
1 1 1 3  25 2  o 6.5212 1.3061 41.645   16.447  27.686    18.991  83.525    32.894  4.9193 1.6436 8.1231 2.0303 -3.203866      2.612197  
1 1 1 3  25 3  o 9.0955 1.1252 94.128   17.715  92.555    20.806  98.272    33.776  9.2981 1.1188 8.8928 1.9525 0.4052734      2.250375  
1 1 1 3  25 4  o 4.0525 1.2013 5.4552   14.287  -0.9273   16.364  25.918    29.300  3.0974 1.3631 5.0076 1.9785 -1.910205      2.402588  
1 1 1 3  25 5  o 9.8348 1.1167 112.303  18.554  113.301   21.720  109.609   35.693  10.313 1.0530 9.3564 1.9697 0.9567080      2.233493  
1 1 1 3  25 6  o 5.5844 1.2994 37.440   15.903  38.420    18.512  34.678    31.070  5.7060 1.5719 5.4627 2.0696 0.2433000      2.598867  
1 1 1 3  25 7  o 8.4633 1.1650 73.136   16.904  62.075    19.343  108.877   34.770  7.4474 1.3483 9.4792 1.9002 -2.031829      2.329948  
1 1 1 3  25 8  o 6.2910 1.2374 52.094   16.891  62.610    19.745  23.395    32.617  7.4888 1.3687 5.0932 2.0619 2.395588       2.474811  
1 1 1 3  25 9  o 9.2554 1.2248 108.364  19.017  118.191   22.301  82.174    36.407  10.569 1.0550 7.9419 2.2108 2.626950       2.449624  
1 1 1 3  25 10 o 13.168 0.9007 192.345  20.326  197.610   23.657  177.499   39.726  13.799 0.8572 12.537 1.5843 1.261459       1.801363  
1 1 1 3  25 11 o 7.4222 1.3284 64.477   17.738  61.304    20.386  74.366    35.987  7.3378 1.4405 7.5066 2.2325 -0.1687489     2.656890  
1 1 1 3  25 12 o 5.0710 1.3140 18.787   16.332  6.2668    18.973  54.602    32.090  3.6420 1.5323 6.5000 2.1350 -2.858051      2.627911  
1 1 1 3  25 13 o 4.7078 1.3069 21.599   17.685  27.707    20.431  3.3507    35.314  4.9502 1.7041 4.4653 1.9818 0.4848719      2.613771  
1 1 1 3  25 14 o 5.7748 1.2722 18.840   17.179  -4.6201   19.747  91.867    34.840  3.2082 1.4483 8.3414 2.0921 -5.133219      2.544487  
1 1 1 3  25 15 o 7.4741 1.3636 74.552   19.645  78.017    22.633  63.969    39.558  8.3224 1.3598 6.6259 2.3641 1.696443       2.727290  
1 1 1 3  25 16 o 4.9504 1.3808 27.494   18.601  26.040    21.689  31.538    36.170  4.7118 1.7406 5.1890 2.1440 -0.4772539     2.761601  
1 1 1 3  25 17 o 3.0436 1.0660 -31.2278 16.825  -34.5342  18.807  -17.9722  37.656  2.2892 1.1304 3.7980 1.8076 -1.508829      2.131934  
1 1 1 3  25 18 o 4.0813 1.2453 16.293   18.061  21.367    20.761  0.5016    36.625  4.2014 1.6637 3.9612 1.8534 0.2401540      2.490580  
1 1 1 3  25 19 o 3.4720 1.1734 -6.2991  17.207  -9.5499   19.002  8.5061    40.552  2.8082 1.3206 4.1359 1.9399 -1.327689      2.346767  
1 1 1 3  25 20 o 4.1263 1.2918 20.026   18.041  16.012    20.244  35.513    39.766  3.7347 1.5776 4.5179 2.0460 -0.7831888     2.583590  
1 1 1 3  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  25 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 0  o 3.4708 1.4904 11.129   18.921  30.062    31.287  0.2122    23.758  4.2381 2.3982 2.7036 1.7701 -0.000000      0.000000  
1 1 1 3  26 1  o 6.8524 1.2586 54.079   16.202  50.073    19.179  64.061    30.276  6.5895 1.4902 7.1152 2.0286 -0.5256286     2.517127  
1 1 1 3  26 2  o 3.8278 1.1741 3.7043   15.581  2.7611    18.782  5.7861    27.904  3.4772 1.4957 4.1783 1.8101 -0.7011142     2.348148  
1 1 1 3  26 3  o 8.8510 1.1440 84.831   18.370  76.872    21.894  103.761   33.763  8.4157 1.3008 9.2863 1.8823 -0.8706360     2.288057  
1 1 1 3  26 4  o 5.7015 1.0374 41.868   15.969  64.965    18.710  -20.1117  30.649  7.7904 1.2008 3.6125 1.6919 4.177860       2.074734  
1 1 1 3  26 5  o 3.7122 1.1767 -4.3732  16.051  -8.5524   18.815  6.7992    30.763  3.0394 1.3884 4.3851 1.9002 -1.345693      2.353338  
1 1 1 3  26 6  o 5.9270 1.3360 35.688   17.103  22.900    20.411  65.840    31.340  4.6505 1.6931 7.2035 2.0673 -2.552904      2.672097  
1 1 1 3  26 7  o 4.8664 1.1954 26.843   16.261  39.609    18.625  -14.0785  33.347  5.8270 1.5650 3.9058 1.8073 1.921241       2.390739  
1 1 1 3  26 8  o 4.4004 1.2461 16.448   16.614  23.247    19.460  -1.8267   31.903  4.6485 1.6582 4.1522 1.8605 0.4963255      2.492203  
1 1 1 3  26 9  o 6.3334 1.2938 38.428   17.292  19.340    20.566  84.480    31.945  4.4284 1.6823 8.2384 1.9661 -3.810005      2.587641  
1 1 1 3  26 10 o 3.8909 1.1686 5.1709   16.737  17.450    19.829  -25.2541  31.213  4.2832 1.6460 3.4985 1.6594 0.7847269      2.337256  
1 1 1 3  26 11 o 3.1724 1.0524 -13.4869 15.109  -11.5492  17.713  -18.6638  28.952  2.8292 1.3120 3.5157 1.6459 -0.6864407     2.104789  
1 1 1 3  26 12 o 6.3400 1.3871 53.013   18.858  56.332    21.879  43.423    37.188  6.8488 1.6223 5.8311 2.2505 1.017734       2.774253  
1 1 1 3  26 13 o 6.4589 1.3622 56.745   19.326  63.965    23.296  40.808    34.612  7.2654 1.6419 5.6523 2.1740 1.613067       2.724356  
1 1 1 3  26 14 o 4.5452 1.3471 4.7234   18.969  -10.5870  22.049  48.336    37.214  3.1659 1.4666 5.9246 2.2601 -2.758787      2.694201  
1 1 1 3  26 15 o 6.5971 1.3471 64.690   19.963  74.891    23.375  37.202    38.372  7.8507 1.5438 5.3434 2.2081 2.507293       2.694249  
1 1 1 3  26 16 o 3.9574 1.2733 -11.4983 18.515  -27.6282  21.067  43.242    38.809  2.5878 1.2609 5.3270 2.2126 -2.739124      2.546601  
1 1 1 3  26 17 o 3.8764 1.2358 8.2364   19.304  13.443    22.248  -7.6241   38.829  3.8694 1.6451 3.8833 1.8445 -0.1393414E-01 2.471539  
1 1 1 3  26 18 o 3.9410 1.2506 13.289   18.905  14.870    21.656  8.2251    38.758  3.8192 1.6234 4.0628 1.9027 -0.2436357     2.501158  
1 1 1 3  26 19 o 3.6544 1.2281 1.1222   18.427  -5.0185   20.356  28.991    43.364  2.9542 1.3821 4.3545 2.0306 -1.400346      2.456271  
1 1 1 3  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  26 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 0  o 2.8951 1.3633 -22.2290 25.906  16.497    29.529  -151.6220 53.976  3.5738 2.1816 2.2163 1.6353 -0.000000      0.000000  
1 1 1 3  27 1  o 4.8093 1.2277 25.336   15.081  29.216    18.456  17.539    26.164  5.0448 1.6163 4.5739 1.8484 0.4709296      2.455373  
1 1 1 3  27 2  o 12.289 0.8858 152.734  20.368  135.041   24.278  194.772   37.423  11.288 1.0754 13.291 1.4079 -2.003148      1.771617  
1 1 1 3  27 3  o 5.8927 1.3742 38.001   17.409  31.013    20.589  55.526    32.606  5.1857 1.7105 6.5997 2.1513 -1.414002      2.748413  
1 1 1 3  27 4  o 4.8464 1.1638 24.727   16.741  43.813    19.868  -21.9966  31.087  6.1114 1.6049 3.5813 1.6857 2.530064       2.327545  
1 1 1 3  27 5  o 5.9965 1.3907 41.325   17.777  37.160    20.884  52.285    33.876  5.5994 1.7088 6.3937 2.1947 -0.7942262     2.781484  
1 1 1 3  27 6  o 8.7984 1.2015 86.923   19.330  80.308    23.218  101.863   34.892  8.5407 1.3593 9.0560 1.9815 -0.5153170     2.402915  
1 1 1 3  27 7  o 13.730 0.8862 209.750  21.655  216.855   25.771  192.681   39.944  14.407 0.8944 13.053 1.5301 1.354662       1.772367  
1 1 1 3  27 8  o 4.9147 1.3727 22.271   18.117  20.172    21.074  28.217    35.464  4.5052 1.7050 5.3242 2.1519 -0.8190041     2.745481  
1 1 1 3  27 9  f 9.4408 1.2001 104.227  20.341  104.488   24.568  103.657   36.272  9.8087 1.2524 9.0729 2.0475 0.7357912      2.400154  
1 1 1 3  27 10 o 6.4211 1.4326 52.594   19.398  51.166    22.816  56.316    36.841  6.4424 1.7330 6.3998 2.2817 0.4267263E-01  2.865207  
1 1 1 3  27 11 o 5.0705 1.2008 27.926   19.028  54.427    22.908  -31.0329  34.170  6.6364 1.7140 3.5046 1.6824 3.131752       2.401690  
1 1 1 3  27 12 o 4.6115 1.2962 20.464   19.585  34.494    23.367  -12.6733  35.911  5.2722 1.8220 3.9508 1.8441 1.321416       2.592427  
1 1 1 3  27 13 o 4.2962 1.3016 13.765   19.529  18.148    23.574  4.1769    34.868  4.3275 1.7525 4.2649 1.9250 0.6257868E-01  2.603286  
1 1 1 3  27 14 o 5.1804 1.4567 28.707   20.368  17.892    23.731  58.953    39.687  4.2595 1.7457 6.1014 2.3324 -1.841897      2.913349  
1 1 1 3  27 15 o 4.2085 1.2967 18.006   18.972  18.799    21.843  15.570    38.284  4.0803 1.6738 4.3367 1.9808 -0.2564297     2.593312  
1 1 1 3  27 16 o 4.7941 1.3274 34.276   19.904  42.778    22.447  3.0002    43.053  5.4322 1.7857 4.1561 1.9646 1.276062       2.654898  
1 1 1 3  27 17 o 5.0911 1.3376 44.786   20.040  52.706    22.903  18.915    41.393  5.9047 1.7867 4.2775 1.9910 1.627193       2.675162  
1 1 1 3  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  27 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 0  o 3.5556 1.6592 5.5368   27.960  9.5132    32.437  -5.9595   55.155  3.3835 2.1591 3.7277 2.5201 -0.000000      0.000000  
1 1 1 3  28 1  o 6.0626 1.3146 43.748   19.357  68.931    27.266  18.156    27.487  7.5016 1.8329 4.6237 1.8850 2.877943       2.629218  
1 1 1 3  28 2  o 13.483 0.8236 202.559  20.697  219.900   25.867  171.701   34.507  14.511 0.8913 12.455 1.3853 2.056816       1.647254  
1 1 1 3  28 3  o 6.0168 1.3583 46.140   18.569  51.915    22.141  32.444    34.093  6.5959 1.6752 5.4377 2.1387 1.158163       2.716688  
1 1 1 3  28 4  o 9.3613 1.1639 94.204   19.572  83.906    23.107  120.354   36.821  8.7675 1.3178 9.9552 1.9189 -1.187707      2.327795  
1 1 1 3  28 5  o 14.342 0.8610 205.721  23.216  177.962   27.735  270.700   42.434  12.960 1.0700 15.725 1.3493 -2.765114      1.722075  
1 1 1 3  28 6  o 5.9766 1.3734 35.863   18.515  19.356    22.273  72.783    33.310  4.4805 1.7382 7.4728 2.1269 -2.992334      2.746799  
1 1 1 3  28 7  o 6.0791 1.3841 41.798   18.197  30.386    21.891  67.318    32.736  5.0713 1.7629 7.0870 2.1342 -2.015680      2.768156  
1 1 1 3  28 8  o 4.5141 1.3450 14.744   18.656  11.693    21.732  23.293    36.378  4.0131 1.6603 5.0151 2.1164 -1.001922      2.689982  
1 1 1 3  28 9  o 5.7522 1.4329 38.283   19.520  27.575    23.647  61.185    34.582  4.8857 1.8149 6.6187 2.2179 -1.733075      2.865840  
1 1 1 3  28 10 o 12.855 0.9995 184.928  23.744  179.169   28.549  197.848   42.765  12.839 1.1118 12.872 1.6612 -0.3293514E-01 1.998921  
1 1 1 3  28 11 o 10.626 1.2102 136.897  23.371  133.645   28.536  143.522   40.729  10.864 1.3134 10.389 2.0331 0.4748716      2.420410  
1 1 1 3  28 12 o 4.2631 1.3074 -6.6657  19.201  -26.7230  22.346  49.933    37.537  2.7399 1.3265 5.7862 2.2533 -3.046376      2.614702  
1 1 1 3  28 13 o 7.3489 1.4270 82.795   21.046  83.974    24.862  79.811    39.534  8.0592 1.5989 6.6387 2.3640 1.420499       2.853930  
1 1 1 3  28 14 o 6.1723 1.5144 58.996   21.118  53.763    24.365  74.797    42.340  6.0978 1.8423 6.2469 2.4040 -0.1490355     3.028776  
1 1 1 3  28 15 o 4.3659 1.3339 24.113   20.026  24.683    23.091  22.384    40.219  4.3103 1.7384 4.4216 2.0236 -0.1112518     2.667750  
1 1 1 3  28 16 o 3.9007 1.2243 15.652   20.020  26.145    22.571  -23.0643  43.356  4.2539 1.7176 3.5475 1.7450 0.7063847      2.448503  
1 1 1 3  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  28 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 0  o 4.2701 1.8932 25.889   29.878  24.381    34.197  30.753    61.418  3.9557 2.3819 4.5846 2.9434 -0.000000      0.000000  
1 1 1 3  29 1  o 3.5597 1.1467 -13.9668 19.214  9.2305    26.382  -40.1692  28.038  4.1550 1.7796 2.9643 1.4466 1.190681       2.293332  
1 1 1 3  29 2  o 5.3101 1.3770 34.019   19.139  34.784    26.376  33.168    27.813  5.3469 1.9280 5.2733 1.9664 0.7363749E-01  2.753917  
1 1 1 3  29 3  o 6.8131 1.3373 57.625   18.161  53.729    22.312  65.273    31.263  6.6314 1.6802 6.9948 2.0809 -0.3633647     2.674590  
1 1 1 3  29 4  o 6.0048 1.3908 47.778   19.325  52.554    23.215  36.996    34.877  6.5026 1.7476 5.5071 2.1641 0.9955645      2.781589  
1 1 1 3  29 5  o 4.6013 1.3477 14.742   18.136  7.5389    21.103  35.089    35.467  3.7818 1.6048 5.4208 2.1656 -1.638981      2.695434  
1 1 1 3  29 6  f 3.8926 1.2393 -0.8974  19.203  -4.2867   23.614  5.7201    32.996  3.4830 1.5770 4.3023 1.9123 -0.8193042     2.478664  
1 1 1 3  29 7  o 7.5883 1.3435 80.576   21.291  94.328    25.905  51.954    37.373  9.0865 1.4255 6.0901 2.2778 2.996412       2.687076  
1 1 1 3  29 8  f 6.3558 1.4847 54.062   20.680  51.124    24.425  61.501    38.866  6.2786 1.8318 6.4331 2.3372 -0.1545939     2.969482  
1 1 1 3  29 9  o 7.4622 1.4432 71.235   20.589  61.182    24.366  96.331    38.498  6.8803 1.7628 8.0442 2.2855 -1.163861      2.886336  
1 1 1 3  29 10 o 6.4516 1.2876 64.399   21.721  88.718    26.004  8.2678    39.507  8.4632 1.5948 4.4400 2.0218 4.023273       2.575105  
1 1 1 3  29 11 o 4.8487 1.4095 25.348   20.724  9.6547    24.849  61.204    37.561  3.8165 1.6796 5.8809 2.2640 -2.064336      2.818991  
1 1 1 3  29 12 o 7.2896 1.4262 60.854   21.700  28.203    25.250  153.093   42.440  4.6025 1.8309 9.9766 2.1872 -5.374104      2.852412  
1 1 1 3  29 13 o 5.4207 1.4259 48.884   20.713  50.940    24.619  43.903    38.324  5.7851 1.8681 5.0563 2.1547 0.7288184      2.851746  
1 1 1 3  29 14 o 7.1168 1.5606 87.101   22.790  79.291    26.129  111.934   46.590  7.3213 1.7977 6.9122 2.5515 0.4090915      3.121180  
1 1 1 3  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  29 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 0  f 5.6666 2.2288 61.799   33.362  56.152    37.667  82.361    71.871  5.4566 2.7666 5.8766 3.4952 -0.000000      0.000000  
1 1 1 3  30 1  o 4.7478 1.3843 21.958   21.182  24.941    31.519  19.501    28.604  4.8983 2.0102 4.5973 1.9037 0.3010359      2.768518  
1 1 1 3  30 2  o 5.1912 1.4446 32.187   21.940  31.934    29.507  32.501    32.809  5.1574 2.0007 5.2251 2.0844 -0.6768417E-01 2.889186  
1 1 1 3  30 3  o 8.6836 1.4266 100.192  24.369  109.814   34.295  90.380    34.633  9.2344 1.9195 8.1328 2.1108 1.101576       2.853106  
1 1 1 3  30 4  o 7.0168 1.4729 67.116   23.525  96.878    34.533  41.342    32.136  8.4639 2.0596 5.5697 2.1061 2.894198       2.945745  
1 1 1 3  30 5  o 4.4617 1.2150 16.960   19.402  40.096    22.468  -50.8778  38.473  5.5643 1.7834 3.3591 1.6506 2.205249       2.429991  
1 1 1 3  30 6  o 6.5900 1.4630 61.506   20.913  60.691    25.425  63.210    36.772  6.7657 1.8333 6.4144 2.2804 0.3512979      2.925931  
1 1 1 3  30 7  o 8.0279 1.3410 96.494   22.048  113.896   26.788  59.953    38.817  9.9118 1.3513 6.1440 2.3167 3.767753       2.682039  
1 1 1 3  30 8  o 4.1147 1.3032 8.5348   20.662  0.5786    25.115  25.197    36.345  3.5594 1.6174 4.6700 2.0438 -1.110604      2.606355  
1 1 1 3  30 9  o 3.5695 1.1500 -0.5631  19.114  14.039    22.626  -36.9484  35.716  3.8875 1.6561 3.2514 1.5962 0.6361396      2.300097  
1 1 1 3  30 10 o 5.0112 1.4569 32.363   21.119  22.536    24.640  59.562    40.993  4.3242 1.7763 5.6982 2.3098 -1.373951      2.913857  
1 1 1 3  30 11 o 4.5516 1.3857 24.005   21.406  11.760    25.911  50.325    37.988  3.8471 1.7030 5.2560 2.1865 -1.408862      2.771493  
1 1 1 3  30 12 o 4.3825 1.2759 25.461   21.228  45.498    25.679  -17.7883  37.727  5.2644 1.9017 3.5007 1.7015 1.763790       2.551770  
1 1 1 3  30 13 o 4.4561 1.3449 33.137   21.902  39.368    25.574  15.991    42.423  4.8222 1.8648 4.0900 1.9384 0.7322345      2.689773  
1 1 1 3  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  30 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 0  o 3.5452 1.6973 6.2760   31.726  11.588    35.559  -14.4503  70.242  3.3879 2.1992 3.7025 2.5859 -0.000000      0.000000  
1 1 1 3  31 1  f 4.5643 1.2834 10.498   21.854  -39.1798  32.328  52.308    29.658  3.1484 1.5400 5.9803 2.0535 -2.831866      2.566806  
1 1 1 3  31 2  o 9.2561 1.3892 117.697  24.893  113.592   34.243  122.298   36.250  9.1150 1.9381 9.3971 1.9907 -0.2820215     2.778314  
1 1 1 3  31 3  o 3.6519 1.2158 -10.2820 22.981  -17.1029  33.046  -3.8938   31.981  3.5312 1.6841 3.7725 1.7540 -0.2413142     2.431600  
1 1 1 3  31 4  o 3.5148 1.1696 -14.7937 22.124  -42.6889  32.564  9.1220    30.152  3.0355 1.4968 3.9941 1.7976 -0.9586029     2.339227  
1 1 1 3  31 5  o 4.2046 1.3373 13.875   23.839  3.2453    34.319  23.786    33.138  3.9346 1.8252 4.4746 1.9551 -0.5400355     2.674626  
1 1 1 3  31 6  o 8.8620 1.3475 105.518  21.629  95.441    25.812  129.279   39.635  8.6434 1.5501 9.0807 2.2045 -0.4373417     2.694946  
1 1 1 3  31 7  o 4.6271 1.3864 25.527   20.913  17.582    25.382  42.322    36.902  4.1210 1.7547 5.1331 2.1469 -1.012136      2.772769  
1 1 1 3  31 8  o 3.6455 1.2131 -5.9911  20.609  -16.0804  24.842  16.286    36.913  3.0281 1.4485 4.2628 1.9463 -1.234771      2.426150  
1 1 1 3  31 9  o 3.9462 1.2618 12.674   19.798  12.331    23.227  13.588    37.858  3.7498 1.6377 4.1425 1.9200 -0.3927629     2.523523  
1 1 1 3  31 10 o 4.8041 1.3019 39.376   21.588  56.632    24.973  -11.6461  42.941  5.9066 1.8788 3.7017 1.8028 2.204960       2.603841  
1 1 1 3  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  31 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 0  o 3.7548 1.8247 10.579   33.085  1.5544    36.495  52.208    78.382  3.0380 2.0527 4.4715 3.0174 -0.000000      0.000000  
1 1 1 3  32 1  o 5.0926 1.5079 43.897   29.647  -41.0422  75.374  59.443    32.246  4.2680 2.1331 5.9172 2.1320 -1.649203      3.015874  
1 1 1 3  32 2  o 6.2988 1.3850 62.931   23.923  104.631   32.902  16.154    34.847  8.3515 1.9968 4.2461 1.9198 4.105434       2.769982  
1 1 1 3  32 3  o 4.8936 1.4353 35.657   23.560  19.752    32.321  53.690    34.416  4.2777 1.8974 5.5094 2.1542 -1.231658      2.870655  
1 1 1 3  32 4  o 3.7336 1.2317 -2.5324  23.349  -24.4734  34.136  16.757    32.007  3.3177 1.6139 4.1494 1.8611 -0.8317173     2.463394  
1 1 1 3  32 5  o 3.7779 1.2523 0.4030   24.037  -11.4230  34.163  11.998    33.827  3.5266 1.6901 4.0291 1.8483 -0.5024571     2.504562  
1 1 1 3  32 6  o 4.6200 1.3951 33.666   23.264  44.067    32.097  22.153    33.769  4.9951 2.0367 4.2450 1.9072 0.7501416      2.790285  
1 1 1 3  32 7  o 5.3966 1.3537 52.692   19.953  61.617    24.467  34.974    34.475  6.2495 1.8362 4.5437 1.9895 1.705822       2.707329  
1 1 1 3  32 8  o 4.1057 1.2851 22.352   21.559  30.715    25.879  3.3861    38.974  4.4078 1.8166 3.8036 1.8181 0.6041496      2.570157  
1 1 1 3  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  32 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 0  o 5.0993 1.9969 77.846   36.193  88.841    40.598  35.262    79.899  6.3048 2.9170 3.8938 2.7278 -0.000000      0.000000  
1 1 1 3  33 1  o 3.3987 1.1568 -13.7855 23.947  -40.4692  36.155  7.0703    31.964  3.0695 1.5248 3.7279 1.7400 -0.6584835     2.313607  
1 1 1 3  33 2  o 3.8229 1.2706 8.1461   24.892  2.4621    35.987  13.360    34.468  3.7225 1.7703 3.9233 1.8231 -0.2007535     2.541168  
1 1 1 3  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  33 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  34 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  35 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  36 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  37 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  38 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 3  38 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  1  0  o 33.472 0.7369 1126.85  49.223  1138.10   69.869  1115.76   69.358  33.639 1.0408 33.305 1.0436 -0.000000      0.000000  
1 1 1 4  1  1  o 13.385 0.4555 179.665  12.180  169.412   17.176  190.037   17.275  12.999 0.6607 13.770 0.6273 -0.7702875     0.9110197 
1 1 1 4  1  2  o 26.723 0.4909 716.811  26.233  708.258   37.090  725.373   37.109  26.562 0.6982 26.883 0.6902 -0.3201694     0.9817390 
1 1 1 4  1  3  o 18.032 0.4657 326.573  16.793  318.190   23.696  335.030   23.801  17.799 0.6657 18.266 0.6515 -0.4665909     0.9314274 
1 1 1 4  1  4  o 11.683 0.5245 133.673  10.755  144.048   21.448  130.188   12.431  11.968 0.8960 11.398 0.5453 0.5701351      1.048915  
1 1 1 4  1  5  o 16.917 0.4688 287.071  15.860  292.113   22.417  282.018   22.441  17.066 0.6568 16.768 0.6692 0.2984104      0.9376399 
1 1 1 4  1  6  o 31.533 0.5164 998.524  32.554  1040.20   46.302  957.787   45.780  32.186 0.7193 30.880 0.7412 1.305195       1.032870  
1 1 1 4  1  7  o 28.003 0.5008 786.987  28.034  817.007   39.845  757.556   39.451  28.533 0.6982 27.473 0.7180 1.060511       1.001518  
1 1 1 4  1  8  o 19.998 0.4767 401.503  19.061  412.600   27.020  390.508   26.894  20.274 0.6664 19.722 0.6818 0.5519753      0.9533660 
1 1 1 4  1  9  o 13.945 0.4770 195.215  13.302  198.339   18.799  192.082   18.826  14.057 0.6687 13.832 0.6805 0.2244349      0.9540530 
1 1 1 4  1  10 f 22.964 0.4863 529.134  22.331  519.402   31.547  538.909   31.616  22.752 0.6933 23.177 0.6821 -0.4245491     0.9725416 
1 1 1 4  1  11 o 10.810 0.5015 117.108  10.837  111.754   15.080  122.826   15.585  10.555 0.7144 11.066 0.7042 -0.5109739     1.003088  
1 1 1 4  1  12 o 46.078 0.5927 2133.00  54.612  2088.35   77.055  2178.07   77.412  45.592 0.8451 46.565 0.8312 -0.9726143     1.185350  
1 1 1 4  1  13 o 43.596 0.5298 1905.47  45.377  1889.68   58.786  1928.74   71.377  43.391 0.6774 43.802 0.8148 -0.4104576     1.059592  
1 1 1 4  1  14 o 38.258 0.5095 1476.85  38.237  1501.66   49.706  1440.88   59.845  38.673 0.6427 37.843 0.7907 0.8300438      1.018925  
1 1 1 4  1  15 o 9.5663 0.4266 92.306   8.1259  86.620    11.826  97.393    11.184  9.2836 0.6369 9.8490 0.5678 -0.5654783     0.8532722 
1 1 1 4  1  16 o 15.699 0.3483 247.797  10.924  243.667   15.766  251.610   15.149  15.571 0.5063 15.827 0.4786 -0.2559052     0.6966690 
1 1 1 4  1  17 o 17.232 0.3719 298.259  12.781  282.478   17.294  317.256   18.974  16.735 0.5167 17.730 0.5351 -0.9948177     0.7438268 
1 1 1 4  1  18 o 9.3328 0.3911 88.125   7.2814  85.933    10.597  90.086    10.021  9.2189 0.5748 9.4468 0.5304 -0.2278357     0.7821136 
1 1 1 4  1  19 o 3.5938 0.6531 13.471   4.7313  17.487    7.2542  10.497    6.2415  4.0348 0.9194 3.1527 0.9277 0.8821101      1.306154  
1 1 1 4  1  20 o 4.2060 0.6582 19.255   5.3958  16.296    7.8948  21.850    7.3917  3.8773 1.0085 4.5347 0.8461 -0.6573849     1.316471  
1 1 1 4  1  21 o 13.381 0.3793 181.892  10.148  180.781   14.516  182.954   14.192  13.338 0.5442 13.424 0.5286 -0.8594036E-01 0.7586740 
1 1 1 4  1  22 o 5.9868 0.5735 38.516   6.4655  28.320    9.2542  48.240    9.0369  5.1177 0.9387 6.8558 0.6591 -1.738013      1.146986  
1 1 1 4  1  23 o 3.8968 0.7427 16.660   5.9392  18.259    8.3093  14.989    8.4924  4.0833 1.0204 3.7104 1.0794 0.3729465      1.485350  
1 1 1 4  1  24 o 10.704 0.4306 116.909  9.2115  111.457   12.901  122.578   13.157  10.446 0.6175 10.961 0.6002 -0.5151167     0.8611035 
1 1 1 4  1  25 o 11.701 0.4258 139.269  9.9601  134.433   13.897  144.376   14.282  11.491 0.6047 11.910 0.5996 -0.4191971     0.8515424 
1 1 1 4  1  26 o 15.019 0.4258 228.120  12.678  217.722   16.699  242.269   19.480  14.632 0.5706 15.406 0.6322 -0.7737503     0.8516538 
1 1 1 4  1  27 o 4.5443 0.8106 22.535   7.3420  19.623    9.7786  26.298    11.116  4.2168 1.1346 4.8718 1.1579 -0.6549511     1.621113  
1 1 1 4  1  28 o 7.8967 0.6166 69.241   9.1260  84.645    12.051  48.527    13.974  9.0667 0.6645 6.7266 1.0387 2.340169       1.233126  
1 1 1 4  1  29 o 8.2424 0.5891 72.606   9.4726  76.097    12.335  67.587    14.790  8.5421 0.7220 7.9427 0.9310 0.5993519      1.178166  
1 1 1 4  1  30 o 3.3188 0.8879 7.8315   8.2756  0.3689    10.328  21.218    13.832  2.4876 1.0891 4.1500 1.4026 -1.662400      1.775806  
1 1 1 4  1  31 o 4.9605 0.9346 30.337   9.8009  18.800    12.753  46.983    15.319  3.8346 1.3449 6.0863 1.2980 -2.251724      1.869112  
1 1 1 4  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  2  0  o 35.154 0.7420 1245.43  52.059  1271.92   73.914  1219.35   73.335  35.528 1.0423 34.780 1.0565 -0.000000      0.000000  
1 1 1 4  2  1  o 19.260 0.4593 372.480  17.693  375.717   25.028  369.247   25.014  19.344 0.6469 19.176 0.6522 0.1679268      0.9186701 
1 1 1 4  2  2  o 17.670 0.4560 313.441  16.114  310.849   22.811  316.023   22.767  17.597 0.6482 17.743 0.6416 -0.1465397     0.9119747 
1 1 1 4  2  3  o 15.931 0.4551 254.585  14.500  249.960   20.503  259.212   20.510  15.786 0.6494 16.076 0.6379 -0.2903490     0.9102960 
1 1 1 4  2  4  o 11.397 0.4577 130.254  10.432  128.301   14.766  132.199   14.741  11.311 0.6527 11.482 0.6419 -0.1710644     0.9154848 
1 1 1 4  2  5  o 18.809 0.4655 355.013  17.510  349.537   24.799  360.457   24.727  18.664 0.6643 18.955 0.6523 -0.2904434     0.9310312 
1 1 1 4  2  6  o 28.441 0.4990 811.781  28.386  821.941   40.347  801.822   39.944  28.617 0.7049 28.265 0.7066 0.3526535      0.9980996 
1 1 1 4  2  7  o 31.554 0.6297 998.659  37.763  1011.41   64.517  992.012   46.575  31.678 1.0183 31.430 0.7409 0.2471809      1.259353  
1 1 1 4  2  8  o 17.349 0.5974 311.464  19.424  277.016   32.931  329.845   24.055  16.571 0.9936 18.126 0.6635 -1.554985      1.194799  
1 1 1 4  2  9  o 16.019 0.5829 258.490  17.720  255.722   30.190  259.945   21.887  15.941 0.9469 16.097 0.6798 -0.1555681     1.165706  
1 1 1 4  2  10 o 33.482 0.6370 1113.12  40.539  1173.62   69.898  1082.46   49.762  34.130 1.0240 32.833 0.7578 1.296795       1.273910  
1 1 1 4  2  11 o 6.8870 0.5784 48.019   7.8980  52.491    10.846  42.971    11.524  7.2334 0.7497 6.5406 0.8809 0.6927881      1.156778  
1 1 1 4  2  12 o 25.601 0.4997 657.737  25.570  630.038   36.040  685.812   36.285  25.057 0.7192 26.145 0.6939 -1.088711      0.9993612 
1 1 1 4  2  13 o 37.367 0.5038 1403.30  36.992  1407.38   48.071  1397.37   57.927  37.449 0.6418 37.285 0.7768 0.1639061      1.007648  
1 1 1 4  2  14 o 12.155 0.4718 147.867  11.253  145.702   14.521  151.121   17.804  12.049 0.6026 12.261 0.7260 -0.2120867     0.9435186 
1 1 1 4  2  15 o 11.175 0.4875 127.294  10.649  134.123   13.900  117.590   16.569  11.552 0.6017 10.799 0.7672 0.7524843      0.9749386 
1 1 1 4  2  16 f 10.780 0.4996 119.037  10.475  125.453   13.553  109.519   16.508  11.160 0.6072 10.400 0.7936 0.7594090      0.9992604 
1 1 1 4  2  17 o 12.846 0.4891 170.688  12.192  182.270   15.797  153.630   19.173  13.423 0.5884 12.270 0.7813 1.153240       0.9781061 
1 1 1 4  2  18 o 5.1865 0.5674 30.087   5.3113  19.709    8.2156  37.540    6.9617  4.2829 0.9803 6.0901 0.5716 -1.807197      1.134749  
1 1 1 4  2  19 o 12.733 0.3758 164.622  9.5392  156.242   13.819  172.249   13.184  12.415 0.5566 13.051 0.5051 -0.6360197     0.7515863 
1 1 1 4  2  20 o 7.3102 0.4613 54.403   6.7236  55.821    9.9636  53.216    9.1108  7.3927 0.6739 7.2276 0.6303 0.1650901      0.9226885 
1 1 1 4  2  21 o 3.3728 0.7383 11.829   5.4302  14.119    8.4961  10.247    7.0605  3.6136 1.0870 3.1320 0.9993 0.4816284      1.476552  
1 1 1 4  2  22 o 12.334 0.4014 154.748  9.8917  161.766   14.365  148.420   13.641  12.598 0.5701 12.069 0.5651 0.5288877      0.8027493 
1 1 1 4  2  23 o 6.1254 0.6104 40.714   6.9667  28.715    10.063  51.761    9.6547  5.1425 1.0144 7.1083 0.6791 -1.965796      1.220750  
1 1 1 4  2  24 f 10.882 0.4522 120.929  9.8215  116.943   13.398  125.558   14.439  10.694 0.6265 11.070 0.6522 -0.3766041     0.9043097 
1 1 1 4  2  25 o 17.571 0.4303 317.995  14.842  292.231   22.735  337.127   19.592  16.909 0.6723 18.233 0.5373 -1.323729      0.8605821 
1 1 1 4  2  26 o 7.5140 0.5530 58.270   8.2732  51.385    11.529  65.579    11.879  7.0453 0.8182 7.9827 0.7440 -0.9373407     1.105923  
1 1 1 4  2  27 o 3.7120 0.8221 13.517   7.2439  5.9519    9.7971  22.642    10.759  2.9109 1.1460 4.5132 1.1790 -1.602311      1.644198  
1 1 1 4  2  28 o 8.8350 0.5420 81.808   9.4818  87.367    12.850  75.165    14.048  9.1958 0.6987 8.4742 0.8289 0.7215490      1.084073  
1 1 1 4  2  29 o 10.504 0.5170 115.652  10.766  118.514   14.427  112.056   16.172  10.685 0.6751 10.324 0.7832 0.3605051      1.034017  
1 1 1 4  2  30 f 3.7524 0.8083 16.022   8.2805  28.092    10.563  -3.2175   13.336  4.9027 1.1039 2.6021 1.1810 2.300615       1.616541  
1 1 1 4  2  31 o 4.1078 0.9682 21.928   9.1585  20.231    11.727  24.581    14.664  3.9657 1.2900 4.2499 1.4442 -0.2841716     1.936450  
1 1 1 4  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  2  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  3  0  o 36.879 0.7524 1369.39  55.388  1397.76   78.659  1341.49   78.006  37.260 1.0575 36.498 1.0707 -0.000000      0.000000  
1 1 1 4  3  1  o 38.048 0.5366 1453.92  40.831  1464.81   57.777  1443.05   57.712  38.191 0.7564 37.905 0.7613 0.2857971      1.073166  
1 1 1 4  3  2  o 15.530 0.4524 241.859  14.052  242.469   19.835  241.246   19.910  15.550 0.6378 15.510 0.6418 0.3953743E-01  0.9048234 
1 1 1 4  3  3  o 26.507 0.4825 704.809  25.577  705.116   36.163  704.501   36.180  26.513 0.6820 26.501 0.6826 0.1164627E-01  0.9649106 
1 1 1 4  3  4  o 31.718 0.5059 1009.90  32.092  1019.27   45.403  1000.55   45.368  31.866 0.7124 31.571 0.7185 0.2948914      1.011820  
1 1 1 4  3  5  o 22.671 0.4712 515.757  21.366  521.421   30.249  510.117   30.184  22.796 0.6635 22.547 0.6694 0.2491379      0.9424732 
1 1 1 4  3  6  o 43.238 0.5683 1878.28  49.148  1890.62   69.596  1866.00   69.415  43.380 0.8022 43.096 0.8053 0.2842178      1.136684  
1 1 1 4  3  7  o 21.996 0.4727 485.585  20.796  491.235   29.490  479.995   29.330  22.123 0.6665 21.868 0.6706 0.2550602      0.9454759 
1 1 1 4  3  8  o 5.0960 0.7777 29.699   6.9280  32.962    8.0269  20.172    13.718  5.7287 0.7006 4.4634 1.3888 1.265264       1.555460  
1 1 1 4  3  9  o 2.4134 0.6520 3.5995   4.7698  7.7175    5.2362  -16.4790  11.562  2.7762 0.8571 2.0506 0.9829 0.7256351      1.304058  
1 1 1 4  3  10 o 25.692 0.6127 672.771  29.798  633.268   50.357  694.058   36.965  25.081 1.0039 26.302 0.7027 -1.220648      1.225361  
1 1 1 4  3  11 o 27.457 0.6201 766.657  32.251  727.322   54.552  787.793   39.988  26.888 1.0144 28.026 0.7134 -1.137966      1.240173  
1 1 1 4  3  12 o 14.064 0.6002 199.508  16.002  196.586   27.298  201.038   19.752  13.974 0.9767 14.155 0.6977 -0.1804991     1.200332  
1 1 1 4  3  13 o 36.191 0.5495 1317.52  39.747  1264.12   56.224  1370.88   56.198  35.453 0.7929 36.928 0.7609 -1.475117      1.098964  
1 1 1 4  3  14 o 19.661 0.4993 388.682  19.623  382.984   28.062  394.133   27.451  19.518 0.7189 19.804 0.6931 -0.2857265     0.9985521 
1 1 1 4  3  15 o 11.798 0.5388 140.417  12.663  158.010   18.244  124.063   17.591  12.516 0.7289 11.081 0.7937 1.434575       1.077614  
1 1 1 4  3  16 o 12.368 0.5345 155.067  13.198  150.042   19.024  159.730   18.326  12.169 0.7817 12.566 0.7291 -0.3973970     1.068959  
1 1 1 4  3  17 f 19.289 0.5105 378.461  19.685  373.582   28.161  383.124   27.527  19.161 0.7348 19.416 0.7089 -0.2547607     1.021032  
1 1 1 4  3  18 o 12.263 0.5557 154.858  13.540  137.447   19.393  171.415   18.912  11.567 0.8383 12.959 0.7297 -1.392260      1.111389  
1 1 1 4  3  19 o 9.0843 0.6381 86.835   11.389  71.617    16.550  100.527   15.698  8.2802 0.9994 9.8883 0.7938 -1.608075      1.276245  
1 1 1 4  3  20 o 4.8203 0.8649 26.080   8.3571  28.179    11.244  23.489    12.492  5.0565 1.1391 4.5840 1.3017 0.4725194      1.729780  
1 1 1 4  3  21 o 11.201 0.4950 129.909  10.957  118.964   16.358  138.816   14.756  10.743 0.7614 11.659 0.6328 -0.9157858     0.9900319 
1 1 1 4  3  22 o 7.3564 0.5353 55.876   7.8627  60.512    11.311  51.542    10.938  7.6571 0.7386 7.0557 0.7751 0.6014080      1.070639  
1 1 1 4  3  23 o 2.7527 0.7386 5.7496   5.8160  1.2435    8.8592  9.1626    7.7102  2.4620 1.0420 3.0435 1.0469 -0.5815589     1.477100  
1 1 1 4  3  24 o 6.9698 0.6213 50.473   8.2816  51.873    13.964  49.712    10.286  7.0002 0.9974 6.9394 0.7411 0.6083488E-01  1.242600  
1 1 1 4  3  25 o 10.339 0.4593 109.073  9.4916  114.300   13.587  104.091   13.265  10.583 0.6419 10.094 0.6571 0.4885063      0.9185897 
1 1 1 4  3  26 o 12.491 0.5016 160.294  12.520  161.413   17.394  159.092   18.035  12.544 0.6933 12.439 0.7250 0.1051216      1.003126  
1 1 1 4  3  27 o 9.1338 0.5128 85.862   9.3662  83.615    13.130  88.190    13.365  9.0109 0.7285 9.2566 0.7219 -0.2456503     1.025640  
1 1 1 4  3  28 o 8.0451 0.5789 67.901   9.2806  70.869    12.798  64.610    13.478  8.2492 0.7757 7.8411 0.8594 0.4080696      1.157736  
1 1 1 4  3  29 o 2.9992 0.8541 6.3458   7.8389  4.5760    10.498  8.5765    11.786  2.8092 1.1573 3.1892 1.2565 -0.3799622     1.708240  
1 1 1 4  3  30 o 3.9620 0.9452 19.037   8.8347  18.623    11.755  19.574    13.393  3.9238 1.2923 4.0001 1.3796 -0.7631946E-01 1.890344  
1 1 1 4  3  31 o 3.8431 0.9894 19.151   10.002  15.024    14.355  23.045    13.943  3.5485 1.3902 4.1377 1.4082 -0.5891912     1.978821  
1 1 1 4  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  3  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  4  0  o 11.072 0.6625 125.580  14.423  129.756   20.412  121.418   20.381  11.264 0.9202 10.880 0.9535 -0.000000      0.000000  
1 1 1 4  4  1  f 31.127 0.5000 972.190  31.121  954.421   43.961  990.041   44.062  30.841 0.7127 31.413 0.7013 -0.5719318     0.9999053 
1 1 1 4  4  2  o 20.254 0.4600 411.468  18.632  408.058   26.374  414.865   26.324  20.170 0.6538 20.339 0.6471 -0.1681538     0.9199076 
1 1 1 4  4  3  o 24.609 0.4740 607.731  23.329  609.956   33.022  605.515   32.961  24.654 0.6697 24.564 0.6709 0.9008789E-01  0.9479738 
1 1 1 4  4  4  o 17.998 0.4563 324.964  16.423  327.490   23.229  322.439   23.223  18.068 0.6428 17.927 0.6477 0.1403046      0.9125564 
1 1 1 4  4  5  o 16.397 0.4560 269.651  14.955  265.992   21.096  273.348   21.203  16.285 0.6477 16.509 0.6422 -0.2240391     0.9120907 
1 1 1 4  4  6  o 9.7421 0.4745 95.250   9.2450  94.440    13.112  96.050    13.037  9.7006 0.6759 9.7835 0.6663 -0.8280754E-01 0.9490453 
1 1 1 4  4  7  o 15.753 0.4615 249.188  14.531  260.848   20.609  237.661   20.491  16.121 0.6392 15.386 0.6659 0.7355652      0.9230282 
1 1 1 4  4  8  o 26.871 0.4871 724.476  26.179  733.992   37.104  715.042   36.942  27.047 0.6859 26.695 0.6919 0.3521976      0.9742978 
1 1 1 4  4  9  o 22.880 0.4763 525.178  21.790  537.435   30.917  513.080   30.716  23.146 0.6679 22.614 0.6791 0.5317688      0.9525025 
1 1 1 4  4  10 o 12.046 0.7046 145.952  16.947  145.640   23.311  146.301   24.683  12.034 0.9685 12.058 1.0235 -0.2335358E-01 1.409132  
1 1 1 4  4  11 o 36.428 0.6587 1323.04  45.227  1300.78   55.162  1368.70   78.996  35.998 0.7662 36.858 1.0716 -0.8606873     1.317354  
1 1 1 4  4  12 o 14.466 0.6256 216.591  16.533  226.368   19.962  195.236   29.502  15.020 0.6645 13.913 1.0602 1.107315       1.251274  
1 1 1 4  4  13 o 25.715 0.5110 664.770  26.271  648.532   37.248  680.844   37.059  25.400 0.7332 26.029 0.7119 -0.6289253     1.021947  
1 1 1 4  4  14 o 37.496 0.5580 1416.09  41.825  1361.63   59.116  1470.67   59.184  36.769 0.8039 38.223 0.7742 -1.453716      1.116059  
1 1 1 4  4  15 o 22.401 0.6494 513.424  26.797  499.686   48.061  519.621   32.280  22.113 1.0867 22.689 0.7113 -0.5759411     1.298829  
1 1 1 4  4  16 o 10.366 0.5690 109.230  11.793  112.170   16.952  106.473   16.417  10.501 0.8072 10.232 0.8022 0.2690554      1.138051  
1 1 1 4  4  17 o 12.212 0.5443 151.435  13.280  157.297   19.345  146.211   18.264  12.433 0.7780 11.991 0.7615 0.4418154      1.088651  
1 1 1 4  4  18 o 9.9870 0.7127 106.860  13.651  119.759   17.751  88.193    21.354  10.810 0.8211 9.1642 1.1651 1.645517       1.425331  
1 1 1 4  4  19 o 2.8486 0.8032 -2.4802  7.8644  14.371    12.238  -14.3347  10.264  3.7873 1.3181 1.9098 0.9182 1.877456       1.606344  
1 1 1 4  4  20 o 9.6510 0.7481 95.594   14.187  82.477    18.113  116.411   22.819  8.8383 1.0247 10.464 1.0904 -1.625426      1.496296  
1 1 1 4  4  21 o 6.9635 0.8326 52.354   11.262  62.106    16.728  44.270    15.231  7.6307 1.0961 6.2963 1.2536 1.334361       1.665165  
1 1 1 4  4  22 o 7.3473 0.7564 59.492   10.520  66.560    14.001  50.328    15.943  7.9777 0.8775 6.7169 1.2322 1.260795       1.512717  
1 1 1 4  4  23 o 4.5351 0.9463 22.263   8.7043  25.439    15.550  20.815    10.504  4.7397 1.4792 4.3305 1.1804 0.4092145      1.892519  
1 1 1 4  4  24 o 4.3791 0.8889 22.087   8.3266  16.355    13.289  25.793    10.684  3.9423 1.3734 4.8159 1.1289 -0.8735800     1.777801  
1 1 1 4  4  25 o 12.921 0.5691 173.631  14.566  181.992   19.624  163.372   21.738  13.304 0.7375 12.539 0.8668 0.7645121      1.138126  
1 1 1 4  4  26 o 2.5372 0.7975 -2.3494  7.8525  -2.5131   12.968  -2.2545   9.8673  2.7079 1.2014 2.3665 1.0491 0.3413358      1.594998  
1 1 1 4  4  27 o 20.008 0.4717 411.523  18.835  405.329   27.423  417.054   25.914  19.847 0.6909 20.170 0.6424 -0.3236198     0.9433728 
1 1 1 4  4  28 o 10.839 0.5897 123.597  12.729  118.219   18.602  128.332   17.456  10.589 0.8783 11.089 0.7871 -0.4999819     1.179388  
1 1 1 4  4  29 o 4.0768 1.0037 19.386   10.024  19.880    14.616  18.948    13.774  4.1179 1.4400 4.0358 1.3987 0.8214664E-01  2.007469  
1 1 1 4  4  30 o 3.5907 0.9771 13.253   10.209  20.867    14.766  6.2809    14.130  4.0770 1.4455 3.1044 1.3151 0.9726067      1.954200  
1 1 1 4  4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  5  0  o 19.834 0.6562 397.366  25.889  411.183   36.669  383.635   36.556  20.183 0.9127 19.484 0.9431 -0.000000      0.000000  
1 1 1 4  5  1  o 10.749 0.4662 115.935  10.020  114.158   14.138  117.728   14.204  10.666 0.6628 10.832 0.6557 -0.1658850     0.9323002 
1 1 1 4  5  2  o 15.253 0.4564 233.445  13.920  236.488   19.651  230.379   19.722  15.353 0.6400 15.153 0.6508 0.2004499      0.9127194 
1 1 1 4  5  3  o 24.023 0.4733 579.003  22.741  573.296   32.112  584.745   32.209  23.904 0.6717 24.142 0.6671 -0.2380638     0.9466284 
1 1 1 4  5  4  o 20.736 0.4645 431.358  19.260  441.571   27.262  421.182   27.214  20.982 0.6497 20.490 0.6641 0.4915352      0.9290060 
1 1 1 4  5  5  o 7.1514 0.5101 51.388   7.2899  52.569    10.183  50.147    10.441  7.2364 0.7036 7.0664 0.7388 0.1700630      1.020203  
1 1 1 4  5  6  o 26.469 0.4843 703.529  25.635  714.540   36.300  692.574   36.207  26.676 0.6804 26.262 0.6893 0.4146519      0.9685671 
1 1 1 4  5  7  o 15.365 0.4623 236.975  14.197  246.519   20.100  227.473   20.056  15.674 0.6412 15.055 0.6661 0.6196861      0.9245582 
1 1 1 4  5  8  o 7.8527 0.5098 61.966   7.9855  67.339    11.323  56.650    11.264  8.1929 0.6910 7.5125 0.7497 0.6804447      1.019561  
1 1 1 4  5  9  o 33.824 0.5184 1148.10  35.067  1139.73   49.532  1156.51   49.653  33.701 0.7349 33.948 0.7313 -0.2477608     1.036746  
1 1 1 4  5  10 o 25.471 0.4858 650.780  24.737  671.989   34.929  629.440   35.036  25.889 0.6746 25.053 0.6992 0.8354588      0.9716178 
1 1 1 4  5  11 o 25.014 0.4872 627.829  24.371  636.114   34.324  619.406   34.609  25.181 0.6815 24.846 0.6965 0.3346672      0.9744456 
1 1 1 4  5  12 o 14.653 0.6059 224.824  14.829  232.641   17.010  200.065   30.272  15.232 0.5583 14.074 1.0755 1.157948       1.211754  
1 1 1 4  5  13 o 29.060 0.5985 852.248  30.123  854.038   34.817  846.918   60.070  29.172 0.5967 28.947 1.0376 0.2251225      1.196950  
1 1 1 4  5  14 o 16.372 0.6064 268.692  18.482  265.199   22.309  276.334   32.999  16.233 0.6872 16.511 0.9993 -0.2784061     1.212766  
1 1 1 4  5  15 o 15.330 0.5230 239.141  15.913  210.077   22.840  266.560   22.184  14.406 0.7927 16.253 0.6824 -1.846927      1.045987  
1 1 1 4  5  16 o 11.956 0.5546 145.895  13.208  144.683   19.538  146.914   17.924  11.900 0.8209 12.013 0.7460 -0.1137171     1.109272  
1 1 1 4  5  17 f 15.568 0.5296 246.513  16.475  251.146   23.866  242.295   22.771  15.703 0.7599 15.432 0.7378 0.2711792      1.059122  
1 1 1 4  5  18 o 7.6287 0.8016 60.913   11.806  49.118    15.778  75.914    17.795  6.7265 1.2177 8.5310 1.0430 -1.804484      1.603288  
1 1 1 4  5  19 o 13.032 0.5715 174.294  14.878  185.226   21.665  164.538   20.466  13.418 0.8073 12.646 0.8092 0.7723799      1.143047  
1 1 1 4  5  20 o 11.780 0.5972 144.874  13.966  137.800   20.718  150.764   18.907  11.484 0.9020 12.077 0.7828 -0.5921488     1.194308  
1 1 1 4  5  21 o 6.0551 0.9339 40.759   10.968  52.397    16.840  32.185    14.454  6.8234 1.2811 5.2868 1.3594 1.536648       1.867897  
1 1 1 4  5  22 o 12.318 0.6233 158.407  15.336  161.391   22.329  155.742   21.101  12.417 0.8992 12.219 0.8635 0.1979790      1.246625  
1 1 1 4  5  23 o 13.423 0.6279 188.434  16.787  177.671   24.361  198.166   23.165  13.027 0.9350 13.819 0.8382 -0.7919073     1.255716  
1 1 1 4  5  24 o 2.3564 0.7814 -11.9575 9.3981  -6.9522   12.493  -18.4829  14.264  2.4551 1.1251 2.2577 1.0847 0.1973512      1.562833  
1 1 1 4  5  25 f 12.749 0.5255 166.618  13.282  171.834   20.281  162.702   17.575  12.902 0.7860 12.596 0.6976 0.3055983      1.050931  
1 1 1 4  5  26 o 11.243 0.5692 133.494  12.509  114.621   18.883  148.255   16.699  10.471 0.9017 12.015 0.6949 -1.544020      1.138374  
1 1 1 4  5  27 o 3.2389 0.8982 7.8787   8.8432  -1.7213   14.943  13.054    10.971  2.9188 1.2926 3.5590 1.2474 -0.6402667     1.796339  
1 1 1 4  5  28 o 2.3262 0.7611 -8.2060  8.5157  -18.3014  14.001  -2.2786   10.728  2.2094 1.0648 2.4429 1.0878 -0.2335837     1.522208  
1 1 1 4  5  29 o 3.8404 0.9832 17.050   10.222  8.0737    16.304  22.863    13.121  3.3704 1.4193 4.3104 1.3608 -0.9400594     1.966303  
1 1 1 4  5  30 o 4.0978 0.9192 19.858   10.529  -2.2710   16.273  35.794    13.809  2.8472 1.2969 5.3485 1.3029 -2.501328      1.838380  
1 1 1 4  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  6  0  o 41.153 0.7870 1704.75  64.651  1657.41   91.091  1752.80   91.773  40.574 1.1245 41.733 1.1013 -0.000000      0.000000  
1 1 1 4  6  1  f 14.103 0.4624 199.491  13.043  198.529   18.466  200.449   18.425  14.068 0.6563 14.137 0.6517 -0.6813526E-01 0.9248610 
1 1 1 4  6  2  o 26.714 0.4857 716.176  25.945  729.467   36.667  702.849   36.716  26.963 0.6799 26.465 0.6937 0.4983158      0.9713343 
1 1 1 4  6  3  o 17.017 0.4616 290.598  15.707  298.214   22.185  282.942   22.242  17.242 0.6433 16.793 0.6622 0.4488411      0.9232816 
1 1 1 4  6  4  o 19.156 0.4651 368.255  17.818  368.863   25.250  367.652   25.148  19.172 0.6585 19.141 0.6569 0.3134918E-01  0.9301627 
1 1 1 4  6  5  o 21.492 0.4706 463.747  20.229  462.508   28.613  464.984   28.603  21.463 0.6666 21.521 0.6645 -0.5761909E-01 0.9412255 
1 1 1 4  6  6  o 17.225 0.4639 297.780  15.981  293.857   22.627  301.684   22.574  17.111 0.6612 17.338 0.6510 -0.2273388     0.9278727 
1 1 1 4  6  7  o 11.867 0.4764 141.248  11.307  140.559   15.940  141.946   16.043  11.838 0.6732 11.896 0.6743 -0.5822849E-01 0.9528165 
1 1 1 4  6  8  f 19.531 0.4697 382.640  18.346  388.287   25.930  376.978   25.962  19.675 0.6589 19.386 0.6696 0.2895947      0.9394526 
1 1 1 4  6  9  o 36.915 0.5353 1367.18  39.518  1360.86   55.680  1373.59   56.096  36.829 0.7559 37.001 0.7580 -0.1714401     1.070543  
1 1 1 4  6  10 o 30.615 0.5077 940.670  31.082  960.992   43.874  920.195   44.039  30.949 0.7088 30.282 0.7272 0.6666698      1.015465  
1 1 1 4  6  11 o 33.096 0.5210 1100.47  34.470  1129.20   48.438  1070.99   49.064  33.536 0.7222 32.655 0.7512 0.8811340      1.042063  
1 1 1 4  6  12 o 15.939 0.4550 259.723  14.114  278.908   18.395  232.262   22.008  16.676 0.5515 15.202 0.7239 1.474271       0.9100406 
1 1 1 4  6  13 o 7.1210 0.7858 50.705   8.7088  49.695    9.7180  54.822    19.625  7.0317 0.6910 7.2102 1.4115 -0.1785383     1.571534  
1 1 1 4  6  14 o 19.916 0.5837 402.309  19.992  403.334   23.036  399.182   40.243  20.026 0.5751 19.805 1.0160 0.2216206      1.167488  
1 1 1 4  6  15 o 13.813 0.6332 201.603  14.555  208.189   16.674  180.512   29.836  14.375 0.5800 13.250 1.1259 1.124791       1.266448  
1 1 1 4  6  16 o 9.9960 0.6336 101.229  12.667  101.229   12.667  0.0000    0.0000  9.9960 0.6336 ?      ?      ?              ?         
1 1 1 4  6  17 o 4.1775 0.9959 17.902   10.863  26.747    13.444  1.2678    18.437  4.9190 1.3332 3.4359 1.4799 1.483126       1.991899  
1 1 1 4  6  18 o 8.1778 0.7846 66.920   12.270  83.328    21.452  58.943    14.958  8.8426 1.2130 7.5130 0.9955 1.329577       1.569174  
1 1 1 4  6  19 o 6.6904 0.8125 47.950   10.510  49.620    16.185  46.732    13.821  6.7123 1.2517 6.6686 1.0363 0.4362249E-01  1.624980  
1 1 1 4  6  20 o 24.250 0.5410 607.651  26.188  585.915   37.775  627.765   36.338  23.803 0.7935 24.696 0.7357 -0.8926086     1.082071  
1 1 1 4  6  21 f 8.4919 0.7415 77.927   12.379  66.442    18.193  87.829    16.892  7.8422 1.1599 9.1416 0.9239 -1.299394      1.482920  
1 1 1 4  6  22 o 8.2469 1.0123 71.768   15.760  61.315    19.257  92.972    27.427  7.3901 1.3527 9.1038 1.5063 -1.713709      2.024563  
1 1 1 4  6  23 o 9.7957 0.7331 101.739  14.198  121.702   20.504  83.350    19.680  10.763 0.9526 8.8286 1.1145 1.934030       1.466150  
1 1 1 4  6  24 o 14.400 0.6220 214.751  17.872  225.646   26.410  205.547   24.275  14.726 0.8967 14.075 0.8623 0.6504545      1.244069  
1 1 1 4  6  25 o 8.5543 0.8480 78.294   14.363  93.661    20.974  64.721    19.711  9.3807 1.1179 7.7279 1.2753 1.652859       1.695914  
1 1 1 4  6  26 o 7.6747 0.8945 64.545   13.308  64.329    17.743  64.823    20.122  7.7559 1.1438 7.5935 1.3756 0.1624708      1.788994  
1 1 1 4  6  27 o 2.8334 0.8684 -1.4081  8.6475  7.5484    15.133  -5.7505   10.537  3.4075 1.3950 2.2593 1.0347 1.148181       1.736818  
1 1 1 4  6  28 o 12.534 0.5990 169.944  14.525  144.057   22.404  188.714   19.077  11.589 0.9666 13.478 0.7077 -1.888367      1.197965  
1 1 1 4  6  29 o 5.0560 1.0075 30.535   10.561  44.745    17.319  22.123    13.325  5.8979 1.4727 4.2141 1.3754 1.683792       2.015077  
1 1 1 4  6  30 o 8.9067 0.7520 91.841   12.928  88.011    20.743  94.273    16.531  8.5843 1.2082 9.2292 0.8956 -0.6449566     1.503931  
1 1 1 4  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  7  0  o 18.181 0.6684 334.419  24.150  327.305   34.142  341.543   34.165  17.984 0.9554 18.378 0.9350 -0.000000      0.000000  
1 1 1 4  7  1  o 22.761 0.4743 519.932  21.589  519.031   30.526  520.834   30.538  22.741 0.6712 22.780 0.6703 -0.3957367E-01 0.9485285 
1 1 1 4  7  2  o 17.953 0.4669 323.497  16.763  327.624   23.764  319.411   23.649  18.068 0.6576 17.839 0.6628 0.2284050      0.9337218 
1 1 1 4  7  3  o 10.998 0.4767 121.547  10.474  115.054   14.829  128.012   14.797  10.704 0.6927 11.293 0.6552 -0.5891867     0.9534512 
1 1 1 4  7  4  o 11.174 0.4834 125.434  10.796  130.979   15.293  119.926   15.242  11.421 0.6695 10.927 0.6975 0.4943771      0.9667985 
1 1 1 4  7  5  o 22.407 0.4765 503.771  21.352  513.016   30.264  494.608   30.130  22.612 0.6692 22.202 0.6785 0.4104309      0.9530129 
1 1 1 4  7  6  o 7.8360 0.5392 61.830   8.4018  54.045    11.841  69.724    11.923  7.3358 0.8071 8.3361 0.7152 -1.000255      1.078336  
1 1 1 4  7  7  o 20.767 0.4743 432.635  19.701  428.303   27.845  436.977   27.877  20.663 0.6738 20.871 0.6678 -0.2087574     0.9486945 
1 1 1 4  7  8  o 16.465 0.4723 271.887  15.549  274.613   21.758  269.043   22.228  16.550 0.6573 16.380 0.6785 0.1700554      0.9446906 
1 1 1 4  7  9  o 19.177 0.5880 366.316  21.158  378.102   37.275  360.713   25.700  19.389 0.9613 18.965 0.6776 0.4235172      1.176059  
1 1 1 4  7  10 o 26.360 0.4950 697.372  26.093  701.624   36.578  692.966   37.232  26.443 0.6916 26.277 0.7085 0.1658630      0.9900944 
1 1 1 4  7  11 o 18.854 0.4813 357.565  18.117  376.150   25.370  338.227   25.879  19.357 0.6553 18.350 0.7051 1.007267       0.9626316 
1 1 1 4  7  12 o 13.753 0.6197 197.094  14.317  203.005   16.440  178.541   29.128  14.224 0.5779 13.282 1.0965 0.9419680      1.239457  
1 1 1 4  7  13 o 25.970 0.5938 685.899  26.676  691.040   30.861  670.706   53.058  26.226 0.5884 25.714 1.0317 0.5125618      1.187666  
1 1 1 4  7  14 o 6.1208 0.7098 37.830   8.6888  37.830    8.6888  0.0000    0.0000  6.1208 0.7098 ?      ?      ?              ?         
1 1 1 4  7  15 f 14.395 0.6484 216.632  16.589  222.077   19.587  202.818   31.199  14.806 0.6615 13.984 1.1155 0.8216562      1.296856  
1 1 1 4  7  16 o 11.284 0.7410 143.029  14.483  159.300   17.352  105.666   26.294  12.535 0.6922 10.033 1.3104 2.501887       1.481956  
1 1 1 4  7  17 o 9.2596 0.7323 92.022   10.830  94.184    12.207  84.032    23.467  9.6338 0.6336 8.8855 1.3205 0.7482224      1.464629  
1 1 1 4  7  18 o 9.1473 0.8613 96.764   11.505  101.348   12.879  78.646    25.603  9.9773 0.6454 8.3172 1.5972 1.660020       1.722663  
1 1 1 4  7  19 o 6.2045 1.3333 43.375   16.052  43.375    16.052  0.0000    0.0000  6.2045 1.3333 ?      ?      ?              ?         
1 1 1 4  7  20 o 8.8620 0.9547 88.830   15.610  93.989    19.711  80.152    25.565  9.4197 1.0463 8.3044 1.5973 1.115304       1.909429  
1 1 1 4  7  21 o 11.363 0.6600 137.928  14.720  115.660   21.629  157.143   20.090  10.429 1.0369 12.296 0.8169 -1.866983      1.320062  
1 1 1 4  7  22 o 6.6805 0.9550 50.273   12.207  49.889    18.677  50.560    16.128  6.6015 1.4539 6.7595 1.2386 -0.1580315     1.909960  
1 1 1 4  7  23 o 10.616 0.7209 119.089  15.243  125.145   22.806  114.198   20.492  10.840 1.0520 10.393 0.9858 0.4461575      1.441704  
1 1 1 4  7  24 o 6.2201 1.0495 44.181   12.824  46.019    19.157  42.688    17.264  6.3163 1.5321 6.1239 1.4347 0.1923962      2.098970  
1 1 1 4  7  25 o 6.7961 1.0436 53.895   13.817  44.734    21.722  60.121    17.907  6.1179 1.7093 7.4743 1.1979 -1.356399      2.087272  
1 1 1 4  7  26 o 14.491 0.6596 219.672  19.097  219.236   27.602  220.072   26.449  14.463 0.9543 14.520 0.9108 -0.5728245E-01 1.319149  
1 1 1 4  7  27 o 10.752 0.8001 125.141  17.163  132.694   25.399  118.794   23.283  11.035 1.1509 10.469 1.1120 0.5652409      1.600287  
1 1 1 4  7  28 o 5.1537 1.1108 33.484   13.419  45.440    18.071  18.784    20.037  6.0968 1.4937 4.2106 1.6444 1.886142       2.221577  
1 1 1 4  7  29 o 4.8810 1.0554 27.465   10.943  44.399    19.109  19.203    13.348  5.7749 1.5996 3.9870 1.3771 1.787936       2.110731  
1 1 1 4  7  30 o 10.653 0.7056 131.402  14.472  120.882   23.045  138.252   18.596  10.089 1.1421 11.217 0.8289 -1.127741      1.411175  
1 1 1 4  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  8  0  o 12.751 0.6933 166.070  17.436  169.155   24.995  163.147   24.335  12.867 0.9846 12.634 0.9764 -0.000000      0.000000  
1 1 1 4  8  1  o 11.785 0.4883 139.636  11.495  131.976   16.311  147.193   16.202  11.462 0.7115 12.108 0.6691 -0.6459599     0.9766994 
1 1 1 4  8  2  o 17.255 0.4712 298.956  16.256  308.483   22.993  289.434   22.986  17.531 0.6558 16.979 0.6769 0.5519829      0.9424463 
1 1 1 4  8  3  o 29.063 0.4990 847.867  29.003  858.593   41.039  837.164   40.994  29.248 0.7016 28.879 0.7098 0.3685341      0.9979751 
1 1 1 4  8  4  o 18.216 0.4723 332.760  17.205  331.370   24.172  334.187   24.495  18.177 0.6649 18.254 0.6710 -0.7662964E-01 0.9445900 
1 1 1 4  8  5  o 18.003 0.4721 325.362  16.980  342.923   24.004  307.774   24.023  18.491 0.6491 17.515 0.6858 0.9762421      0.9442469 
1 1 1 4  8  6  o 22.994 0.4810 530.379  22.121  528.620   31.120  532.174   31.449  22.956 0.6778 23.032 0.6827 -0.7650948E-01 0.9620561 
1 1 1 4  8  7  o 29.647 0.5037 881.354  29.861  852.487   41.916  911.102   42.551  29.153 0.7189 30.140 0.7059 -0.9872265     1.007499  
1 1 1 4  8  8  o 25.917 0.4923 673.859  25.513  683.673   35.867  663.806   36.300  26.109 0.6869 25.725 0.7056 0.3842239      0.9846730 
1 1 1 4  8  9  o 12.166 0.4869 148.478  11.847  145.669   16.660  151.351   16.850  12.049 0.6913 12.282 0.6859 -0.2330608     0.9738718 
1 1 1 4  8  10 o 10.987 0.5963 122.871  12.616  115.934   20.547  127.071   15.985  10.725 0.9579 11.248 0.7105 -0.5230732     1.192632  
1 1 1 4  8  11 o 32.793 0.5247 1081.78  34.394  1110.68   48.308  1052.07   48.980  33.241 0.7266 32.345 0.7572 0.8961601      1.049421  
1 1 1 4  8  12 o 27.945 0.5844 763.465  28.481  740.216   32.780  835.076   57.530  27.152 0.6036 28.738 1.0009 -1.585791      1.168881  
1 1 1 4  8  13 o 15.119 0.6185 232.530  15.672  233.222   17.854  230.208   32.708  15.225 0.5864 15.014 1.0892 0.2108126      1.237041  
1 1 1 4  8  14 o 9.5666 0.7276 101.021  11.172  106.986   12.735  81.096    23.274  10.299 0.6183 8.8341 1.3173 1.464997       1.455182  
1 1 1 4  8  15 o 5.9001 0.9273 37.135   9.0516  37.022    10.143  37.577    20.058  6.0144 0.8432 5.7858 1.6517 0.2286224      1.854530  
1 1 1 4  8  16 o 7.7472 0.9093 74.427   10.227  80.856    11.478  49.646    22.534  8.9221 0.6432 6.5723 1.7011 2.349714       1.818669  
1 1 1 4  8  17 o 5.2444 0.9146 29.734   7.8644  29.857    8.6313  29.128    19.084  5.3899 0.8007 5.0988 1.6446 0.2910976      1.829132  
1 1 1 4  8  18 o 9.3249 0.8982 105.680  12.144  114.034   13.711  75.271    26.158  10.579 0.6480 8.0707 1.6754 2.508475       1.796352  
1 1 1 4  8  19 o 11.051 0.7585 135.112  13.173  139.003   14.818  120.444   28.767  11.661 0.6354 10.442 1.3775 1.219100       1.516957  
1 1 1 4  8  20 o 12.261 0.7085 159.225  14.263  159.090   16.150  159.703   30.407  12.454 0.6484 12.067 1.2599 0.3876333      1.416958  
1 1 1 4  8  21 o 5.4462 1.2314 30.235   15.027  17.683    18.378  55.553    26.103  4.2242 1.5938 6.6683 1.8775 -2.444144      2.462772  
1 1 1 4  8  22 o 4.4179 1.0763 20.360   11.244  25.510    18.416  17.299    14.197  4.7707 1.6184 4.0651 1.4194 0.7056475      2.152637  
1 1 1 4  8  23 o 4.4088 1.0278 15.589   11.898  39.647    18.648  -0.9290   15.452  5.7969 1.5698 3.0208 1.3271 2.776105       2.055564  
1 1 1 4  8  24 o 7.2622 1.0300 61.176   14.355  50.657    22.294  68.625    18.762  6.5236 1.6938 8.0008 1.1725 -1.477143      2.060023  
1 1 1 4  8  25 o 5.7798 1.1250 39.217   13.314  40.834    20.406  38.018    17.568  5.8511 1.6645 5.7085 1.5140 0.1425858      2.250037  
1 1 1 4  8  26 o 13.394 0.7124 191.846  18.886  177.408   28.045  203.827   25.548  12.863 1.0901 13.925 0.9173 -1.062078      1.424742  
1 1 1 4  8  27 o 3.9808 1.1429 10.772   14.355  22.963    22.197  2.0093    18.820  4.5824 1.7461 3.3791 1.4750 1.203273       2.285706  
1 1 1 4  8  28 o 3.4691 1.0548 5.6612   13.376  -3.3768   21.713  11.189    16.981  3.2999 1.5012 3.6383 1.4822 -0.3384261     2.109662  
1 1 1 4  8  29 o 6.1101 1.2380 51.923   16.254  69.704    24.536  38.017    21.698  7.0746 1.7450 5.1457 1.7567 1.928991       2.476037  
1 1 1 4  8  30 o 5.4822 1.0152 43.722   11.583  31.444    19.949  49.968    14.227  4.5565 1.6715 6.4079 1.1525 -1.851406      2.030330  
1 1 1 4  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  8  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  9  0  o 22.092 0.6871 492.389  30.221  501.297   42.730  483.473   42.749  22.294 0.9624 21.889 0.9810 -0.000000      0.000000  
1 1 1 4  9  1  o 27.751 0.4956 772.576  27.508  768.391   38.812  776.800   38.994  27.676 0.7012 27.827 0.7007 -0.1510906     0.9912509 
1 1 1 4  9  2  o 45.083 0.5812 2041.57  52.408  2042.48   74.042  2040.66   74.191  45.093 0.8210 45.072 0.8230 0.2055359E-01  1.162494  
1 1 1 4  9  3  o 18.416 0.4739 340.225  17.456  337.199   24.573  343.307   24.803  18.334 0.6702 18.499 0.6704 -0.1652966     0.9478987 
1 1 1 4  9  4  o 12.525 0.4933 157.546  12.319  142.182   17.285  173.405   17.562  11.902 0.7261 13.148 0.6679 -1.245743      0.9865812 
1 1 1 4  9  5  o 21.679 0.4795 471.301  20.790  468.100   29.244  474.571   29.561  21.605 0.6768 21.753 0.6795 -0.1485538     0.9590280 
1 1 1 4  9  6  o 27.268 0.4968 745.567  27.090  737.146   38.067  754.208   38.561  27.112 0.7020 27.424 0.7030 -0.3118515     0.9935400 
1 1 1 4  9  7  o 15.358 0.4807 236.651  14.757  246.051   20.859  227.231   20.881  15.664 0.6658 15.051 0.6937 0.6127968      0.9614920 
1 1 1 4  9  8  o 37.889 0.6689 1456.20  47.968  1407.81   81.683  1481.67   59.263  37.365 1.0930 38.413 0.7714 -1.047588      1.337823  
1 1 1 4  9  9  o 21.509 0.4870 464.357  20.944  456.764   29.292  472.300   29.959  21.330 0.6867 21.689 0.6906 -0.3592052     0.9739004 
1 1 1 4  9  10 o 27.499 0.5032 760.075  27.665  769.823   38.837  750.033   39.417  27.680 0.7015 27.318 0.7215 0.3618450      1.006310  
1 1 1 4  9  11 o 18.094 0.4889 329.419  17.674  342.017   24.759  316.329   25.237  18.450 0.6710 17.738 0.7114 0.7115746      0.9778765 
1 1 1 4  9  12 o 15.460 0.6107 244.460  16.084  246.921   18.489  236.804   32.616  15.670 0.5899 15.250 1.0694 0.4203482      1.221301  
1 1 1 4  9  13 o 16.815 0.6313 299.697  17.738  311.176   20.384  263.895   35.999  17.582 0.5797 16.047 1.1217 1.535021       1.262624  
1 1 1 4  9  14 o 19.333 0.6158 384.782  20.130  386.591   23.047  378.962   41.335  19.553 0.5893 19.112 1.0814 0.4414215      1.231554  
1 1 1 4  9  15 o 18.259 0.5950 334.797  18.752  329.414   21.557  351.539   38.016  18.055 0.5970 18.463 1.0295 -0.4081726     1.190065  
1 1 1 4  9  16 o 10.096 0.7126 102.552  11.718  100.267   13.139  111.434   25.903  9.9335 0.6614 10.259 1.2624 -0.3254280     1.425187  
1 1 1 4  9  17 o 7.9612 0.9640 81.374   11.133  89.293    12.497  50.928    24.504  9.3590 0.6677 6.5634 1.8087 2.795637       1.928026  
1 1 1 4  9  18 o 7.5539 0.9838 79.654   11.156  90.821    12.580  38.544    24.137  9.4230 0.6675 5.6849 1.8509 3.738101       1.967551  
1 1 1 4  9  19 o 9.2697 0.8304 91.089   12.111  90.417    13.499  93.864    27.419  9.3807 0.7195 9.1587 1.4969 0.2219791      1.660854  
1 1 1 4  9  20 o 10.773 0.7805 126.049  13.548  127.454   15.296  120.929   29.188  11.136 0.6868 10.410 1.4019 0.7255135      1.561064  
1 1 1 4  9  21 o 5.9394 0.9368 55.440   10.174  64.556    10.992  0.9040    26.884  7.9344 0.6927 3.9444 1.7409 3.989967       1.873670  
1 1 1 4  9  22 o 8.7818 1.0175 83.989   12.490  82.649    13.595  91.246    31.636  8.9470 0.7597 8.6166 1.8879 0.3303852      2.035046  
1 1 1 4  9  23 o 10.133 1.0968 119.596  19.960  127.841   24.728  104.178   33.815  10.960 1.1281 9.3066 1.8814 1.653803       2.193676  
1 1 1 4  9  24 o 3.6360 1.0158 -1.9623  11.947  27.186    20.183  -17.6819  14.822  4.9245 1.6939 2.3474 1.1218 2.577087       2.031678  
1 1 1 4  9  25 o 7.6535 1.0252 64.279   15.184  89.708    23.404  45.797    19.953  9.0702 1.2901 6.2368 1.5937 2.833427       2.050433  
1 1 1 4  9  26 o 5.5106 1.1858 37.423   14.241  33.147    22.702  40.197    18.286  5.2263 1.7965 5.7948 1.5483 -0.5685210     2.371637  
1 1 1 4  9  27 o 3.7517 1.1137 8.6378   13.885  13.053    21.901  5.6706    17.954  4.0351 1.6679 3.4683 1.4763 0.5667555      2.227394  
1 1 1 4  9  28 o 12.599 0.8249 185.796  20.159  150.466   29.819  215.535   27.358  11.231 1.3275 13.966 0.9794 -2.735178      1.649740  
1 1 1 4  9  29 o 5.5798 1.2401 47.697   16.474  32.479    25.763  58.225    21.428  4.6765 1.8528 6.4831 1.6488 -1.806579      2.480238  
1 1 1 4  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  10 0  o 32.647 0.7361 1073.05  47.945  1094.24   67.822  1051.89   67.786  32.972 1.0308 32.322 1.0511 -0.000000      0.000000  
1 1 1 4  10 1  o 35.642 0.5313 1275.18  37.874  1281.31   53.543  1269.04   53.581  35.728 0.7493 35.556 0.7535 0.1722794      1.062618  
1 1 1 4  10 2  o 17.412 0.4791 304.064  16.685  303.097   23.583  305.033   23.608  17.384 0.6783 17.439 0.6769 -0.5553627E-01 0.9582568 
1 1 1 4  10 3  o 28.574 0.5018 819.009  28.675  823.828   40.467  814.148   40.640  28.658 0.7060 28.489 0.7133 0.1697636      1.003600  
1 1 1 4  10 4  o 25.314 0.4927 642.602  24.943  640.387   35.180  644.841   35.371  25.271 0.6961 25.358 0.6974 -0.8760643E-01 0.9853449 
1 1 1 4  10 5  o 16.381 0.4838 268.968  15.843  258.288   22.163  280.130   22.657  16.049 0.6905 16.714 0.6778 -0.6656570     0.9675610 
1 1 1 4  10 6  o 5.9148 0.6580 35.751   7.5878  39.168    10.741  32.346    10.721  6.2431 0.8602 5.5866 0.9960 0.6564479      1.316077  
1 1 1 4  10 7  f 22.045 0.4894 487.557  21.577  479.323   30.256  496.078   30.781  21.856 0.6922 22.234 0.6922 -0.3787041     0.9788966 
1 1 1 4  10 8  f 37.925 0.6721 1439.22  48.140  1480.69   83.625  1418.67   58.874  38.284 1.0922 37.566 0.7836 0.7177849      1.344195  
1 1 1 4  10 9  o 12.545 0.5037 158.166  12.632  164.623   17.922  151.792   17.806  12.800 0.7001 12.289 0.7245 0.5110168      1.007455  
1 1 1 4  10 10 o 14.564 0.5005 213.523  14.553  226.884   20.501  199.949   20.663  15.027 0.6822 14.101 0.7327 0.9253044      1.001063  
1 1 1 4  10 11 o 13.432 0.6257 186.513  14.502  190.687   16.826  174.455   28.600  13.771 0.6109 13.093 1.0922 0.6777925      1.251436  
1 1 1 4  10 12 o 22.145 0.6015 495.485  22.910  493.770   26.364  500.777   46.299  22.145 0.5952 22.145 1.0453 -0.1907349E-05 1.202943  
1 1 1 4  10 13 o 17.656 0.6214 320.169  18.633  321.908   21.373  314.662   38.032  17.855 0.5985 17.458 1.0892 0.3965645      1.242861  
1 1 1 4  10 14 o 20.547 0.6070 432.418  21.456  433.346   24.740  429.603   43.096  20.706 0.5974 20.388 1.0569 0.3184471      1.214051  
1 1 1 4  10 15 o 8.6227 0.9260 83.516   11.772  85.605    13.109  74.817    26.754  9.1613 0.7155 8.0840 1.7083 1.077375       1.852039  
1 1 1 4  10 16 o 9.7343 0.8040 104.441  12.384  107.665   13.963  92.559    26.807  10.271 0.6797 9.1972 1.4573 1.074246       1.608039  
1 1 1 4  10 17 o 13.191 0.7093 180.442  17.155  178.212   20.497  185.655   31.343  13.170 0.7782 13.211 1.1862 -0.4079247E-01 1.418698  
1 1 1 4  10 18 o 5.1894 1.0608 25.241   8.9287  22.497    9.6396  41.813    23.689  4.5157 1.0816 5.8630 1.8251 -1.347302      2.121509  
1 1 1 4  10 19 o 10.418 0.8052 122.663  13.286  127.214   15.035  106.443   28.385  11.127 0.6756 9.7095 1.4617 1.417027       1.610320  
1 1 1 4  10 20 o 10.727 0.8600 133.910  13.834  139.862   15.453  109.882   31.049  11.676 0.6617 9.7781 1.5877 1.897824       1.720055  
1 1 1 4  10 21 o 5.0401 0.9528 34.901   9.4426  39.978    10.073  -1.8938   27.117  6.2154 0.8103 3.8648 1.7246 2.350591       1.905520  
1 1 1 4  10 22 o 5.3593 1.0360 35.444   9.7149  37.586    10.430  21.409    26.695  5.9993 0.8693 4.7194 1.8809 1.279909       2.072083  
1 1 1 4  10 23 f 7.4123 1.1138 67.945   12.014  70.458    13.055  54.050    30.702  8.2648 0.7898 6.5598 2.0828 1.704920       2.227535  
1 1 1 4  10 24 o 6.4987 1.2062 43.689   11.050  42.151    11.645  57.583    35.002  6.3514 0.9168 6.6461 2.2313 -0.2947259     2.412307  
1 1 1 4  10 25 o 15.037 0.8880 243.882  25.162  241.602   30.862  248.400   43.454  15.131 1.0198 14.943 1.4540 0.1876783      1.775986  
1 1 1 4  10 26 o 3.2109 0.9826 -2.5343  12.980  -29.4737  21.883  12.088    16.122  2.6890 1.3044 3.7329 1.4699 -1.043908      1.965216  
1 1 1 4  10 27 o 8.5392 1.0410 87.271   17.094  79.543    25.543  93.540    23.005  7.9857 1.6537 9.0926 1.2650 -1.106954      2.082075  
1 1 1 4  10 28 o 5.3020 1.2785 39.747   16.015  44.712    25.319  36.435    20.677  5.4807 1.8965 5.1233 1.7150 0.3574390      2.556933  
1 1 1 4  10 29 o 2.9197 0.9847 -12.5115 15.097  -3.6395   25.106  -17.5369  18.895  3.2814 1.5350 2.5581 1.2339 0.7232826      1.969454  
1 1 1 4  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  11 0  o 41.281 0.7985 1714.11  65.815  1701.01   92.723  1727.41   93.434  41.122 1.1293 41.440 1.1292 -0.000000      0.000000  
1 1 1 4  11 1  o 23.780 0.4897 567.121  23.287  573.951   32.875  560.241   32.992  23.925 0.6870 23.636 0.6979 0.2885017      0.9793569 
1 1 1 4  11 2  o 31.621 0.5170 1003.11  32.693  1009.81   46.199  996.390   46.272  31.728 0.7281 31.515 0.7341 0.2123585      1.033922  
1 1 1 4  11 3  o 13.588 0.4954 185.310  13.452  194.891   19.056  175.794   18.991  13.940 0.6835 13.237 0.7173 0.7025146      0.9908505 
1 1 1 4  11 4  o 13.221 0.5043 175.492  13.323  166.789   18.834  184.207   18.849  12.892 0.7305 13.550 0.6955 -0.6586857     1.008629  
1 1 1 4  11 5  o 4.7238 0.8543 24.593   8.1675  29.473    10.264  16.168    13.486  5.3249 1.0005 4.1227 1.3850 1.202237       1.708578  
1 1 1 4  11 6  o 17.529 0.4882 308.447  17.108  297.866   24.126  319.150   24.263  17.226 0.7003 17.832 0.6803 -0.6067123     0.9763454 
1 1 1 4  11 7  o 27.842 0.5072 778.680  28.240  773.465   39.672  784.036   40.207  27.747 0.7149 27.936 0.7196 -0.1881199     1.014358  
1 1 1 4  11 8  f 33.289 0.5304 1114.58  35.299  1147.40   49.886  1081.68   49.953  33.783 0.7383 32.796 0.7616 0.9873695      1.060733  
1 1 1 4  11 9  o 31.239 0.5234 981.938  32.688  1010.50   46.042  952.909   46.415  31.701 0.7262 30.777 0.7540 0.9232502      1.046873  
1 1 1 4  11 10 o 8.0451 0.6049 65.452   9.7253  68.437    13.747  62.461    13.761  8.2308 0.8351 7.8593 0.8754 0.3714895      1.209848  
1 1 1 4  11 11 o 13.845 0.6837 203.139  15.598  209.932   17.803  180.704   32.355  14.436 0.6166 13.254 1.2206 1.182128       1.367471  
1 1 1 4  11 12 o 15.907 0.6354 253.045  17.257  248.415   19.726  268.146   35.622  15.683 0.6289 16.130 1.1042 -0.4465857     1.270740  
1 1 1 4  11 13 o 5.6786 0.9794 38.023   9.8573  41.125    11.071  26.155    21.657  6.3341 0.8739 5.0230 1.7531 1.311062       1.958801  
1 1 1 4  11 14 o 2.8387 0.8799 1.6641   7.5054  4.0480    8.0482  -14.2457  20.791  2.6050 1.0345 3.0725 1.4236 -0.4675529     1.759776  
1 1 1 4  11 15 f 9.4993 0.7750 87.046   12.213  81.537    13.676  108.750   27.144  8.9266 0.7660 10.072 1.3475 -1.145526      1.550008  
1 1 1 4  11 16 o 11.115 0.7424 127.880  13.674  126.635   15.490  132.274   29.106  11.137 0.6955 11.093 1.3119 0.4377174E-01  1.484873  
1 1 1 4  11 17 o 5.5025 1.0797 30.211   9.4031  28.276    10.118  42.459    25.460  5.0974 1.0280 5.9077 1.8989 -0.8103580     2.159338  
1 1 1 4  11 18 f 8.8537 0.9182 88.379   12.231  89.951    13.698  82.196    27.172  9.3514 0.7324 8.3560 1.6841 0.9954052      1.836431  
1 1 1 4  11 19 o 3.9565 0.8644 19.793   8.4978  26.031    9.1062  -22.2635  23.645  4.8957 0.9643 3.0172 1.4349 1.878487       1.728847  
1 1 1 4  11 20 f 3.7208 1.0632 -0.2775  7.3499  -3.2594   7.6584  34.512    26.158  2.0089 0.9049 5.4327 1.9242 -3.423834      2.126325  
1 1 1 4  11 21 o 3.9044 1.0146 13.357   7.1860  13.224    7.5377  14.686    23.804  3.4946 1.0170 4.3141 1.7560 -0.8194828     2.029212  
1 1 1 4  11 22 o 8.3865 1.0489 77.706   12.739  76.865    13.966  81.871    31.082  8.6197 0.8101 8.1533 1.9351 0.4664869      2.097866  
1 1 1 4  11 23 o 5.7367 1.0462 46.065   10.538  50.717    11.166  8.1722    31.868  7.0070 0.7967 4.4664 1.9347 2.540534       2.092319  
1 1 1 4  11 24 f 6.4742 1.1151 55.912   11.861  59.916    12.821  32.140    31.242  7.5907 0.8445 5.3577 2.0642 2.233001       2.230244  
1 1 1 4  11 25 o 9.8584 1.1407 124.726  14.929  130.354   16.333  96.148    36.805  11.231 0.7271 8.4854 2.1624 2.746019       2.281392  
1 1 1 4  11 26 o 4.3076 1.1538 19.280   10.190  20.721    10.588  1.2259    37.481  4.2701 1.1935 4.3451 1.9750 -0.7499409E-01 2.307626  
1 1 1 4  11 27 o 7.9130 1.4547 83.506   21.884  72.288    26.247  109.093   39.640  7.3844 1.7947 8.4416 2.2899 -1.057181      2.909401  
1 1 1 4  11 28 f 4.2394 1.1918 21.685   16.145  5.9658    25.441  32.284    20.890  3.6744 1.6527 4.8044 1.7176 -1.130002      2.383622  
1 1 1 4  11 29 o 5.7674 1.1694 54.533   17.873  15.566    28.037  81.208    23.197  3.8670 1.7376 7.6678 1.5656 -3.800796      2.338841  
1 1 1 4  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  11 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  12 0  o 4.4790 1.2699 28.016   11.502  35.007    16.342  21.152    16.193  5.1857 1.7591 3.7724 1.8320 -0.000000      0.000000  
1 1 1 4  12 1  o 21.299 0.6050 461.287  24.181  440.291   41.746  471.888   29.663  20.911 0.9982 21.688 0.6839 -0.7768688     1.209982  
1 1 1 4  12 2  o 3.3101 0.8017 8.5750   7.0263  16.591    9.8371  0.2262    10.039  4.0120 1.1602 2.6082 1.1069 1.403849       1.603482  
1 1 1 4  12 3  o 10.419 0.5393 109.135  11.227  104.515   15.972  113.647   15.785  10.200 0.7829 10.639 0.7419 -0.4387674     1.078574  
1 1 1 4  12 4  o 2.2085 0.6855 -2.9320  5.9758  -7.1823   8.6249  0.9922    8.2875  1.9883 0.9197 2.4287 1.0167 -0.4404360     1.370995  
1 1 1 4  12 5  o 20.068 0.4916 404.476  19.724  416.288   27.959  392.773   27.828  20.361 0.6866 19.775 0.7036 0.5854740      0.9831014 
1 1 1 4  12 6  o 20.431 0.4968 419.444  20.300  422.714   28.661  416.152   28.758  20.512 0.6986 20.351 0.7065 0.1609077      0.9936285 
1 1 1 4  12 7  o 14.320 0.5092 206.152  14.584  203.926   20.659  208.362   20.591  14.243 0.7252 14.398 0.7151 -0.1551256     1.018479  
1 1 1 4  12 8  o 23.456 0.5087 553.300  23.861  552.170   33.418  554.475   34.080  23.433 0.7131 23.479 0.7258 -0.4649162E-01 1.017444  
1 1 1 4  12 9  o 16.596 0.5162 277.718  17.128  276.987   23.913  278.487   24.544  16.575 0.7213 16.617 0.7385 -0.4159737E-01 1.032353  
1 1 1 4  12 10 o 18.040 0.5094 329.173  18.351  343.792   25.696  313.955   26.218  18.456 0.6962 17.625 0.7438 0.8305740      1.018737  
1 1 1 4  12 11 o 11.814 0.7535 148.794  14.334  152.857   16.208  134.210   30.708  12.298 0.6590 11.330 1.3552 0.9675970      1.506913  
1 1 1 4  12 12 o 10.564 0.7473 116.103  13.414  116.460   15.397  114.978   27.323  10.700 0.7195 10.428 1.3101 0.2713871      1.494641  
1 1 1 4  12 13 o 8.5448 1.0156 92.966   12.511  102.072   14.039  57.850    27.570  10.023 0.7004 7.0670 1.9066 2.955666       2.031181  
1 1 1 4  12 14 o 12.807 0.7329 173.057  15.338  175.091   17.371  165.861   32.671  13.126 0.6617 12.489 1.3080 0.6374617      1.465864  
1 1 1 4  12 15 o 16.789 0.6334 281.541  18.396  271.694   21.094  312.807   37.589  16.335 0.6457 17.243 1.0899 -0.9087486     1.266841  
1 1 1 4  12 16 o 6.8934 1.0324 60.113   11.313  64.735    12.613  41.105    25.579  7.9240 0.7959 5.8628 1.9052 2.061179       2.064727  
1 1 1 4  12 17 o 10.085 0.8078 103.196  13.190  99.225    14.728  119.279   29.639  9.8117 0.7505 10.359 1.4306 -0.5472145     1.615546  
1 1 1 4  12 18 o 3.4720 0.9587 10.650   8.2214  12.592    8.8816  -0.9726   21.731  3.4430 1.1228 3.5010 1.5542 -0.5798697E-01 1.917357  
1 1 1 4  12 19 o 8.1294 1.0487 74.716   12.622  74.356    13.921  76.377    29.931  8.4572 0.8230 7.8016 1.9291 0.6556478      2.097339  
1 1 1 4  12 20 o 2.9540 0.9610 -3.4578  8.0492  -4.0923   8.5269  1.7342    24.390  2.0888 0.9465 3.8192 1.6728 -1.730355      1.922013  
1 1 1 4  12 21 o 3.3902 1.0331 5.4867   8.8791  6.0714    9.4040  0.6838    26.953  2.8740 1.1254 3.9065 1.7327 -1.032537      2.066125  
1 1 1 4  12 22 o 15.291 0.7410 236.097  18.543  228.439   20.798  265.770   40.939  14.934 0.6963 15.648 1.3082 -0.7130880     1.481948  
1 1 1 4  12 23 o 11.284 0.9110 138.294  15.679  138.351   17.367  138.043   36.460  11.592 0.7491 10.976 1.6609 0.6155672      1.822001  
1 1 1 4  12 24 o 8.5294 1.1435 79.562   13.845  77.704    15.031  89.956    35.555  8.6469 0.8692 8.4119 2.1155 0.2349806      2.287058  
1 1 1 4  12 25 f 4.7795 1.3013 17.033   11.470  13.959    12.065  45.913    36.981  3.6747 1.3062 5.8842 2.2510 -2.209482      2.602550  
1 1 1 4  12 26 o 6.5923 1.1843 35.451   10.406  29.899    10.926  89.628    34.132  5.1528 1.0941 8.0319 2.1008 -2.879126      2.368617  
1 1 1 4  12 27 o 12.815 1.1706 225.081  19.656  234.801   21.713  180.963   46.259  14.878 0.7297 10.752 2.2246 4.126012       2.341230  
1 1 1 4  12 28 o 5.6582 1.2581 44.268   12.294  43.334    12.818  55.012    43.471  6.0740 1.0954 5.2423 2.2652 0.8316979      2.516165  
1 1 1 4  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  12 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  13 0  o 3.8935 1.3092 22.499   11.772  19.227    16.923  25.567    16.387  3.5977 1.8476 4.1894 1.8554 -0.000000      0.000000  
1 1 1 4  13 1  o 2.3447 0.7256 -3.0352  6.6292  1.3469    9.4291  -7.3181   9.3219  2.6032 1.0867 2.0862 0.9619 0.5170188      1.451262  
1 1 1 4  13 2  o 14.523 0.5105 212.043  14.816  221.205   20.922  202.826   20.984  14.839 0.7049 14.206 0.7385 0.6329565      1.020965  
1 1 1 4  13 3  o 15.897 0.5030 253.913  15.985  263.618   22.737  244.427   22.478  16.199 0.7018 15.596 0.7206 0.6027079      1.005917  
1 1 1 4  13 4  o 10.203 0.5738 104.578  11.686  114.547   16.897  95.441    16.178  10.670 0.7918 9.7365 0.8308 0.9334459      1.147687  
1 1 1 4  13 5  f 23.678 0.5029 563.425  23.813  550.680   33.489  576.459   33.866  23.407 0.7154 23.950 0.7070 -0.5430031     1.005804  
1 1 1 4  13 6  o 2.5448 0.7546 0.2669   6.6787  4.4865    9.1182  -4.6171   9.8100  2.8003 1.1046 2.2892 1.0283 0.5111263      1.509117  
1 1 1 4  13 7  o 17.950 0.6131 305.809  20.910  389.103   37.243  267.464   25.269  19.609 0.9496 16.290 0.7756 3.319523       1.226104  
1 1 1 4  13 8  o 6.8377 0.6917 48.013   9.3593  53.712    12.918  41.716    13.578  7.2791 0.8874 6.3963 1.0614 0.8828077      1.383496  
1 1 1 4  13 9  o 14.373 0.5304 208.868  15.243  213.962   21.549  203.767   21.565  14.550 0.7405 14.195 0.7596 0.3547831      1.060810  
1 1 1 4  13 10 o 4.2514 1.0020 18.922   9.3576  21.490    10.533  9.3043    20.383  4.4738 1.1655 4.0289 1.6303 0.4449220      2.004096  
1 1 1 4  13 11 o 7.9893 0.9614 63.998   12.499  60.255    14.079  77.916    27.149  7.6557 0.9195 8.3230 1.6887 -0.6672435     1.922802  
1 1 1 4  13 12 o 15.567 0.6344 237.974  17.423  226.696   20.125  271.729   34.815  14.948 0.6732 16.186 1.0755 -1.237982      1.268784  
1 1 1 4  13 13 o 13.123 0.7278 178.220  15.732  177.704   17.802  180.059   33.617  13.221 0.6733 13.025 1.2905 0.1956444      1.455559  
1 1 1 4  13 14 o 11.804 0.7818 147.289  14.976  147.648   16.892  145.971   32.372  12.019 0.7027 11.588 1.3967 0.4311781      1.563545  
1 1 1 4  13 15 o 3.1268 0.9631 0.5992   8.6065  -0.5245   9.4246  6.2426    21.120  2.4250 1.0513 3.8286 1.6140 -1.403640      1.926189  
1 1 1 4  13 16 o 4.9612 1.0558 28.823   10.134  30.395    11.193  21.673    23.870  5.2559 1.1001 4.6666 1.8025 0.5893016      2.111675  
1 1 1 4  13 17 o 4.1924 1.0865 17.503   9.9587  18.139    10.837  14.052    25.251  4.0487 1.2299 4.3361 1.7915 -0.2874594     2.173045  
1 1 1 4  13 18 o 3.7140 1.0941 3.2915   10.191  -0.5930   11.092  24.330    25.813  2.5974 1.1331 4.8306 1.8720 -2.233167      2.188226  
1 1 1 4  13 19 o 7.6350 1.0923 67.486   12.618  68.093    13.913  64.674    29.959  8.0962 0.8592 7.1737 2.0085 0.9224730      2.184552  
1 1 1 4  13 20 o 5.9060 1.0664 45.670   11.895  50.906    13.230  23.584    27.173  6.9588 0.9506 4.8531 1.9092 2.105666       2.132754  
1 1 1 4  13 21 o 13.100 0.9341 215.404  18.037  237.161   20.452  139.244   38.264  15.225 0.6717 10.975 1.7432 4.249633       1.868128  
1 1 1 4  13 22 o 9.4182 1.1309 106.750  14.745  109.624   16.159  92.447    36.043  10.307 0.7838 8.5289 2.1217 1.778497       2.261851  
1 1 1 4  13 23 o 6.3232 1.1556 46.679   11.615  47.067    12.487  44.189    31.634  6.6997 0.9319 5.9468 2.1150 0.7529063      2.311173  
1 1 1 4  13 24 o 7.5111 1.2097 70.693   13.364  72.070    14.401  62.155    35.858  8.2975 0.8678 6.7248 2.2584 1.572698       2.419411  
1 1 1 4  13 25 o 5.4999 1.2431 34.111   11.427  33.702    12.006  38.040    37.221  5.4833 1.1323 5.5165 2.2133 -0.3314686E-01 2.486127  
1 1 1 4  13 26 o 8.9652 1.2075 99.789   15.692  99.286    17.219  102.253   38.114  9.6390 0.8932 8.2914 2.2438 1.347588       2.415027  
1 1 1 4  13 27 o 5.1765 1.3314 24.043   11.584  18.975    12.159  73.835    38.113  3.9642 1.3148 6.3888 2.3155 -2.424525      2.662712  
1 1 1 4  13 28 o 3.4314 0.9473 13.727   7.4540  15.677    7.5886  -39.7687  39.753  3.6322 1.0087 3.2306 1.6039 0.4015903      1.894687  
1 1 1 4  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  14 0  f 16.282 0.7248 269.666  23.381  262.358   33.058  276.982   33.074  16.055 1.0395 16.509 1.0103 -0.000000      0.000000  
1 1 1 4  14 1  o 22.548 0.5018 511.018  22.627  509.898   32.208  512.110   31.795  22.523 0.7150 22.574 0.7043 -0.5052757E-01 1.003604  
1 1 1 4  14 2  f 8.2045 0.7945 61.012   12.151  89.536    22.848  49.763    14.348  9.3919 1.2163 7.0171 1.0224 2.374813       1.588935  
1 1 1 4  14 3  o 9.2633 0.5994 86.452   11.079  78.698    15.491  94.572    15.852  8.8357 0.8766 9.6909 0.8179 -0.8552084     1.198875  
1 1 1 4  14 4  o 11.757 0.7235 141.459  15.466  143.799   18.470  135.967   28.293  11.952 0.7727 11.563 1.2234 0.3880949      1.446973  
1 1 1 4  14 5  o 6.8253 0.7581 48.582   9.9621  54.772    13.704  41.644    14.508  7.3575 0.9313 6.2931 1.1964 1.064445       1.516141  
1 1 1 4  14 6  o 9.9574 0.5945 100.152  11.798  89.085    16.330  112.238   17.065  9.3787 0.8706 10.536 0.8098 -1.157386      1.189019  
1 1 1 4  14 7  o 7.2838 0.7540 56.269   10.167  77.855    14.600  35.941    14.168  8.7654 0.8328 5.8021 1.2573 2.963251       1.508061  
1 1 1 4  14 8  o 9.0436 0.6198 83.158   11.198  84.148    15.547  82.089    16.143  9.1033 0.8539 8.9839 0.8984 0.1193695      1.239509  
1 1 1 4  14 9  o 22.436 0.5231 512.638  23.424  543.036   32.836  481.138   33.425  23.129 0.7099 21.743 0.7687 1.385990       1.046291  
1 1 1 4  14 10 o 2.5401 0.8477 -8.9812  8.4144  -8.1846   9.2764  -12.6801  19.989  2.0175 0.9402 3.0627 1.4108 -1.045265      1.695440  
1 1 1 4  14 11 o 9.4165 0.7891 78.527   12.882  66.489    14.518  123.107   27.939  8.0428 0.9025 10.790 1.2946 -2.747469      1.578185  
1 1 1 4  14 12 o 6.4245 1.0813 34.751   11.711  25.547    13.027  73.515    26.735  4.8210 1.3148 8.0279 1.7171 -3.206969      2.162627  
1 1 1 4  14 13 o 11.261 0.7440 122.002  14.768  110.768   16.923  157.875   30.240  10.371 0.8159 12.151 1.2444 -1.779653      1.487982  
1 1 1 4  14 14 o 7.7222 1.1050 77.316   13.562  84.785    15.273  49.467    29.493  9.0638 0.8425 6.3806 2.0430 2.683135       2.209946  
1 1 1 4  14 15 o 6.0766 1.0923 36.658   11.390  31.244    12.781  57.546    25.104  5.2808 1.2326 6.8724 1.8037 -1.591550      2.184630  
1 1 1 4  14 16 o 4.4945 1.1209 21.376   11.032  22.273    12.219  17.424    25.654  4.4577 1.2942 4.5313 1.8306 -0.7359648E-01 2.241890  
1 1 1 4  14 17 o 3.9296 0.9683 17.362   9.7961  23.147    10.591  -16.9057  25.775  4.5496 1.1603 3.3096 1.5505 1.239958       1.936605  
1 1 1 4  14 18 o 6.7935 1.0576 45.773   11.624  40.604    12.905  68.007    26.765  6.0998 1.0982 7.4873 1.8079 -1.387562      2.115276  
1 1 1 4  14 19 o 13.772 0.7726 197.523  17.448  194.259   19.670  209.570   37.787  13.749 0.7153 13.794 1.3696 -0.4541969E-01 1.545197  
1 1 1 4  14 20 o 5.7101 1.1710 30.693   11.475  25.380    12.605  56.401    27.728  4.7343 1.2942 6.6858 1.9520 -1.951482      2.342089  
1 1 1 4  14 21 o 5.3419 1.3299 32.251   14.153  32.251    14.153  0.0000    0.0000  5.3419 1.3299 ?      ?      ?              ?         
1 1 1 4  14 22 o 3.8339 1.1702 4.6032   10.395  3.0519    10.963  18.425    32.724  2.8141 1.1730 4.8538 2.0252 -2.039710      2.340341  
1 1 1 4  14 23 o 4.5364 1.0488 25.297   11.434  31.691    12.273  -16.7343  31.466  5.3473 1.1793 3.7256 1.7347 1.621650       2.097614  
1 1 1 4  14 24 o 11.607 0.8882 127.415  16.282  115.076   17.852  188.466   39.709  10.477 0.8519 12.737 1.5588 -2.259595      1.776455  
1 1 1 4  14 25 o 4.8727 1.3433 15.035   12.364  9.8635    13.036  61.361    39.015  3.3809 1.3247 6.3645 2.3372 -2.983672      2.686517  
1 1 1 4  14 26 o 3.9260 1.1023 17.408   11.041  19.698    11.647  -2.8714   34.663  4.0306 1.2832 3.8214 1.7928 0.2091682      2.204679  
1 1 1 4  14 27 o 6.3980 1.2624 55.814   13.188  54.151    13.967  69.476    40.038  6.9268 1.0082 5.8693 2.3147 1.057504       2.524779  
1 1 1 4  14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  14 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  15 0  o 4.5255 1.3704 29.739   12.898  34.203    18.101  25.135    18.382  4.9627 1.9198 4.0882 1.9560 -0.000000      0.000000  
1 1 1 4  15 1  o 12.866 0.5497 167.042  14.140  171.297   19.935  162.733   20.061  13.032 0.7648 12.699 0.7899 0.3335648      1.099476  
1 1 1 4  15 2  o 17.920 0.5149 323.743  18.452  321.499   25.816  326.087   26.384  17.858 0.7228 17.982 0.7336 -0.1247826     1.029889  
1 1 1 4  15 3  o 13.393 0.5514 181.094  14.764  176.661   20.536  185.837   21.241  13.224 0.7765 13.562 0.7831 -0.3378744     1.102804  
1 1 1 4  15 4  o 13.341 0.5459 179.749  14.556  175.174   20.113  184.779   21.091  13.165 0.7639 13.518 0.7801 -0.3530312     1.091866  
1 1 1 4  15 5  o 7.8395 0.7094 62.534   11.100  57.264    15.365  68.287    16.053  7.4914 1.0255 8.1877 0.9803 -0.6963243     1.418723  
1 1 1 4  15 6  o 3.0443 0.8573 2.1981   8.3883  -6.2540   11.415  12.121    12.368  2.4093 1.0931 3.6793 1.3210 -1.270039      1.714596  
1 1 1 4  15 7  o 16.449 0.5385 274.819  17.715  271.277   24.926  278.433   25.182  16.342 0.7626 16.557 0.7605 -0.2148724     1.077009  
1 1 1 4  15 8  o 12.399 0.5830 157.160  14.453  152.939   20.188  161.599   20.702  12.228 0.8255 12.570 0.8235 -0.3421011     1.166001  
1 1 1 4  15 9  o 14.827 0.5590 224.467  16.526  237.640   22.993  210.389   23.770  15.291 0.7518 14.364 0.8274 0.9277887      1.117978  
1 1 1 4  15 10 o 8.3408 0.9579 74.431   13.028  73.614    14.860  77.144    27.081  8.4566 0.8786 8.2249 1.7024 0.2316551      1.915746  
1 1 1 4  15 11 o 10.792 0.8109 122.081  14.945  121.978   17.190  122.399   30.248  10.918 0.7872 10.667 1.4179 0.2508001      1.621760  
1 1 1 4  15 12 o 8.2858 1.0472 77.433   13.700  78.334    15.469  74.155    29.504  8.6990 0.8891 7.8725 1.8964 0.8265657      2.094442  
1 1 1 4  15 13 o 6.5072 1.0885 48.896   12.480  50.306    14.204  44.122    26.136  6.9300 1.0248 6.0843 1.9206 0.8457470      2.176959  
1 1 1 4  15 14 o 3.5066 1.0808 -0.0089  10.729  -2.9573   11.734  15.030    26.501  2.5529 1.1372 4.4603 1.8383 -1.907419      2.161613  
1 1 1 4  15 15 o 3.2616 1.0146 2.8179   9.3871  3.6848    10.067  -2.9592   25.986  2.7664 1.1357 3.7568 1.6815 -0.9904499     2.029126  
1 1 1 4  15 16 o 3.0037 1.0014 -12.1779 10.301  -14.9410  11.146  4.0110    26.979  1.9907 0.9570 4.0166 1.7593 -2.025903      2.002728  
1 1 1 4  15 17 o 7.0854 1.1290 52.562   12.958  48.704    14.348  69.631    30.181  6.7659 1.0603 7.4049 1.9936 -0.6389947     2.258049  
1 1 1 4  15 18 o 11.388 0.7911 122.784  15.492  109.422   17.493  171.376   33.359  10.264 0.8522 12.513 1.3330 -2.248837      1.582110  
1 1 1 4  15 19 o 5.7236 1.1919 32.518   12.036  27.618    13.315  54.424    28.153  4.9187 1.3241 6.5284 1.9821 -1.609633      2.383716  
1 1 1 4  15 20 o 7.4677 1.1358 58.725   13.675  55.303    15.195  73.311    31.369  7.2447 1.0487 7.6907 2.0152 -0.4459462     2.271701  
1 1 1 4  15 21 o 14.939 0.7911 240.907  19.513  243.971   22.228  230.611   40.744  15.414 0.7210 14.464 1.4085 0.9503040      1.582280  
1 1 1 4  15 22 o 14.318 0.8238 207.757  19.098  199.112   21.315  242.953   43.008  13.887 0.7674 14.748 1.4581 -0.8607359     1.647683  
1 1 1 4  15 23 o 6.5107 1.2562 42.291   13.194  36.724    14.338  73.063    33.711  5.6700 1.2930 7.3514 2.1541 -1.681362      2.512347  
1 1 1 4  15 24 o 4.3792 1.2132 17.937   11.701  17.685    12.471  19.790    33.832  3.9892 1.3319 4.7692 2.0282 -0.7800305     2.426438  
1 1 1 4  15 25 o 3.5191 1.0913 7.9247   10.643  10.481    11.070  -23.3127  38.695  3.2880 1.2377 3.7502 1.7976 -0.4622111     2.182544  
1 1 1 4  15 26 o 5.5389 1.1179 46.631   13.121  50.893    13.960  14.333    38.426  6.7429 1.0351 4.3349 1.9817 2.408002       2.235785  
1 1 1 4  15 27 o 7.5789 1.2925 90.442   15.833  90.628    17.061  89.288    42.498  8.9510 0.9530 6.2068 2.4029 2.744139       2.585033  
1 1 1 4  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  16 0  o 13.773 0.8292 198.133  22.062  161.084   31.237  235.006   31.164  12.400 1.2917 15.146 1.0400 -0.000000      0.000000  
1 1 1 4  16 1  o 3.0448 0.8872 3.0937   8.7810  5.6779    12.404  0.4980    12.432  3.2053 1.2806 2.8842 1.2281 0.3211040      1.774332  
1 1 1 4  16 2  o 11.001 0.6104 123.424  13.362  133.058   18.528  112.985   19.287  11.460 0.8084 10.541 0.9148 0.9188938      1.220813  
1 1 1 4  16 3  o 10.336 0.6214 108.059  12.813  100.775   17.373  116.745   18.972  9.9575 0.8724 10.715 0.8853 -0.7573767     1.242893  
1 1 1 4  16 4  o 6.7517 0.8288 47.748   10.890  47.084    14.626  48.574    16.314  6.7634 1.0813 6.7401 1.2564 0.2327871E-01  1.657638  
1 1 1 4  16 5  o 11.815 0.5844 142.167  13.794  135.016   19.011  150.117   20.045  11.502 0.8264 12.128 0.8264 -0.6261501     1.168707  
1 1 1 4  16 6  o 5.4175 0.8853 32.521   9.9843  45.749    13.736  17.704    14.538  6.6458 1.0334 4.1891 1.4378 2.456671       1.770651  
1 1 1 4  16 7  o 16.051 0.6936 253.980  20.630  294.469   38.081  237.162   24.543  16.847 1.1302 15.256 0.8044 1.591166       1.387239  
1 1 1 4  16 8  o 3.8431 0.9554 13.929   9.2501  9.6212    12.993  18.356    13.172  3.4918 1.3346 4.1944 1.3674 -0.7026074     1.910735  
1 1 1 4  16 9  o 11.494 0.7478 131.117  14.741  125.180   16.801  150.966   30.720  11.069 0.7589 11.920 1.2887 -0.8506002     1.495533  
1 1 1 4  16 10 o 4.6131 0.8833 26.434   11.168  39.975    12.412  -31.1284  25.590  6.1956 1.0017 3.0306 1.4551 3.164971       1.766582  
1 1 1 4  16 11 o 3.0598 0.9606 -0.3760  10.255  3.1463    11.426  -14.9594  23.250  2.8869 1.1999 3.2327 1.5005 -0.3458064     1.921297  
1 1 1 4  16 12 o 11.153 0.8737 134.674  16.101  136.103   18.344  129.881   33.603  11.498 0.7977 10.807 1.5546 0.6905651      1.747323  
1 1 1 4  16 13 o 3.2024 0.9199 1.0411   11.336  15.699    12.766  -53.5822  24.645  3.8831 1.3465 2.5218 1.2538 1.361324       1.839840  
1 1 1 4  16 14 o 3.5518 1.0547 5.0810   10.005  3.3337    11.022  13.262    23.849  2.8387 1.1791 4.2649 1.7492 -1.426141      2.109488  
1 1 1 4  16 15 o 6.2015 1.2097 35.668   12.960  27.269    14.359  72.558    30.093  4.8642 1.4003 7.5388 1.9730 -2.674634      2.419385  
1 1 1 4  16 16 o 4.0765 1.1345 12.978   11.131  11.263    12.326  20.559    25.912  3.4967 1.3081 4.6564 1.8540 -1.159648      2.268975  
1 1 1 4  16 17 o 12.957 0.7943 171.927  17.198  166.129   19.455  192.669   36.794  12.694 0.7663 13.220 1.3916 -0.5266657     1.588616  
1 1 1 4  16 18 o 4.6426 1.1448 24.904   12.285  28.500    13.466  7.0698    29.988  4.9978 1.3255 4.2875 1.8670 0.7102571      2.289669  
1 1 1 4  16 19 o 9.1287 1.0196 87.157   14.909  82.681    16.760  104.136   32.640  8.8953 0.9421 9.3622 1.8087 -0.4669724     2.039294  
1 1 1 4  16 20 o 7.5657 1.1930 58.730   14.059  54.237    15.384  81.491    34.624  7.1522 1.0755 7.9791 2.1299 -0.8268900     2.385995  
1 1 1 4  16 21 o 12.940 0.9201 199.967  18.672  214.778   21.340  151.595   38.565  14.438 0.7390 11.442 1.6853 2.995909       1.840216  
1 1 1 4  16 22 o 9.3136 1.0053 81.215   15.607  70.035    17.340  128.934   35.823  8.1085 1.0692 10.519 1.7028 -2.410073      2.010679  
1 1 1 4  16 23 o 9.8158 1.0912 106.363  16.209  102.550   17.981  122.897   37.445  9.8523 0.9125 9.7794 1.9824 0.7293510E-01  2.182300  
1 1 1 4  16 24 o 6.3772 1.2621 50.042   13.985  48.586    15.295  57.467    34.546  6.5181 1.2180 6.2364 2.2110 0.2817636      2.524289  
1 1 1 4  16 25 f 4.1718 1.3106 4.8343   13.346  -1.1839   14.072  58.750    42.118  2.7477 1.2331 5.5959 2.3130 -2.848161      2.621147  
1 1 1 4  16 26 o 3.0448 1.0502 -7.7334  12.215  -7.7638   12.899  -7.4697   38.012  2.3509 1.0999 3.7388 1.7894 -1.387926      2.100435  
1 1 1 4  16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  16 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  17 0  o 14.936 0.7981 231.537  23.502  234.858   32.675  227.976   33.829  15.063 1.0981 14.808 1.1586 -0.000000      0.000000  
1 1 1 4  17 1  o 2.9355 0.8872 0.6921   9.2624  -1.5487   13.576  2.6437    12.669  2.8674 1.2521 3.0036 1.2572 -0.1362858     1.774406  
1 1 1 4  17 2  o 3.5266 0.9226 6.7661   9.4525  -4.0953   12.622  20.635    14.263  2.6364 1.1765 4.4168 1.4215 -1.780443      1.845214  
1 1 1 4  17 3  o 3.4201 0.9524 7.8192   9.6567  10.764    13.128  4.3470    14.254  3.5862 1.3483 3.2540 1.3453 0.3321619      1.904704  
1 1 1 4  17 4  o 4.1817 0.8404 16.719   9.5078  34.277    12.441  -7.9370   14.742  5.6513 1.1400 2.7122 1.2350 2.939138       1.680780  
1 1 1 4  17 5  o 3.5269 0.9206 9.7200   9.0673  16.583    12.309  1.5777    13.407  4.0277 1.3222 3.0261 1.2814 1.001594       1.841279  
1 1 1 4  17 6  o 19.500 0.5396 387.995  21.037  388.273   29.377  387.703   30.139  19.513 0.7528 19.488 0.7733 0.2473068E-01  1.079171  
1 1 1 4  17 7  o 7.3819 0.7503 56.610   11.052  53.342    15.031  60.456    16.306  7.1539 1.0506 7.6099 1.0714 -0.4559216     1.500501  
1 1 1 4  17 8  o 9.0398 0.6902 84.723   12.478  85.347    17.573  84.088    17.721  9.0760 0.9681 9.0036 0.9841 0.7243729E-01  1.380471  
1 1 1 4  17 9  o 17.173 0.7010 308.505  20.458  309.188   23.489  306.358   41.636  17.407 0.6747 16.940 1.2289 0.4675465      1.401965  
1 1 1 4  17 10 o 7.2750 1.0920 65.997   13.596  72.516    15.633  45.757    27.546  8.3574 0.9353 6.1927 1.9736 2.164792       2.183976  
1 1 1 4  17 11 o 19.332 0.6574 369.506  22.422  348.092   25.860  434.343   44.998  18.434 0.7014 20.231 1.1121 -1.796637      1.314855  
1 1 1 4  17 12 o 3.9549 1.0255 15.575   11.494  23.408    12.895  -14.7017  25.354  4.5564 1.3314 3.3535 1.5600 1.202918       2.050955  
1 1 1 4  17 13 o 7.8082 1.0740 58.564   13.840  49.077    15.508  95.685    30.676  6.6662 1.2076 8.9501 1.7764 -2.283937      2.148012  
1 1 1 4  17 14 o 3.6920 1.0687 10.086   11.671  14.181    13.003  -6.8787   26.468  3.7529 1.3536 3.6312 1.6541 0.1217608      2.137345  
1 1 1 4  17 15 o 4.4423 1.2027 17.174   12.076  15.181    13.274  26.745    29.088  3.8475 1.3698 5.0372 1.9773 -1.189622      2.405451  
1 1 1 4  17 16 o 6.8566 1.1503 64.905   14.205  72.851    15.785  31.074    32.569  8.3406 0.9463 5.3727 2.0970 2.967872       2.300641  
1 1 1 4  17 17 o 10.113 1.0682 129.547  16.151  141.105   18.470  91.988    33.296  11.672 0.7912 8.5549 1.9844 3.116817       2.136366  
1 1 1 4  17 18 o 3.1795 1.0184 -0.0507  10.901  4.3653    11.577  -34.6114  32.387  2.9604 1.2170 3.3986 1.6332 -0.4382243     2.036769  
1 1 1 4  17 19 o 6.8890 1.1608 55.997   13.333  56.858    14.786  52.251    30.842  7.3479 1.0061 6.4301 2.0921 0.9178348      2.321509  
1 1 1 4  17 20 o 3.2526 1.0518 -2.6156  11.734  -1.0292   12.786  -11.0873  29.547  2.7654 1.2112 3.7399 1.7200 -0.9745476     2.103664  
1 1 1 4  17 21 o 8.1857 1.2038 91.775   15.750  101.093   17.620  54.716    35.139  9.8515 0.8943 6.5199 2.2354 3.331660       2.407663  
1 1 1 4  17 22 o 8.3595 1.0115 74.591   16.911  74.591    16.911  0.0000    0.0000  8.3595 1.0115 ?      ?      ?              ?         
1 1 1 4  17 23 o 7.7151 1.2718 53.753   15.427  40.848    16.798  123.274   38.987  5.8552 1.4436 9.5751 2.0942 -3.719839      2.543532  
1 1 1 4  17 24 o 7.4048 1.3171 59.136   15.340  50.090    16.691  108.290   38.908  6.4674 1.3347 8.3423 2.2710 -1.874873      2.634182  
1 1 1 4  17 25 o 6.5849 1.3734 54.234   15.401  47.612    16.730  91.033    39.438  6.1572 1.3913 7.0125 2.3684 -0.8553219     2.746828  
1 1 1 4  17 26 o 5.3274 1.2290 48.541   15.586  51.316    16.602  27.923    45.249  6.2903 1.3593 4.3646 2.0478 1.925767       2.457899  
1 1 1 4  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  18 0  o 2.5512 1.1699 -0.0831  14.128  3.9991    20.963  -3.4800   19.122  2.7550 1.7491 2.3475 1.5542 -0.000000      0.000000  
1 1 1 4  18 1  o 5.8595 0.9497 37.678   10.897  35.447    15.297  39.976    15.527  5.6745 1.3646 6.0445 1.3212 -0.3700023     1.899433  
1 1 1 4  18 2  o 11.292 0.6307 131.055  14.243  129.025   20.044  133.127   20.243  11.203 0.8946 11.381 0.8893 -0.1785307     1.261400  
1 1 1 4  18 3  o 13.385 0.5828 183.666  15.578  169.922   21.703  198.275   22.374  12.861 0.8437 13.910 0.8043 -1.048517      1.165648  
1 1 1 4  18 4  o 14.300 0.5847 209.962  16.695  211.190   23.005  208.596   24.264  14.356 0.8013 14.245 0.8517 0.1107273      1.169333  
1 1 1 4  18 5  o 15.314 0.5720 240.063  17.503  238.000   24.194  242.329   25.351  15.251 0.7932 15.376 0.8244 -0.1241236     1.144001  
1 1 1 4  18 6  o 10.486 0.6467 113.372  13.543  106.899   18.601  120.676   19.758  10.168 0.9147 10.803 0.9144 -0.6354208     1.293358  
1 1 1 4  18 7  o 8.7969 0.7278 80.851   12.788  77.025    17.540  85.193    18.683  8.5779 1.0224 9.0158 1.0361 -0.4378967     1.455616  
1 1 1 4  18 8  f 7.7390 0.8147 65.856   11.870  77.152    15.999  52.022    17.705  8.6238 0.9276 6.8542 1.3396 1.769549       1.629379  
1 1 1 4  18 9  o 13.380 0.7425 177.825  17.542  166.835   20.234  211.073   35.195  12.732 0.7946 14.027 1.2545 -1.295147      1.485005  
1 1 1 4  18 10 o 7.8484 1.0970 68.563   14.021  67.080    15.824  73.983    30.245  7.9839 0.9910 7.7128 1.9574 0.2711201      2.193973  
1 1 1 4  18 11 o 12.787 0.7842 171.229  17.406  167.964   20.106  180.997   34.778  12.746 0.7887 12.827 1.3556 -0.8102703E-01 1.568376  
1 1 1 4  18 12 o 7.1484 1.1768 57.831   14.454  55.872    16.336  64.892    31.014  7.2137 1.1323 7.0831 2.0634 0.1305790      2.353653  
1 1 1 4  18 13 o 3.6767 0.9530 9.2040   11.998  24.742    13.527  -48.1071  25.979  4.6573 1.3645 2.6960 1.3308 1.961236       1.906007  
1 1 1 4  18 14 o 5.2231 1.2691 24.352   13.311  18.034    14.784  51.394    30.585  4.1247 1.4479 6.3215 2.0847 -2.196764      2.538191  
1 1 1 4  18 15 o 5.2103 0.9926 35.900   13.085  49.421    14.774  -13.3034  28.182  6.8220 1.0828 3.5986 1.6639 3.223345       1.985189  
1 1 1 4  18 16 o 8.0124 1.1739 68.366   14.876  63.879    16.468  88.265    34.682  7.7477 1.0627 8.2771 2.0936 -0.5293994     2.347886  
1 1 1 4  18 17 o 4.7647 1.1970 25.431   13.034  28.326    14.268  10.838    32.036  4.9841 1.3828 4.5452 1.9542 0.4389067      2.393958  
1 1 1 4  18 18 o 14.401 0.8477 228.273  21.125  234.883   24.700  210.267   40.767  15.065 0.8198 13.736 1.4839 1.328959       1.695317  
1 1 1 4  18 19 o 3.2242 0.9995 0.4895   11.921  9.5404    12.726  -64.3074  34.051  3.4096 1.3163 3.0388 1.5044 0.3707459      1.998972  
1 1 1 4  18 20 o 20.122 0.7348 428.220  24.875  428.768   28.451  426.444   51.254  20.448 0.6957 19.796 1.2946 0.6521358      1.469661  
1 1 1 4  18 21 o 5.9353 1.2801 41.389   14.181  40.184    15.640  46.959    33.630  5.9027 1.3536 5.9678 2.1732 -0.6515408E-01 2.560262  
1 1 1 4  18 22 o 2.8937 1.0056 -18.7766 12.058  -19.3054  12.975  -15.4267  32.656  2.0707 1.0045 3.7166 1.7425 -1.645863      2.011270  
1 1 1 4  18 23 o 4.3364 1.1423 22.575   13.174  28.014    14.158  -12.5507  35.977  4.8235 1.3910 3.8493 1.8124 0.9741554      2.284602  
1 1 1 4  18 24 o 3.5690 1.1333 7.5481   12.709  9.7964    13.395  -12.7389  40.236  3.3006 1.3265 3.8374 1.8378 -0.5367911     2.266507  
1 1 1 4  18 25 o 4.2506 1.2591 20.843   13.868  18.984    14.822  33.912    39.298  3.8831 1.4380 4.6180 2.0673 -0.7348869     2.518259  
1 1 1 4  18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  18 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  19 0  o 5.0990 1.5543 39.545   16.347  35.706    22.553  43.794    23.728  4.7816 2.1760 5.4164 2.2198 -0.000000      0.000000  
1 1 1 4  19 1  o 3.7017 1.0225 10.088   11.125  14.536    15.335  5.1477    16.164  3.9644 1.4638 3.4390 1.4281 0.5253234      2.045024  
1 1 1 4  19 2  o 14.449 0.5822 214.586  16.816  205.012   23.548  224.549   24.021  14.115 0.8341 14.783 0.8125 -0.6679640     1.164418  
1 1 1 4  19 3  o 16.402 0.5680 276.442  18.626  270.043   25.898  283.297   26.808  16.208 0.7989 16.596 0.8077 -0.3879948     1.136065  
1 1 1 4  19 4  o 10.671 0.6633 118.745  14.056  135.083   19.954  102.649   19.805  11.429 0.8729 9.9126 0.9990 1.516631       1.326625  
1 1 1 4  19 5  o 6.0359 0.9641 41.138   11.473  50.747    16.088  31.194    16.365  6.8192 1.2246 5.2526 1.4893 1.566604       1.928137  
1 1 1 4  19 6  o 15.411 0.5725 244.315  17.644  242.937   24.779  245.732   25.131  15.369 0.8061 15.453 0.8131 -0.8441544E-01 1.145004  
1 1 1 4  19 7  o 10.130 0.6883 107.546  13.880  117.770   19.499  97.045    19.761  10.644 0.9159 9.6154 1.0276 1.028918       1.376553  
1 1 1 4  19 8  o 10.291 0.8651 109.193  15.800  103.438   18.335  125.795   31.139  9.9504 0.9213 10.631 1.4645 -0.6809473     1.730198  
1 1 1 4  19 9  f 8.9689 1.0199 82.554   14.717  76.511    16.498  106.096   32.562  8.5299 0.9671 9.4078 1.7961 -0.8778982     2.039891  
1 1 1 4  19 10 o 5.9889 1.1858 41.058   13.331  39.869    15.262  44.884    27.379  5.9460 1.3180 6.0317 1.9716 -0.8571529E-01 2.371577  
1 1 1 4  19 11 o 3.6279 1.1261 2.4510   12.728  0.8646    14.190  8.9839    28.796  2.9811 1.2911 4.2747 1.8454 -1.293633      2.252194  
1 1 1 4  19 12 o 8.9749 0.9628 77.412   15.393  64.657    17.605  118.817   31.719  7.7519 1.1356 10.198 1.5552 -2.446018      1.925646  
1 1 1 4  19 13 o 10.844 0.9057 122.338  16.836  116.969   19.236  139.918   34.808  10.579 0.9091 11.108 1.5668 -0.5289087     1.811433  
1 1 1 4  19 14 o 10.003 1.0083 108.525  16.169  106.035   18.315  117.324   34.424  10.079 0.9086 9.9264 1.8003 0.1525488      2.016572  
1 1 1 4  19 15 o 3.3277 1.1041 -18.3836 17.485  -25.1213  21.703  -5.9188   29.519  2.7962 1.3419 3.8591 1.7536 -1.062884      2.208133  
1 1 1 4  19 16 o 7.8857 1.1568 72.858   14.777  73.474    16.616  70.527    32.310  8.3524 0.9947 7.4190 2.0889 0.9333587      2.313615  
1 1 1 4  19 17 o 4.0290 1.0820 15.130   12.729  23.571    13.863  -30.2137  32.130  4.5837 1.3907 3.4742 1.6579 1.109583       2.163957  
1 1 1 4  19 18 o 5.3434 1.1349 37.870   13.789  45.646    15.070  -2.1197   34.176  6.4263 1.2171 4.2605 1.9160 2.165815       2.269898  
1 1 1 4  19 19 o 7.0788 1.2106 63.241   15.149  66.938    17.025  49.180    33.203  7.9376 1.0724 6.2201 2.1707 1.717522       2.421126  
1 1 1 4  19 20 o 5.0433 1.2576 30.413   14.538  33.539    15.876  14.172    36.185  5.3506 1.4482 4.7360 2.0565 0.6145906      2.515257  
1 1 1 4  19 21 o 5.0742 1.0853 35.309   13.942  45.847    15.385  -13.0837  32.971  6.3518 1.2556 3.7967 1.7705 2.555017       2.170539  
1 1 1 4  19 22 o 3.4041 1.1091 -1.7083  12.818  -2.1065   13.917  0.5181    32.910  2.7640 1.2343 4.0443 1.8431 -1.280347      2.218194  
1 1 1 4  19 23 o 3.8714 0.9585 15.481   13.349  32.811    14.300  -101.8944 37.216  5.1056 1.3714 2.6373 1.3395 2.468253       1.917005  
1 1 1 4  19 24 o 3.4679 1.0919 7.6690   13.736  13.009    14.670  -30.3147  39.127  3.5103 1.3958 3.4255 1.6795 0.8480525E-01  2.183775  
1 1 1 4  19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  20 0  o 6.1178 1.5661 53.146   17.633  50.458    25.047  55.786    24.829  5.8804 2.2541 6.3552 2.1749 -0.000000      0.000000  
1 1 1 4  20 1  o 12.793 0.6365 169.668  16.258  158.669   23.016  180.620   22.968  12.363 0.9308 13.222 0.8685 -0.8589201     1.273097  
1 1 1 4  20 2  f 3.6546 1.0106 8.3026   11.221  18.126    16.180  -0.8002   15.575  4.2368 1.5119 3.0724 1.3414 1.164324       2.021242  
1 1 1 4  20 3  o 12.107 0.6421 152.117  15.511  139.348   21.762  165.303   22.115  11.574 0.9401 12.639 0.8749 -1.064643      1.284190  
1 1 1 4  20 4  o 3.7841 1.0257 10.202   11.584  -0.8164   16.526  20.846    16.243  3.1481 1.3779 4.4200 1.5196 -1.271886      2.051329  
1 1 1 4  20 5  o 4.9639 1.0649 28.273   11.738  34.089    15.989  21.474    17.287  5.4533 1.4434 4.4746 1.5660 0.9787259      2.129769  
1 1 1 4  20 6  o 11.866 0.6642 147.994  15.710  157.927   21.925  137.513   22.522  12.304 0.8910 11.429 0.9853 0.8753595      1.328443  
1 1 1 4  20 7  o 7.1518 0.8621 56.515   11.770  41.518    16.421  72.360    16.879  6.0298 1.3902 8.2739 1.0200 -2.244102      1.724231  
1 1 1 4  20 8  o 4.3425 1.1527 19.226   13.377  24.518    15.149  0.4824    28.508  4.6614 1.4609 4.0237 1.7835 0.6376896      2.305413  
1 1 1 4  20 9  o 7.9391 1.0927 67.662   14.873  62.067    17.066  85.332    30.331  7.5931 1.1238 8.2852 1.8742 -0.6920795     2.185327  
1 1 1 4  20 10 f 5.4983 1.2437 35.210   14.000  34.734    15.910  36.842    29.472  5.4694 1.4361 5.5272 2.0311 -0.5776405E-01 2.487499  
1 1 1 4  20 11 o 15.971 0.7625 274.028  20.919  275.799   24.203  268.798   41.594  16.345 0.7404 15.598 1.3333 0.7474327      1.525096  
1 1 1 4  20 12 o 5.3735 1.0833 38.719   14.495  52.128    16.384  -9.5944   31.098  6.8653 1.2388 3.8818 1.7776 2.983452       2.166687  
1 1 1 4  20 13 o 10.720 1.0186 132.187  17.379  135.922   19.929  120.333   35.509  11.428 0.8720 10.012 1.8412 1.416110       2.037278  
1 1 1 4  20 14 o 5.3913 1.2556 35.093   14.501  37.152    16.200  26.790    32.529  5.6609 1.4303 5.1217 2.0641 0.5391941      2.511246  
1 1 1 4  20 15 o 10.076 1.0179 112.050  16.663  111.033   19.048  115.369   34.392  10.310 0.9237 9.8415 1.8141 0.4687891      2.035778  
1 1 1 4  20 16 o 3.5359 1.0905 2.4866   13.824  10.374    15.297  -32.6474  32.285  3.6377 1.4320 3.4342 1.6451 0.2034309      2.181038  
1 1 1 4  20 17 o 6.0284 1.1239 49.561   14.861  60.354    16.752  9.6955    32.196  7.5281 1.1126 4.5287 1.9531 2.999364       2.247830  
1 1 1 4  20 18 o 9.0423 1.2023 88.693   16.975  84.043    18.856  108.569   38.984  8.8986 1.0595 9.1861 2.1585 -0.2874966     2.404504  
1 1 1 4  20 19 o 11.110 1.0314 130.593  18.479  124.368   20.623  155.949   41.624  10.854 0.9500 11.367 1.8310 -0.5129223     2.062767  
1 1 1 4  20 20 o 5.7034 1.2980 43.702   17.598  51.560    20.513  21.803    34.245  6.5317 1.5861 4.8752 2.0552 1.656511       2.596095  
1 1 1 4  20 21 o 5.3154 1.3895 28.436   15.151  23.061    16.458  58.308    38.799  4.4312 1.5293 6.1996 2.3205 -1.768387      2.779064  
1 1 1 4  20 22 o 9.7453 1.2684 145.105  18.601  158.365   20.998  96.750    40.097  12.098 0.8678 7.3927 2.3838 4.705036       2.536837  
1 1 1 4  20 23 o 5.0599 1.3806 32.771   15.722  28.481    17.013  57.850    41.133  4.6151 1.5556 5.5047 2.2814 -0.8896031     2.761292  
1 1 1 4  20 24 o 3.6604 1.0894 14.347   14.800  23.610    15.874  -47.2300  40.925  4.1462 1.4956 3.1745 1.5843 0.9716344      2.178708  
1 1 1 4  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  20 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  21 0  o 10.798 1.1358 131.933  22.615  141.084   31.081  121.635   32.969  11.333 1.4336 10.264 1.7620 -0.000000      0.000000  
1 1 1 4  21 1  o 3.5571 1.0141 8.4703   11.206  12.160    15.755  4.6926    15.941  3.7683 1.4619 3.3459 1.4059 0.4224472      2.028237  
1 1 1 4  21 2  o 6.2438 1.0531 45.196   12.997  40.554    18.257  49.967    18.507  5.8890 1.5346 6.5986 1.4426 -0.7095623     2.106210  
1 1 1 4  21 3  o 8.9010 0.8085 84.601   14.339  75.148    19.692  95.272    20.922  8.3551 1.1784 9.4469 1.1074 -1.091743      1.617072  
1 1 1 4  21 4  f 10.634 0.7092 119.526  15.041  126.639   21.002  112.037   21.551  10.985 0.9560 10.283 1.0479 0.7014456      1.418442  
1 1 1 4  21 5  o 6.2445 1.0536 45.129   12.943  46.167    17.500  43.875    19.229  6.3635 1.4119 6.1255 1.5641 0.2380266      2.107157  
1 1 1 4  21 6  o 7.8754 0.8591 67.230   13.484  66.484    19.821  67.872    18.397  7.8070 1.2694 7.9438 1.1579 -0.1367879     1.718213  
1 1 1 4  21 7  o 9.1812 1.0778 96.465   15.757  96.102    17.886  97.721    33.296  9.5498 0.9365 8.8126 1.9415 0.7371864      2.155579  
1 1 1 4  21 8  o 8.4191 1.0989 81.225   15.705  80.610    18.221  83.001    30.976  8.7019 1.0469 8.1363 1.9323 0.5656443      2.197702  
1 1 1 4  21 9  o 8.3501 1.2041 94.033   16.695  104.138   19.105  61.386    34.340  9.9361 0.9614 6.7642 2.2079 3.171902       2.408160  
1 1 1 4  21 10 o 9.9207 0.9511 101.385  16.699  94.124    19.286  123.137   33.379  9.4408 1.0214 10.401 1.6047 -0.9598150     1.902166  
1 1 1 4  21 11 f 8.3168 1.2094 86.952   16.616  92.254    18.933  69.182    34.660  9.3547 1.0119 7.2789 2.1969 2.075821       2.418766  
1 1 1 4  21 12 o 11.950 0.8748 153.882  18.025  152.959   20.843  156.622   35.896  12.121 0.8598 11.778 1.5239 0.3433237      1.749690  
1 1 1 4  21 13 o 4.4630 1.2610 15.276   14.082  12.104    15.696  28.364    31.880  3.7479 1.4577 5.1781 2.0581 -1.430146      2.522046  
1 1 1 4  21 14 o 12.543 0.8725 164.100  18.778  159.333   21.523  179.292   38.422  12.394 0.8683 12.692 1.5136 -0.2975149     1.744997  
1 1 1 4  21 15 o 5.4403 1.2942 34.717   15.281  36.539    17.115  27.556    33.932  5.6204 1.4961 5.2602 2.1123 0.3602400      2.588456  
1 1 1 4  21 16 o 5.0564 1.2866 17.728   14.817  7.2366    16.772  55.030    31.625  3.5492 1.4626 6.5636 2.1171 -3.014359      2.573175  
1 1 1 4  21 17 o 8.4634 1.2557 86.994   17.136  88.576    19.226  80.878    37.794  9.1424 1.0515 7.7844 2.2807 1.357960       2.511396  
1 1 1 4  21 18 o 6.1338 1.3588 43.422   16.272  39.548    18.401  57.314    34.846  5.7634 1.5588 6.5041 2.2261 -0.7406654     2.717610  
1 1 1 4  21 19 f 6.1758 1.2768 52.522   17.164  59.852    19.718  29.601    34.866  7.1705 1.4252 5.1810 2.1188 1.989576       2.553527  
1 1 1 4  21 20 o 7.5100 1.4531 67.279   23.771  32.663    29.328  133.564   40.584  5.1268 1.9930 9.8933 2.1151 -4.766479      2.906184  
1 1 1 4  21 21 o 4.4451 1.2933 20.429   15.368  17.620    17.021  32.819    35.747  3.9647 1.5246 4.9255 2.0894 -0.9607673     2.586502  
1 1 1 4  21 22 o 4.4174 1.2139 25.945   14.836  29.945    15.958  0.4665    40.274  4.7864 1.4993 4.0484 1.9096 0.7379518      2.427843  
1 1 1 4  21 23 o 5.8614 1.4295 48.958   16.562  41.120    18.104  89.197    41.021  5.3827 1.5789 6.3401 2.3834 -0.9573894     2.858966  
1 1 1 4  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  21 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  22 0  o 2.9090 1.3322 3.3063   18.358  -0.0154   26.134  6.5420    25.793  2.8011 1.8419 3.0169 1.9252 -0.000000      0.000000  
1 1 1 4  22 1  o 7.7381 0.9611 69.344   14.032  89.959    19.478  47.105    20.231  9.1861 1.0602 6.2902 1.6033 2.895885       1.922172  
1 1 1 4  22 2  o 15.477 0.6222 250.705  19.250  251.182   26.847  250.199   27.618  15.503 0.8659 15.451 0.8937 0.5217171E-01  1.244397  
1 1 1 4  22 3  o 5.2120 1.1471 32.428   13.415  37.475    18.320  26.593    19.700  5.6099 1.5706 4.8142 1.6724 0.7956753      2.294298  
1 1 1 4  22 4  o 3.4161 0.9492 0.1162   11.501  22.415    16.204  -22.5180  16.326  4.4733 1.5181 2.3588 1.1400 2.114529       1.898489  
1 1 1 4  22 5  o 10.586 0.7424 119.296  15.715  116.337   22.005  122.376   22.450  10.450 1.0528 10.722 1.0469 -0.2714262     1.484769  
1 1 1 4  22 6  o 6.6054 1.0079 50.225   12.926  47.128    18.022  53.506    18.551  6.3784 1.4461 6.8324 1.4045 -0.4539871     2.015881  
1 1 1 4  22 7  o 7.6672 1.1931 58.824   15.794  46.775    17.988  99.360    32.994  6.3610 1.4466 8.9734 1.8977 -2.612370      2.386224  
1 1 1 4  22 8  o 9.6837 0.9832 90.141   16.997  75.731    19.472  136.266   34.837  8.4075 1.1580 10.960 1.5893 -2.552354      1.966411  
1 1 1 4  22 9  o 15.466 0.7693 245.264  21.188  234.843   24.675  274.517   41.341  15.060 0.8192 15.872 1.3023 -0.8124542     1.538552  
1 1 1 4  22 10 o 5.0843 1.2872 16.866   15.121  4.9259    17.167  58.200    31.940  3.4524 1.4553 6.7161 2.1235 -3.263746      2.574332  
1 1 1 4  22 11 o 5.4493 1.2563 36.206   15.015  38.603    17.260  28.749    30.448  5.7434 1.4899 5.1552 2.0232 0.5881696      2.512605  
1 1 1 4  22 12 o 9.8987 1.0628 110.914  17.546  111.265   20.372  109.908   34.530  10.279 0.9910 9.5185 1.8805 0.7604637      2.125649  
1 1 1 4  22 13 o 10.864 1.0670 136.163  18.932  140.740   21.976  122.987   37.288  11.609 0.9465 10.119 1.9126 1.489990       2.133959  
1 1 1 4  22 14 o 14.634 0.8184 224.551  20.936  219.859   24.263  238.227   41.425  14.569 0.8327 14.699 1.4091 -0.1301966     1.636746  
1 1 1 4  22 15 o 4.7409 1.2979 20.651   15.445  18.311    17.631  28.371    32.026  4.2562 1.5699 5.2256 2.0673 -0.9693842     2.595785  
1 1 1 4  22 16 o 8.0202 1.2729 82.795   17.917  89.054    20.525  62.757    36.725  9.1398 1.1229 6.9006 2.2848 2.239187       2.545799  
1 1 1 4  22 17 f 4.1870 1.2541 9.4636   15.661  5.9431    17.866  21.141    32.539  3.5200 1.4842 4.8541 2.0219 -1.334022      2.508154  
1 1 1 4  22 18 o 2.7390 0.9380 -22.7701 14.456  -11.8764  16.251  -64.0765  31.644  2.6422 1.2357 2.8358 1.4116 -0.1935766     1.876092  
1 1 1 4  22 19 o 5.8256 1.3882 43.947   17.142  43.599    19.000  45.471    39.738  5.9459 1.5733 5.7052 2.2877 0.2407494      2.776461  
1 1 1 4  22 20 o 6.1490 1.3823 44.932   16.457  35.231    18.548  80.822    35.675  5.1958 1.6146 7.1022 2.2441 -1.906431      2.764597  
1 1 1 4  22 21 o 3.5529 1.2035 -11.4685 15.580  -17.7537  16.824  26.356    41.273  2.4364 1.1724 4.6693 2.1022 -2.232871      2.407020  
1 1 1 4  22 22 o 3.9130 1.2485 7.2678   16.133  -0.9045   17.903  42.578    37.214  2.9779 1.3580 4.8482 2.0954 -1.870237      2.496931  
1 1 1 4  22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  22 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 0  o 2.0102 1.0018 -23.1254 15.947  -18.3527  22.597  -27.8602  22.507  2.1071 1.4705 1.9132 1.3609 -0.000000      0.000000  
1 1 1 4  23 1  o 12.589 0.7099 167.952  17.769  145.784   24.744  191.554   25.532  11.691 1.0582 13.486 0.9466 -1.794538      1.419800  
1 1 1 4  23 2  o 3.8657 1.0821 12.402   12.427  11.116    17.738  13.642    17.415  3.8011 1.5269 3.9303 1.5336 -0.1292710     2.164120  
1 1 1 4  23 3  o 3.1875 0.9792 -1.7658  12.025  -11.5239  16.671  8.8184    17.363  2.7180 1.2646 3.6570 1.4953 -0.9390190     1.958378  
1 1 1 4  23 4  o 7.2630 1.0434 59.911   14.599  51.737    19.621  70.049    21.851  6.6826 1.5044 7.8433 1.4463 -1.160741      2.086802  
1 1 1 4  23 5  o 5.0301 1.1497 28.568   13.321  35.731    19.504  22.306    18.238  5.5118 1.6445 4.5484 1.6071 0.9633951      2.299430  
1 1 1 4  23 6  o 3.6111 1.0849 4.8556   13.699  12.573    15.891  -17.4643  27.026  3.8108 1.4710 3.4115 1.5949 0.3993473      2.169705  
1 1 1 4  23 7  o 10.871 1.0437 140.182  18.443  149.211   21.587  115.776   35.490  11.958 0.9026 9.7836 1.8821 2.174433       2.087323  
1 1 1 4  23 8  o 4.1289 1.0666 11.162   15.307  32.973    17.714  -53.1297  30.414  5.3108 1.5630 2.9469 1.4518 2.363963       2.133251  
1 1 1 4  23 9  o 10.656 0.9922 123.243  18.417  119.638   21.313  133.866   36.591  10.628 1.0027 10.684 1.7124 -0.5644035E-01 1.984371  
1 1 1 4  23 10 o 9.7046 1.2064 117.153  18.707  123.958   21.515  96.061    37.878  10.842 0.9922 8.5673 2.1994 2.274640       2.412814  
1 1 1 4  23 11 o 10.672 0.9702 113.751  18.209  102.934   20.859  148.388   37.327  9.8806 1.0555 11.463 1.6282 -1.582019      1.940411  
1 1 1 4  23 12 o 9.8638 1.1710 109.457  18.788  107.105   21.413  117.326   39.167  10.054 1.0648 9.6733 2.0859 0.3811321      2.341966  
1 1 1 4  23 13 o 11.185 1.2109 170.026  20.162  194.864   23.399  98.419    39.729  13.702 0.8539 8.6678 2.2662 5.034137       2.421745  
1 1 1 4  23 14 o 12.921 0.9466 178.082  20.709  173.135   23.632  194.450   42.986  12.858 0.9190 12.985 1.6552 -0.1271925     1.893208  
1 1 1 4  23 15 o 3.8964 1.2108 -5.8027  15.454  -14.4118  17.558  23.813    32.565  2.7232 1.2770 5.0697 2.0575 -2.346465      2.421555  
1 1 1 4  23 16 o 7.4624 1.3882 62.229   18.415  52.514    20.923  95.619    38.789  6.6098 1.5999 8.3150 2.2692 -1.705212      2.776475  
1 1 1 4  23 17 o 8.0667 1.3070 82.443   18.899  83.335    21.901  79.843    37.401  8.6645 1.2639 7.4690 2.2881 1.195455       2.613930  
1 1 1 4  23 18 o 6.7457 1.3914 62.892   18.616  64.156    20.991  58.237    40.292  7.3136 1.4858 6.1778 2.3529 1.135791       2.782705  
1 1 1 4  23 19 o 3.8592 1.2332 1.5969   16.258  -4.9527   18.216  27.247    36.049  2.9630 1.3582 4.7554 2.0588 -1.792328      2.466427  
1 1 1 4  23 20 o 3.5393 1.1846 -14.7609 15.829  -24.4647  17.453  30.215    37.575  2.3327 1.1390 4.7459 2.0775 -2.413160      2.369260  
1 1 1 4  23 21 o 3.6765 1.1956 6.7441   18.941  9.3812    22.036  -0.7133   37.057  3.5695 1.5758 3.7835 1.7985 -0.2140198     2.391150  
1 1 1 4  23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  23 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 0  o 9.8131 1.3829 116.288  23.536  128.855   31.910  101.297   34.853  10.712 1.5932 8.9142 2.2609 -0.000000      0.000000  
1 1 1 4  24 1  o 12.617 0.7052 167.556  17.787  167.113   24.818  168.025   25.506  12.608 0.9842 12.626 1.0101 -0.1796818E-01 1.410330  
1 1 1 4  24 2  o 3.3795 1.0336 -1.0938  13.236  10.413    19.273  -11.3666  18.210  3.8796 1.5797 2.8794 1.3335 1.000231       2.067240  
1 1 1 4  24 3  o 8.0776 0.9658 71.876   15.150  60.711    20.503  85.305    22.486  7.2929 1.4567 8.8624 1.2686 -1.569453      1.931639  
1 1 1 4  24 4  o 10.151 0.8013 110.180  16.072  89.743    22.234  132.546   23.260  9.1125 1.2200 11.190 1.0394 -2.077089      1.602688  
1 1 1 4  24 5  o 10.721 0.9257 114.397  17.994  99.986    20.901  155.674   35.373  9.6883 1.0787 11.753 1.5048 -2.064971      1.851472  
1 1 1 4  24 6  o 4.9914 1.3008 23.454   15.090  17.631    17.289  42.074    30.915  4.1777 1.5519 5.8051 2.0880 -1.627387      2.601532  
1 1 1 4  24 7  o 10.369 0.9775 111.989  18.550  101.585   21.811  139.192   35.268  9.7308 1.1207 11.007 1.6020 -1.276585      1.955088  
1 1 1 4  24 8  o 3.6467 1.1252 2.0288   15.237  8.4492    18.263  -12.6754  27.639  3.7154 1.5281 3.5781 1.6520 0.1372957      2.250390  
1 1 1 4  24 9  o 3.8228 1.1388 4.7000   15.843  17.496    18.076  -37.7061  32.907  4.2496 1.5852 3.3960 1.6355 0.8536668      2.277669  
1 1 1 4  24 10 o 8.4497 1.1999 75.389   18.306  60.979    21.678  111.200   34.174  7.2669 1.5394 9.6325 1.8410 -2.365554      2.399841  
1 1 1 4  24 11 o 6.2815 1.3464 33.356   16.969  17.639    19.278  87.406    35.752  4.2939 1.6294 8.2691 2.1439 -3.975152      2.692811  
1 1 1 4  24 12 o 3.0091 1.0181 -19.0787 15.156  -15.0359  17.469  -31.3804  30.473  2.6902 1.2655 3.3280 1.5953 -0.6378250     2.036239  
1 1 1 4  24 13 o 10.994 1.2155 149.683  20.797  158.458   23.875  122.083   42.341  12.280 0.9721 9.7071 2.2281 2.573303       2.430920  
1 1 1 4  24 14 o 3.1730 1.0701 -17.6548 15.823  -16.5234  18.117  -21.2933  32.489  2.6989 1.2754 3.6472 1.7187 -0.9483421     2.140253  
1 1 1 4  24 15 o 9.1974 1.3123 111.875  20.088  118.734   23.079  90.437    40.801  10.485 1.1005 7.9095 2.3828 2.575935       2.624639  
1 1 1 4  24 16 o 6.0027 1.2751 51.273   19.378  67.399    22.651  7.2577    37.422  7.5009 1.5607 4.5044 2.0169 2.996526       2.550193  
1 1 1 4  24 17 o 4.5456 1.2875 22.210   18.935  32.968    21.684  -12.3338  38.856  5.0896 1.7554 4.0015 1.8839 1.088069       2.574969  
1 1 1 4  24 18 o 3.2955 1.1163 -14.1506 16.826  -18.8461  19.162  1.6591    35.161  2.6145 1.2564 3.9766 1.8456 -1.362116      2.232650  
1 1 1 4  24 19 o 6.3532 1.2298 68.600   19.787  82.291    22.205  15.806    43.604  8.2620 1.3438 4.4444 2.0601 3.817661       2.459608  
1 1 1 4  24 20 o 3.4843 1.1772 -12.1026 17.218  -22.9744  19.301  30.275    38.105  2.4693 1.2039 4.4992 2.0233 -2.029916      2.354398  
1 1 1 4  24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  24 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 0  o 7.5795 1.5168 80.344   21.695  114.314   30.736  46.618    30.626  9.9609 1.6885 5.1981 2.5203 -0.000000      0.000000  
1 1 1 4  25 1  o 8.8678 0.9332 87.841   15.882  105.164   22.620  70.995    22.306  9.8823 1.1444 7.8532 1.4743 2.029140       1.866362  
1 1 1 4  25 2  o 12.298 0.7272 160.230  17.868  151.219   24.671  170.170   25.913  11.932 1.0339 12.665 1.0230 -0.7333059     1.454488  
1 1 1 4  25 3  o 12.702 0.7136 170.744  18.102  182.151   25.739  159.581   25.462  13.142 0.9793 12.261 1.0383 0.8805180      1.427257  
1 1 1 4  25 4  o 2.7839 0.9143 -11.9802 12.253  -8.0094   17.702  -15.6329  16.978  2.9435 1.3454 2.6244 1.2385 0.3191006      1.828640  
1 1 1 4  25 5  o 6.7228 1.2835 56.916   17.075  61.277    20.107  45.637    32.335  7.3649 1.4165 6.0807 2.1409 1.284225       2.567065  
1 1 1 4  25 6  o 9.6636 1.0346 97.773   18.442  89.659    21.850  117.868   34.387  9.1563 1.1932 10.171 1.6905 -1.014700      2.069137  
1 1 1 4  25 7  o 8.4856 1.2038 79.417   18.086  73.777    21.143  94.797    34.916  8.2488 1.2816 8.7225 2.0382 -0.4736443     2.407619  
1 1 1 4  25 8  o 3.3234 1.0886 -22.8234 15.618  -36.3479  18.615  9.3365    28.705  2.2955 1.1319 4.3513 1.8598 -2.055733      2.177124  
1 1 1 4  25 9  o 5.2384 1.3843 27.804   17.668  24.057    20.538  38.469    34.653  4.7279 1.7017 5.7489 2.1838 -1.020975      2.768559  
1 1 1 4  25 10 o 9.8978 1.1483 114.562  19.633  117.168   23.334  108.242   36.333  10.476 1.1137 9.3199 2.0084 1.155704       2.296560  
1 1 1 4  25 11 o 7.1084 1.3575 64.827   18.569  67.842    21.370  55.536    37.515  7.7223 1.4365 6.4944 2.3039 1.227908       2.715051  
1 1 1 4  25 12 o 4.0552 1.2484 2.7575   16.986  -2.3365   19.911  16.380    32.560  3.3443 1.4860 4.7660 2.0063 -1.421678      2.496726  
1 1 1 4  25 13 f 3.9162 1.2556 -1.5757  18.244  -3.6939   20.909  5.1830    37.349  3.3300 1.4980 4.5024 2.0155 -1.172468      2.511234  
1 1 1 4  25 14 o 6.6259 1.4089 59.548   19.959  63.320    23.808  50.627    36.612  7.1828 1.6862 6.0691 2.2575 1.113740       2.817749  
1 1 1 4  25 15 o 5.8139 1.2995 47.186   19.890  64.386    23.741  6.6977    36.427  7.2057 1.6786 4.4221 1.9842 2.783536       2.599020  
1 1 1 4  25 16 o 4.5943 1.3701 16.659   19.273  8.3219    22.481  39.772    37.431  3.7992 1.6353 5.3894 2.1987 -1.590278      2.740188  
1 1 1 4  25 17 o 4.6759 1.3724 27.683   19.058  23.529    22.030  40.038    37.993  4.3206 1.7129 5.0312 2.1447 -0.7106447     2.744754  
1 1 1 4  25 18 o 5.7127 1.2835 54.761   19.617  67.652    22.596  15.312    39.530  7.1075 1.6250 4.3179 1.9872 2.789555       2.567003  
1 1 1 4  25 19 o 3.6402 1.1524 8.6691   18.042  19.566    20.354  -31.2953  38.979  3.9473 1.6171 3.3331 1.6424 0.6142197      2.304891  
1 1 1 4  25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  25 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 0  o 4.6660 1.6022 30.633   20.746  5.3535    28.399  59.559    30.378  3.1085 1.9980 6.2235 2.5052 -0.000000      0.000000  
1 1 1 4  26 1  o 4.0459 1.1601 10.870   14.795  18.064    21.506  4.4065    20.385  4.4170 1.7095 3.6747 1.5688 0.7422731      2.320292  
1 1 1 4  26 2  o 5.9576 1.1986 42.224   15.043  46.476    20.854  37.610    21.721  6.2801 1.6418 5.6351 1.7466 0.6449151      2.397125  
1 1 1 4  26 3  o 10.928 0.7755 125.642  16.643  96.518    22.463  161.091   24.782  9.4835 1.1843 12.373 1.0015 -2.889083      1.551005  
1 1 1 4  26 4  o 6.2170 1.2178 35.174   16.508  12.917    19.884  84.547    29.615  4.0497 1.6202 8.3844 1.8184 -4.334711      2.435506  
1 1 1 4  26 5  o 14.474 0.8890 228.380  22.954  231.135   27.165  221.503   42.918  14.887 0.9124 14.062 1.5260 0.8246031      1.777974  
1 1 1 4  26 6  o 6.9789 1.2438 61.998   17.327  69.724    20.555  43.032    32.205  8.0155 1.2822 5.9423 2.1318 2.073223       2.487665  
1 1 1 4  26 7  o 8.0637 1.2936 87.712   19.378  99.512    22.627  55.237    37.537  9.6252 1.1754 6.5021 2.3048 3.123162       2.587175  
1 1 1 4  26 8  o 9.7607 1.0710 99.751   19.884  83.694    24.018  134.731   35.450  8.6968 1.3809 10.825 1.6375 -2.127863      2.141989  
1 1 1 4  26 9  o 7.5154 1.3962 66.493   19.080  62.390    21.892  79.464    38.920  7.3461 1.5393 7.6847 2.3299 -0.3386250     2.792491  
1 1 1 4  26 10 o 3.4779 1.1411 -9.9158  17.241  -5.3642   20.005  -23.0581  33.994  3.2359 1.4596 3.7199 1.7545 -0.4839344     2.282280  
1 1 1 4  26 11 o 4.0931 1.2599 4.4318   17.414  -1.4095   20.500  19.569    33.000  3.3855 1.5059 4.8008 2.0204 -1.415378      2.519837  
1 1 1 4  26 12 o 10.644 1.2967 148.048  22.874  160.062   27.012  117.592   43.008  12.158 1.1109 9.1308 2.3433 3.027120       2.593309  
1 1 1 4  26 13 o 7.9505 1.4243 84.789   21.638  86.173    25.791  81.501    39.764  8.4894 1.5771 7.4117 2.3722 1.077749       2.848585  
1 1 1 4  26 14 o 4.7275 1.2549 24.343   19.845  44.446    22.874  -36.8376  39.903  5.8295 1.7899 3.6255 1.7593 2.204015       2.509781  
1 1 1 4  26 15 o 4.9115 1.4183 25.668   19.837  16.329    23.143  51.530    38.514  4.1201 1.7097 5.7028 2.2635 -1.582644      2.836676  
1 1 1 4  26 16 o 3.9173 1.2155 10.837   18.920  21.660    21.443  -27.2126  40.204  4.2355 1.6865 3.5991 1.7509 0.6364300      2.431058  
1 1 1 4  26 17 o 6.3401 1.4061 68.534   20.370  71.659    23.197  58.004    42.579  7.2659 1.6357 5.4144 2.2876 1.851443       2.812226  
1 1 1 4  26 18 o 5.1988 1.4457 49.694   21.259  48.201    24.161  54.812    44.739  5.4189 1.8537 4.9787 2.2189 0.4401774      2.891327  
1 1 1 4  26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  26 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 0  o 2.8127 1.3295 -7.2870  21.110  5.5366    28.851  -22.0628  30.969  3.1222 2.0096 2.5032 1.7411 -0.000000      0.000000  
1 1 1 4  27 1  o 6.5029 1.2118 50.544   16.059  57.449    23.036  44.015    22.399  6.9571 1.6755 6.0487 1.7511 0.9084010      2.423592  
1 1 1 4  27 2  o 7.4060 1.1345 64.314   16.328  58.833    23.261  69.639    22.926  7.0381 1.6765 7.7739 1.5290 -0.7358489     2.269031  
1 1 1 4  27 3  o 5.5863 1.3643 34.342   17.170  28.842    20.333  48.011    32.056  5.0142 1.7006 6.1583 2.1338 -1.144153      2.728515  
1 1 1 4  27 4  o 4.6596 1.3155 19.301   17.724  16.570    21.825  24.592    30.376  4.3175 1.7070 5.0016 2.0020 -0.6840353     2.630981  
1 1 1 4  27 5  o 8.0016 1.3045 82.564   19.696  90.524    23.467  63.594    36.226  9.1037 1.2889 6.8995 2.2685 2.204253       2.609073  
1 1 1 4  27 6  o 4.5893 1.2098 19.638   17.063  35.179    20.499  -15.4170  30.787  5.4655 1.6972 3.7130 1.7245 1.752572       2.419616  
1 1 1 4  27 7  o 4.0654 1.2550 4.3628   18.359  4.4164    22.453  4.2549    31.891  3.8007 1.6351 4.3301 1.9043 -0.5293913     2.509947  
1 1 1 4  27 8  o 5.9403 1.4203 44.867   19.512  46.658    23.306  40.670    35.679  6.1439 1.7884 5.7368 2.2071 0.4071107      2.840699  
1 1 1 4  27 9  o 3.7008 1.1952 -8.0437  17.862  -15.0689  21.320  8.4998    32.716  2.9990 1.4066 4.4025 1.9326 -1.403543      2.390311  
1 1 1 4  27 10 o 10.588 1.2303 135.958  22.350  137.124   26.438  133.038   41.841  11.195 1.1808 9.9816 2.1587 1.213629       2.460529  
1 1 1 4  27 11 o 5.5366 1.4108 27.615   20.057  7.2772    24.099  73.462    36.183  3.9162 1.6894 7.1570 2.2599 -3.240867      2.821548  
1 1 1 4  27 12 o 5.8568 1.4181 49.456   21.128  57.932    24.441  24.393    42.026  6.6868 1.7914 5.0267 2.1989 1.660120       2.836253  
1 1 1 4  27 13 o 6.6604 1.3782 67.956   20.995  78.701    24.697  39.956    39.868  7.9475 1.6090 5.3733 2.2381 2.574220       2.756393  
1 1 1 4  27 14 o 4.1425 1.3094 14.807   20.594  17.858    23.371  4.2047    43.565  4.0738 1.7066 4.2113 1.9863 -0.1375008     2.618716  
1 1 1 4  27 15 o 3.4849 1.1797 -18.2415 19.726  -31.0297  23.148  15.673    37.697  2.6394 1.2936 4.3304 1.9731 -1.691066      2.359347  
1 1 1 4  27 16 o 4.1468 1.3023 18.969   20.166  19.886    23.215  16.152    40.711  4.0549 1.6999 4.2386 1.9735 -0.1837368     2.604646  
1 1 1 4  27 17 o 3.7128 1.2414 -5.9298  19.969  -22.4517  23.000  44.650    40.243  2.6980 1.3152 4.7277 2.1060 -2.029757      2.482892  
1 1 1 4  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  27 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 0  o 9.1752 1.5930 106.752  25.311  94.919    35.550  118.919   36.046  8.4236 2.4324 9.9269 2.0578 -0.000000      0.000000  
1 1 1 4  28 1  o 11.622 0.8238 144.311  19.098  159.559   27.837  130.750   26.251  12.217 1.1392 11.027 1.1903 1.190410       1.647663  
1 1 1 4  28 2  o 14.567 0.8958 227.411  23.408  223.121   27.577  238.472   44.279  14.585 0.9454 14.548 1.5218 0.3657722E-01  1.791540  
1 1 1 4  28 3  o 9.5439 1.2394 108.126  20.789  108.424   24.707  107.405   38.473  9.9845 1.2373 9.1034 2.1478 0.8811283      2.478706  
1 1 1 4  28 4  o 8.5213 1.2272 77.201   19.798  54.685    23.873  126.793   35.429  6.6654 1.7635 10.377 1.7070 -3.711906      2.454350  
1 1 1 4  28 5  o 4.6461 1.3526 9.8359   18.725  -3.1387   21.934  44.694    35.952  3.4254 1.5382 5.8668 2.2254 -2.441466      2.705251  
1 1 1 4  28 6  o 3.9459 1.1944 5.4499   17.876  18.946    21.807  -22.2002  31.214  4.3808 1.7142 3.5111 1.6636 0.8697021      2.388778  
1 1 1 4  28 7  o 5.3336 1.4269 34.151   20.054  33.632    24.246  35.275    35.677  5.2420 1.8530 5.4251 2.1704 -0.1831312     2.853750  
1 1 1 4  28 8  o 6.2562 1.3193 55.275   21.034  75.832    25.484  11.341    37.255  7.8880 1.6675 4.6244 2.0448 3.263659       2.638525  
1 1 1 4  28 9  o 6.9419 1.4904 61.979   21.510  50.413    26.218  85.796    37.620  6.1817 1.9193 7.7022 2.2808 -1.520502      2.980897  
1 1 1 4  28 10 o 6.4697 1.4946 47.556   21.354  26.883    25.143  101.054   40.447  4.7704 1.8479 8.1691 2.3497 -3.398786      2.989265  
1 1 1 4  28 11 o 10.317 1.2472 130.951  23.015  123.456   27.520  148.390   41.978  10.339 1.3308 10.294 2.1098 0.4526043E-01  2.494462  
1 1 1 4  28 12 o 3.4938 1.1694 -7.7675  19.488  -8.8567   22.929  -4.9330   36.989  3.1259 1.4638 3.8617 1.8241 -0.7358348     2.338838  
1 1 1 4  28 13 o 4.8052 1.4359 24.589   20.616  13.466    23.649  59.806    42.080  3.9162 1.6813 5.6942 2.3281 -1.777912      2.871711  
1 1 1 4  28 14 o 5.1198 1.4484 42.770   21.402  40.968    24.920  47.835    41.780  5.1428 1.8710 5.0968 2.2115 0.4604197E-01  2.896771  
1 1 1 4  28 15 o 4.3410 1.2966 28.394   20.616  37.027    23.195  -4.0839   44.988  4.8272 1.7966 3.8548 1.8700 0.9723539      2.593206  
1 1 1 4  28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  28 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 0  o 2.6204 1.2676 -12.1683 21.002  -8.5315   29.891  -15.7140  29.514  2.7124 1.8398 2.5283 1.7444 -0.000000      0.000000  
1 1 1 4  29 1  o 7.6968 1.3441 75.328   19.830  74.178    24.339  77.599    34.199  7.8689 1.6010 7.5247 2.1595 0.3441296      2.688290  
1 1 1 4  29 2  o 8.0658 1.3740 85.300   20.853  88.013    24.529  78.227    39.602  8.8201 1.3905 7.3114 2.3702 1.508686       2.747989  
1 1 1 4  29 3  o 13.591 0.9678 208.354  23.765  208.861   28.357  207.156   43.557  13.967 1.0152 13.215 1.6481 0.7522650      1.935640  
1 1 1 4  29 4  o 5.0314 1.3561 30.029   18.971  35.107    22.913  18.960    33.828  5.3135 1.8052 4.7493 2.0241 0.5642085      2.712152  
1 1 1 4  29 5  o 4.8456 1.3932 15.407   19.760  1.3174    23.311  51.378    37.246  3.6425 1.6137 6.0487 2.2717 -2.406197      2.786470  
1 1 1 4  29 6  o 3.9943 1.2676 3.1066   19.258  2.4019    22.732  4.8981    36.247  3.6309 1.6018 4.3577 1.9652 -0.7268088     2.535295  
1 1 1 4  29 7  o 10.529 1.2545 142.405  23.074  149.419   27.936  127.350   40.930  11.565 1.2078 9.4918 2.1992 2.073597       2.508992  
1 1 1 4  29 8  o 3.6848 1.2183 -26.9709 20.741  -50.9726  25.147  24.098    36.681  2.5306 1.2595 4.8391 2.0859 -2.308460      2.436655  
1 1 1 4  29 9  o 6.6094 1.4527 55.645   21.588  30.335    26.352  107.297   37.645  4.8203 1.8849 8.3985 2.2109 -3.578211      2.905351  
1 1 1 4  29 10 o 5.4748 1.4914 48.312   22.004  46.313    25.678  53.837    42.688  5.5258 1.9100 5.4238 2.2910 0.1020021      2.982746  
1 1 1 4  29 11 o 6.7860 1.5773 75.205   23.578  69.518    27.916  89.358    44.040  6.8362 1.9475 6.7357 2.4817 0.1004701      3.154613  
1 1 1 4  29 12 o 5.2820 1.4844 39.951   21.678  24.367    25.674  78.663    40.464  4.3225 1.7978 6.2415 2.3625 -1.919004      2.968776  
1 1 1 4  29 13 o 3.6463 1.1574 3.5803   20.301  24.897    23.211  -65.8105  41.878  4.2307 1.7293 3.0619 1.5387 1.168752       2.314740  
1 1 1 4  29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  29 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 0  o 6.1169 2.1104 77.444   32.179  81.582    36.085  61.381    71.105  7.1006 2.7014 5.1331 3.2431 -0.000000      0.000000  
1 1 1 4  30 1  o 4.7607 1.3316 26.555   19.049  32.682    23.254  14.058    33.212  5.0662 1.8121 4.4552 1.9517 0.6110249      2.663193  
1 1 1 4  30 2  o 10.148 1.2784 151.856  22.332  189.219   27.456  78.822    38.386  13.178 1.0417 7.1188 2.3349 6.059264       2.556746  
1 1 1 4  30 3  f 3.6499 1.1738 -3.9534  19.406  9.6890    23.490  -33.2806  34.440  3.9088 1.6768 3.3910 1.6429 0.5178053      2.347515  
1 1 1 4  30 4  o 3.6696 1.1902 -2.8126  19.274  2.4288    23.471  -13.6637  33.772  3.6200 1.6107 3.7192 1.7526 -0.9923840E-01 2.380330  
1 1 1 4  30 5  o 4.9140 1.3981 25.389   20.499  11.287    25.314  52.252    34.937  4.0032 1.7292 5.8247 2.1975 -1.821462      2.796282  
1 1 1 4  30 6  o 4.8189 1.4023 29.908   20.229  25.705    23.930  40.434    37.869  4.5006 1.7849 5.1371 2.1632 -0.6365499     2.804511  
1 1 1 4  30 7  o 5.7437 1.4439 42.851   21.030  19.416    25.573  91.812    36.963  4.1868 1.7711 7.3006 2.2810 -3.113752      2.887866  
1 1 1 4  30 8  o 4.4149 1.3669 5.9378   21.304  -14.7641  25.116  59.046    40.227  3.1151 1.4807 5.7148 2.2981 -2.599683      2.733806  
1 1 1 4  30 9  o 2.7594 0.9751 -49.0251 20.361  -51.4574  25.327  -44.5808  34.236  2.4620 1.2314 3.0568 1.5124 -0.5947099     1.950277  
1 1 1 4  30 10 o 4.7759 1.3472 35.613   21.838  50.134    26.334  3.6343    39.078  5.5786 1.9339 3.9731 1.8762 1.605501       2.694453  
1 1 1 4  30 11 o 4.5658 1.2999 32.918   21.654  49.655    25.207  -14.2093  42.299  5.4751 1.8924 3.6565 1.7826 1.818605       2.599820  
1 1 1 4  30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  30 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 0  o 5.7745 2.3057 67.479   33.061  49.688    36.665  144.874   76.473  4.7477 2.6303 6.8012 3.7877 -0.000000      0.000000  
1 1 1 4  31 1  o 3.6177 1.3049 -46.6583 27.037  -12.1703  72.791  -52.1779  29.120  4.5316 2.2352 2.7038 1.3473 1.827793       2.609859  
1 1 1 4  31 2  o 3.8810 1.2294 4.1817   18.416  -6.6542   22.371  26.966    32.439  3.1574 1.4677 4.6046 1.9728 -1.447280      2.458828  
1 1 1 4  31 3  o 5.6505 1.3471 51.721   21.067  66.869    25.205  16.608    38.375  6.9003 1.8055 4.4008 1.9996 2.499503       2.694128  
1 1 1 4  31 4  o 4.9288 1.4156 32.051   20.448  23.035    24.634  52.027    36.670  4.3464 1.7796 5.5112 2.2019 -1.164773      2.831172  
1 1 1 4  31 5  o 6.7567 1.3692 78.198   22.617  97.891    27.900  40.456    38.625  8.5116 1.6985 5.0019 2.1481 3.509615       2.738429  
1 1 1 4  31 6  o 4.4699 1.3713 23.761   20.882  16.895    24.775  40.608    38.807  4.0078 1.7207 4.9319 2.1356 -0.9240680     2.742601  
1 1 1 4  31 7  o 5.2379 1.3768 47.547   21.429  58.427    25.590  22.009    39.206  6.1133 1.8959 4.3624 1.9970 1.750930       2.753684  
1 1 1 4  31 8  o 3.2738 1.1215 -16.7162 22.304  -5.8346   26.619  -42.3558  40.860  3.2841 1.5501 3.2635 1.6212 0.2062440E-01  2.243003  
1 1 1 4  31 9  o 2.8255 0.9886 -36.6905 20.886  -17.3232  24.758  -84.4846  38.893  2.9032 1.4033 2.7477 1.3928 0.1554854      1.977147  
1 1 1 4  31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  31 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 0  o 3.2529 1.6501 -16.2511 31.221  -28.8189  34.316  44.149    75.228  2.3575 1.6775 4.1483 2.8420 -0.000000      0.000000  
1 1 1 4  32 1  o 3.5741 1.1998 -5.8970  23.109  4.6449    33.858  -15.0914  31.620  3.8168 1.7846 3.3314 1.6041 0.4853816      2.399598  
1 1 1 4  32 2  o 3.6883 1.2240 -7.9720  23.165  -36.2754  30.876  28.479    35.039  2.9404 1.4514 4.4362 1.9712 -1.495738      2.447915  
1 1 1 4  32 3  o 3.9263 1.2355 15.836   19.541  20.374    24.250  7.4298    33.002  4.0339 1.7163 3.8188 1.7776 0.2151246      2.470981  
1 1 1 4  32 4  o 8.0655 1.5064 105.108  23.311  91.201    28.031  136.290   41.973  7.7498 1.8366 8.3813 2.3882 -0.6315255     3.012735  
1 1 1 4  32 5  o 6.2976 1.3997 77.828   23.121  93.866    28.266  45.401    40.192  7.8352 1.8359 4.7600 2.1134 3.075205       2.799413  
1 1 1 4  32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  32 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  33 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  34 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  35 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  36 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  37 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  37 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  37 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  37 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  37 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 4  37 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  1  0  o 22.587 0.6834 515.290  30.739  523.375   43.637  507.327   43.308  22.764 0.9623 22.409 0.9704 -0.000000      0.000000  
1 1 1 5  1  1  o 13.186 0.4666 174.786  12.285  185.806   17.368  163.749   17.381  13.604 0.6383 12.768 0.6806 0.8363886      0.9331226 
1 1 1 5  1  2  f 26.184 0.4935 688.418  25.843  697.211   36.592  679.668   36.503  26.352 0.6943 26.017 0.7015 0.3347225      0.9869956 
1 1 1 5  1  3  o 27.527 0.4992 760.347  27.484  765.297   38.865  755.396   38.870  27.617 0.7036 27.437 0.7083 0.1798573      0.9984263 
1 1 1 5  1  4  o 25.653 0.5557 646.468  25.084  691.242   49.735  631.195   29.049  26.211 0.9487 25.095 0.5788 1.116301       1.111346  
1 1 1 5  1  5  o 13.293 0.4784 177.422  12.714  182.526   17.929  172.258   18.033  13.486 0.6647 13.100 0.6883 0.3864651      0.9568404 
1 1 1 5  1  6  o 16.234 0.4773 264.403  15.495  264.951   21.876  263.852   21.952  16.251 0.6731 16.217 0.6768 0.3402519E-01  0.9545106 
1 1 1 5  1  7  o 5.2767 0.6243 28.663   6.3849  32.190    8.9170  24.953    9.1465  5.6601 0.7877 4.8933 0.9689 0.7667603      1.248677  
1 1 1 5  1  8  o 16.096 0.4806 260.202  15.460  271.641   21.935  248.910   21.795  16.448 0.6668 15.743 0.6922 0.7057028      0.9611204 
1 1 1 5  1  9  f 25.020 0.4955 628.016  24.796  632.273   35.107  623.778   35.027  25.104 0.6992 24.935 0.7024 0.1695862      0.9910833 
1 1 1 5  1  10 o 12.774 0.4985 163.741  12.734  163.246   17.826  164.257   18.196  12.755 0.6988 12.794 0.7111 -0.3864288E-01 0.9970201 
1 1 1 5  1  11 o 26.999 0.5040 731.032  27.207  707.240   38.307  755.248   38.648  26.554 0.7213 27.443 0.7041 -0.8883934     1.008016  
1 1 1 5  1  12 o 18.648 0.4872 348.748  18.165  336.386   25.448  361.588   25.936  18.311 0.6949 18.985 0.6831 -0.6746044     0.9744031 
1 1 1 5  1  13 o 21.967 0.4931 484.505  21.661  470.553   30.448  498.802   30.821  21.646 0.7033 22.288 0.6914 -0.6418514     0.9862758 
1 1 1 5  1  14 o 10.181 0.5321 104.287  10.821  105.092   14.967  103.406   15.662  10.224 0.7320 10.139 0.7724 0.8545399E-01  1.064115  
1 1 1 5  1  15 o 11.920 0.4754 141.006  11.135  132.780   14.288  153.729   17.769  11.489 0.6218 12.350 0.7194 -0.8609257     0.9508878 
1 1 1 5  1  16 o 16.629 0.4065 278.652  13.498  271.799   19.475  284.988   18.726  16.428 0.5927 16.829 0.5563 -0.4008980     0.8129224 
1 1 1 5  1  17 o 3.7014 0.6482 15.409   5.3288  4.9115    8.4967  22.215    6.8415  2.7312 1.0697 4.6716 0.7322 -1.940387      1.296304  
1 1 1 5  1  18 o 2.5530 0.6231 6.0207   4.1522  0.4618    6.9738  9.0736    5.1681  2.1707 0.9219 2.9354 0.8386 -0.7646871     1.246252  
1 1 1 5  1  19 o 6.0457 0.4862 36.784   5.7711  47.909    8.6961  28.028    7.7149  6.8604 0.6338 5.2310 0.7374 1.629357       0.9723564 
1 1 1 5  1  20 o 5.8355 0.5065 34.673   5.8808  36.952    8.8755  32.890    7.8516  6.0007 0.7395 5.6703 0.6924 0.3304396      1.013048  
1 1 1 5  1  21 o 7.5600 0.4661 58.195   7.0247  62.003    10.454  55.059    9.4857  7.7811 0.6717 7.3389 0.6463 0.4422255      0.9321284 
1 1 1 5  1  22 o 2.6961 0.7149 3.0699   5.4406  12.576    9.1446  -2.1388   6.7690  3.4553 1.1399 1.9370 0.8632 1.518281       1.429889  
1 1 1 5  1  23 o 5.8730 0.5842 35.396   6.7839  43.587    10.086  28.629    9.1671  6.4998 0.7759 5.2462 0.8737 1.253587       1.168474  
1 1 1 5  1  24 o 7.9922 0.5028 65.780   8.0338  64.765    11.467  66.758    11.259  7.9277 0.7232 8.0568 0.6987 -0.1290169     1.005612  
1 1 1 5  1  25 o 18.188 0.4194 335.116  15.111  326.906   19.927  346.223   23.179  17.946 0.5552 18.430 0.6288 -0.4839020     0.8388649 
1 1 1 5  1  26 o 2.4710 0.7338 0.4660   6.3594  -4.3611   8.8572  5.6020    9.1363  2.1211 0.9626 2.8209 1.1079 -0.6997633     1.467650  
1 1 1 5  1  27 o 4.0156 0.8176 16.806   7.2596  9.5020    9.7710  25.807    10.846  3.2053 1.1707 4.8259 1.1416 -1.620558      1.635213  
1 1 1 5  1  28 o 9.0368 0.5304 84.955   9.5288  86.375    12.869  83.232    14.177  9.1404 0.7040 8.9331 0.7935 0.2073288      1.060769  
1 1 1 5  1  29 o 9.8680 0.5339 102.272  10.447  103.935   13.980  100.169   15.724  9.9910 0.6996 9.7449 0.8068 0.2460871      1.067857  
1 1 1 5  1  30 o 4.1800 0.9525 20.789   9.1684  15.161    12.227  28.019    13.858  3.6405 1.3127 4.7195 1.3805 -1.079061      1.905006  
1 1 1 5  1  31 o 2.0307 0.6931 -12.9654 8.1276  -13.8510  10.355  -11.5442  13.117  1.8474 0.8964 2.2141 1.0573 -0.3667059     1.386180  
1 1 1 5  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  2  0  f 17.901 0.6628 324.244  23.566  313.088   33.417  335.281   33.237  17.588 0.9565 18.214 0.9177 -0.000000      0.000000  
1 1 1 5  2  1  o 21.629 0.4717 469.313  20.400  481.965   28.918  456.780   28.782  21.920 0.6596 21.338 0.6744 0.5818748      0.9433803 
1 1 1 5  2  2  o 25.767 0.4860 666.056  25.044  664.181   35.435  667.928   35.399  25.731 0.6886 25.804 0.6859 -0.7278442E-01 0.9719241 
1 1 1 5  2  3  o 38.623 0.5460 1497.78  42.175  1494.23   59.690  1501.31   59.598  38.577 0.7736 38.669 0.7706 -0.9188461E-01 1.091953  
1 1 1 5  2  4  o 17.428 0.4677 304.761  16.302  309.402   23.099  300.155   23.010  17.560 0.6577 17.295 0.6652 0.2650528      0.9354557 
1 1 1 5  2  5  o 25.358 0.4897 645.362  24.832  638.255   35.156  652.439   35.080  25.218 0.6970 25.498 0.6879 -0.2798653     0.9793084 
1 1 1 5  2  6  o 33.363 0.5240 1117.59  34.964  1108.28   49.508  1126.84   49.386  33.223 0.7451 33.502 0.7371 -0.2785378     1.048047  
1 1 1 5  2  7  o 7.2660 0.6083 51.933   7.6190  55.494    15.580  50.814    8.7347  7.4149 1.0506 7.1171 0.6136 0.2978106      1.216657  
1 1 1 5  2  8  o 22.951 0.5576 524.568  22.425  540.177   44.351  519.207   25.992  23.149 0.9579 22.754 0.5712 0.3954678      1.115284  
1 1 1 5  2  9  o 35.580 0.6544 1261.57  44.197  1309.48   76.160  1237.25   54.271  36.054 1.0562 35.105 0.7730 0.9488564      1.308817  
1 1 1 5  2  10 o 8.0896 0.7590 70.849   10.895  55.715    18.521  78.857    13.472  7.3156 1.3142 8.8636 0.7600 -1.547998      1.518092  
1 1 1 5  2  11 o 30.275 0.5196 919.535  31.459  906.592   44.479  932.490   44.499  30.061 0.7398 30.489 0.7298 -0.4276638     1.039173  
1 1 1 5  2  12 o 24.163 0.5006 585.994  24.186  567.132   34.118  605.047   34.290  23.771 0.7177 24.555 0.6982 -0.7841225     1.001283  
1 1 1 5  2  13 o 18.893 0.4928 358.541  18.622  359.539   26.274  357.533   26.397  18.920 0.6944 18.866 0.6996 0.5347824E-01  0.9856777 
1 1 1 5  2  14 f 11.232 0.5263 127.074  11.802  134.073   16.568  119.864   16.816  11.548 0.7173 10.915 0.7703 0.6335077      1.052593  
1 1 1 5  2  15 o 4.6292 0.7678 20.586   6.9613  13.366    8.6885  33.530    11.633  3.6104 1.1022 5.6479 1.0690 -2.037423      1.535508  
1 1 1 5  2  16 o 18.659 0.4618 352.026  16.938  354.383   22.051  348.635   26.452  18.753 0.5880 18.566 0.7124 0.1861076      0.9236691 
1 1 1 5  2  17 o 8.6123 0.9280 96.722   11.544  110.361   13.199  52.311    23.816  10.439 0.6322 6.7856 1.7451 3.653433       1.856059  
1 1 1 5  2  18 o 4.5791 0.8101 23.548   7.4247  27.167    9.5837  18.116    11.742  5.0397 0.9861 4.1186 1.2854 0.9211297      1.620119  
1 1 1 5  2  19 o 5.0392 0.7956 30.150   8.1431  40.445    10.463  14.333    12.968  6.2635 0.8352 3.8149 1.3544 2.448533       1.591257  
1 1 1 5  2  20 f 11.576 0.4271 136.307  9.8810  132.293   13.654  140.721   14.318  11.399 0.5989 11.752 0.6091 -0.3538666     0.8542514 
1 1 1 5  2  21 o 6.9146 0.4997 49.570   6.7824  46.193    10.431  52.043    8.9270  6.6890 0.7797 7.1401 0.6251 -0.4511242     0.9993860 
1 1 1 5  2  22 o 8.0237 0.5087 67.397   8.0039  53.891    11.526  79.977    11.124  7.2067 0.7996 8.8406 0.6291 -1.633903      1.017454  
1 1 1 5  2  23 o 4.2272 0.7423 20.281   6.3794  13.881    9.7537  25.065    8.4333  3.6208 1.1765 4.8336 0.9056 -1.212743      1.484671  
1 1 1 5  2  24 o 4.3288 0.7707 20.921   6.6444  19.363    10.138  22.095    8.7974  4.1685 1.1688 4.4891 1.0049 -0.3205547     1.541412  
1 1 1 5  2  25 o 5.0912 0.7277 28.024   7.1506  32.236    10.435  24.295    9.8182  5.4715 0.9900 4.7110 1.0668 0.7605395      1.455424  
1 1 1 5  2  26 o 8.6299 0.5167 76.546   8.9100  81.253    12.800  72.122    12.410  8.8906 0.7199 8.3692 0.7414 0.5213785      1.033393  
1 1 1 5  2  27 o 5.9838 0.6999 38.282   8.1925  40.048    11.548  36.493    11.625  6.1765 0.9348 5.7911 1.0420 0.3854203      1.399849  
1 1 1 5  2  28 o 3.1541 0.8553 8.0277   7.8213  12.609    10.676  2.7201    11.491  3.4943 1.2302 2.8139 1.1886 0.6803892      1.710584  
1 1 1 5  2  29 o 12.891 0.4721 172.511  12.150  170.926   16.670  174.307   17.746  12.841 0.6491 12.941 0.6857 -0.9991837E-01 0.9441942 
1 1 1 5  2  30 o 3.2249 0.8996 9.9069   8.5059  9.9882    11.284  9.7998    12.945  3.1896 1.2373 3.2602 1.3062 -0.7058740E-01 1.799189  
1 1 1 5  2  31 o 3.5898 0.8954 12.838   8.7829  1.9808    11.522  27.896    13.569  2.6184 1.1482 4.5611 1.3741 -1.942672      1.790722  
1 1 1 5  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  2  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  3  0  o 8.4039 0.7270 73.949   11.728  75.583    16.728  72.371    16.447  8.5008 1.0232 8.3069 1.0330 -0.000000      0.000000  
1 1 1 5  3  1  o 16.779 0.4604 282.356  15.451  284.638   21.855  280.076   21.846  16.847 0.6486 16.711 0.6536 0.1359501      0.9208398 
1 1 1 5  3  2  o 19.903 0.4658 397.375  18.544  398.271   26.221  396.478   26.228  19.926 0.6580 19.881 0.6596 0.4504776E-01  0.9316812 
1 1 1 5  3  3  o 2.6731 0.6517 6.3525   4.2864  8.3189    6.1092  4.4459    6.0156  2.9081 0.9297 2.4381 0.9135 0.4699273      1.303382  
1 1 1 5  3  4  o 26.712 0.4884 716.080  26.092  719.032   36.958  713.147   36.843  26.767 0.6904 26.657 0.6911 0.1098595      0.9768201 
1 1 1 5  3  5  f 11.795 0.4708 139.600  11.103  136.815   15.738  142.358   15.666  11.678 0.6739 11.913 0.6575 -0.2351398     0.9415039 
1 1 1 5  3  6  o 27.688 0.4961 769.703  27.472  763.574   38.944  775.774   38.758  27.578 0.7061 27.799 0.6971 -0.2208252     0.9922273 
1 1 1 5  3  7  o 11.460 0.4759 131.870  10.907  131.087   15.390  132.659   15.459  11.426 0.6735 11.494 0.6725 -0.6836891E-01 0.9517153 
1 1 1 5  3  8  f 27.891 0.5001 780.560  27.897  788.185   39.680  773.108   39.227  28.026 0.7079 27.757 0.7066 0.2691650      1.000237  
1 1 1 5  3  9  o 31.933 0.5198 1023.75  33.192  1017.68   47.209  1029.68   46.678  31.838 0.7414 32.028 0.7287 -0.1892128     1.039550  
1 1 1 5  3  10 o 19.889 0.5705 407.239  19.523  377.069   38.623  417.593   22.627  19.361 0.9974 20.417 0.5541 -1.055311      1.141013  
1 1 1 5  3  11 o 15.772 0.6161 257.199  18.309  227.206   30.658  273.828   22.827  15.022 1.0204 16.522 0.6908 -1.499731      1.232261  
1 1 1 5  3  12 o 25.936 0.6218 682.218  30.502  659.522   52.016  694.112   37.656  25.579 1.0168 26.294 0.7161 -0.7149849     1.243627  
1 1 1 5  3  13 f 18.824 0.6153 364.845  21.747  333.095   37.026  381.565   26.870  18.159 1.0195 19.489 0.6894 -1.329287      1.230655  
1 1 1 5  3  14 f 10.392 0.7088 117.619  13.290  87.416    22.740  133.286   16.378  9.2722 1.2262 11.513 0.7113 -2.240287      1.417605  
1 1 1 5  3  15 o 4.5880 0.9281 13.323   9.0584  43.355    17.970  3.0919    10.488  6.3422 1.4485 2.8339 1.1609 3.508309       1.856265  
1 1 1 5  3  16 o 10.678 0.5752 116.981  12.175  105.898   17.861  126.599   16.639  10.187 0.8767 11.169 0.7449 -0.9825306     1.150401  
1 1 1 5  3  17 o 16.610 0.6540 281.594  20.533  279.325   25.194  286.082   35.436  16.575 0.7600 16.644 1.0645 -0.6857491E-01 1.307968  
1 1 1 5  3  18 o 7.0701 0.8573 53.216   11.742  52.175    15.538  54.602    17.927  7.0676 1.0993 7.0726 1.3158 -0.4974365E-02 1.714552  
1 1 1 5  3  19 f 4.4066 0.7942 19.672   9.0968  -3.4457   13.616  38.310    12.226  2.7563 1.2266 6.0569 1.0093 -3.300588      1.588439  
1 1 1 5  3  20 o 11.197 0.7220 131.608  15.866  128.465   20.466  136.341   25.118  11.085 0.9232 11.310 1.1104 -0.2252131     1.444062  
1 1 1 5  3  21 o 7.6586 0.8204 64.946   11.944  53.761    17.697  74.303    16.187  6.9118 1.3285 8.4054 0.9629 -1.493594      1.640753  
1 1 1 5  3  22 o 11.104 0.5931 125.291  13.008  106.587   16.909  152.408   20.360  10.116 0.8358 12.093 0.8418 -1.977008      1.186231  
1 1 1 5  3  23 o 2.9814 0.8551 4.7693   7.8574  7.6410    12.272  2.7740    10.229  3.2419 1.2806 2.7209 1.1335 0.5210259      1.710172  
1 1 1 5  3  24 o 4.4554 0.7785 21.248   6.8879  28.094    10.753  16.484    8.9698  5.0420 1.0975 3.8688 1.1046 1.173226       1.557086  
1 1 1 5  3  25 o 10.535 0.4666 113.259  9.8107  117.106   14.422  109.945   13.385  10.696 0.6742 10.374 0.6451 0.3220873      0.9331464 
1 1 1 5  3  26 o 18.993 0.4036 367.168  15.328  372.436   21.884  362.095   21.476  19.126 0.5721 18.861 0.5693 0.2657928      0.8071122 
1 1 1 5  3  27 o 8.7777 0.5509 80.138   9.6389  73.857    13.763  86.185    13.504  8.4235 0.8169 9.1319 0.7394 -0.7083883     1.101848  
1 1 1 5  3  28 o 3.8312 0.8777 15.957   7.9125  10.694    11.218  21.168    11.162  3.3552 1.2493 4.3071 1.2331 -0.9518991     1.755343  
1 1 1 5  3  29 o 4.5119 0.8729 23.935   8.8013  35.740    12.407  11.976    12.487  5.5671 1.1523 3.4568 1.3115 2.110270       1.745756  
1 1 1 5  3  30 o 4.5931 0.8890 27.038   9.9472  7.1046    15.118  42.257    13.209  3.2063 1.3593 5.9799 1.1462 -2.773667      1.778080  
1 1 1 5  3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  4  0  o 14.334 0.6607 208.695  18.749  216.866   26.756  200.812   26.281  14.615 0.9238 14.052 0.9449 -0.000000      0.000000  
1 1 1 5  4  1  f 34.085 0.5191 1166.86  35.381  1142.08   49.923  1191.87   50.149  33.720 0.7403 34.450 0.7278 -0.7298279     1.038141  
1 1 1 5  4  2  o 32.205 0.5100 1041.44  32.849  1036.81   46.417  1046.09   46.493  32.133 0.7223 32.277 0.7202 -0.1439514     1.019982  
1 1 1 5  4  3  o 22.252 0.4729 496.789  21.047  502.823   29.803  490.786   29.727  22.388 0.6656 22.117 0.6720 0.2702770      0.9458687 
1 1 1 5  4  4  o 37.533 0.5370 1414.60  40.307  1404.75   56.957  1424.48   57.049  37.402 0.7614 37.664 0.7573 -0.2626610     1.073931  
1 1 1 5  4  5  o 19.886 0.4692 396.807  18.661  400.472   26.397  393.145   26.385  19.978 0.6607 19.794 0.6665 0.1841869      0.9384573 
1 1 1 5  4  6  o 8.5810 0.4989 73.923   8.5547  69.954    11.966  78.073    12.235  8.3449 0.7170 8.8171 0.6938 -0.4722681     0.9977102 
1 1 1 5  4  7  o 25.781 0.4882 667.257  25.172  671.134   35.647  663.401   35.551  25.856 0.6893 25.706 0.6915 0.1496868      0.9763911 
1 1 1 5  4  8  o 7.1932 0.5401 51.974   7.7653  50.133    11.023  53.787    10.941  7.0661 0.7800 7.3203 0.7473 -0.2541986     1.080210  
1 1 1 5  4  9  o 29.492 0.5038 872.586  29.715  883.342   42.240  862.047   41.810  29.672 0.7118 29.312 0.7132 0.3600368      1.007604  
1 1 1 5  4  10 o 32.293 0.5170 1046.09  33.389  1044.47   47.427  1047.69   47.013  32.268 0.7349 32.318 0.7273 -0.5059433E-01 1.033975  
1 1 1 5  4  11 o 9.1642 0.5297 86.461   9.3872  61.930    13.400  110.099   13.154  7.8499 0.8535 10.479 0.6277 -2.628694      1.059480  
1 1 1 5  4  12 o 29.134 0.6337 849.245  34.731  838.828   42.328  870.709   60.759  28.895 0.7324 29.372 1.0343 -0.4764938     1.267380  
1 1 1 5  4  13 o 5.1307 0.9116 29.127   9.2471  20.934    15.680  33.496    11.450  4.5924 1.4916 5.6691 1.0485 -1.076728      1.823256  
1 1 1 5  4  14 o 23.610 0.6242 573.721  27.755  531.293   47.132  596.245   34.341  22.885 1.0298 24.336 0.7056 -1.450891      1.248309  
1 1 1 5  4  15 o 18.054 0.5180 329.860  18.674  316.679   26.834  342.237   26.003  17.697 0.7581 18.411 0.7062 -0.7137108     1.036096  
1 1 1 5  4  16 o 4.9864 0.8771 27.565   8.6686  23.559    13.654  30.269    11.220  4.6617 1.3723 5.3111 1.0927 -0.6494565     1.754198  
1 1 1 5  4  17 o 7.7736 0.8854 60.538   13.217  53.693    16.208  74.123    22.833  7.1830 1.1282 8.3641 1.3649 -1.181158      1.770857  
1 1 1 5  4  18 o 6.9779 0.8654 52.395   11.690  53.203    15.590  51.357    17.668  7.1271 1.0937 6.8287 1.3415 0.2983661      1.730864  
1 1 1 5  4  19 o 3.8511 0.9291 15.072   8.9604  7.5323    13.929  20.395    11.703  3.3881 1.3559 4.3142 1.2706 -0.9260869     1.858189  
1 1 1 5  4  20 f 14.827 0.5647 227.407  16.714  230.272   24.467  224.901   22.888  14.901 0.8210 14.754 0.7756 0.1463928      1.129444  
1 1 1 5  4  21 o 4.3974 0.9997 21.722   10.623  11.071    16.107  29.920    14.131  3.6972 1.4650 5.0975 1.3607 -1.400286      1.999404  
1 1 1 5  4  22 o 12.800 0.9184 178.020  23.350  152.453   31.470  209.333   34.828  11.752 1.3389 13.848 1.2575 -2.095945      1.836825  
1 1 1 5  4  23 o 4.6416 1.0129 23.482   11.489  7.9944    16.830  36.997    15.722  3.5929 1.4710 5.6903 1.3927 -2.097382      2.025758  
1 1 1 5  4  24 o 7.7738 0.8509 70.230   11.972  89.034    15.930  45.826    18.147  9.2484 0.8612 6.2991 1.4677 2.949298       1.701717  
1 1 1 5  4  25 o 7.4062 0.7698 61.291   10.536  47.757    16.331  70.940    13.790  6.5388 1.2946 8.2736 0.8334 -1.734777      1.539613  
1 1 1 5  4  26 o 4.5629 0.9663 23.945   9.6888  17.864    15.169  28.136    12.592  4.1309 1.4650 4.9948 1.2605 -0.8639793     1.932649  
1 1 1 5  4  27 o 10.742 0.6115 123.074  12.861  105.748   19.296  136.924   17.252  9.9888 0.9659 11.496 0.7504 -1.506874      1.223099  
1 1 1 5  4  28 o 10.363 0.6520 117.836  12.985  92.149    19.660  137.710   17.293  9.2255 1.0655 11.501 0.7518 -2.275087      1.304067  
1 1 1 5  4  29 o 3.9362 1.0137 16.805   10.570  26.361    16.079  9.5305    14.028  4.5445 1.5121 3.3278 1.3504 1.216746       2.027360  
1 1 1 5  4  30 o 10.846 0.6460 130.142  13.960  129.128   20.575  131.006   19.003  10.758 0.9563 10.935 0.8689 -0.1774073     1.292083  
1 1 1 5  4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  5  0  o 23.173 0.6754 541.616  31.170  526.848   44.177  556.256   43.987  22.854 0.9705 23.492 0.9396 -0.000000      0.000000  
1 1 1 5  5  1  o 10.401 0.4828 108.857  10.007  118.845   14.098  98.713    14.207  10.885 0.6476 9.9173 0.7163 0.9680119      0.9656188 
1 1 1 5  5  2  o 28.869 0.4948 836.343  28.565  844.375   40.398  828.313   40.395  29.008 0.6963 28.730 0.7030 0.2781715      0.9895027 
1 1 1 5  5  3  o 20.597 0.4682 425.644  19.288  428.855   27.261  422.426   27.294  20.675 0.6593 20.519 0.6651 0.1561413      0.9364907 
1 1 1 5  5  4  o 15.834 0.4656 251.609  14.744  250.843   20.929  252.364   20.774  15.810 0.6619 15.858 0.6550 -0.4842949E-01 0.9311832 
1 1 1 5  5  5  o 18.848 0.4684 356.663  17.657  352.172   24.987  361.142   24.955  18.729 0.6671 18.967 0.6578 -0.2380486     0.9368595 
1 1 1 5  5  6  o 34.773 0.5241 1214.81  36.452  1215.33   51.564  1214.30   51.537  34.781 0.7413 34.766 0.7412 0.1467133E-01  1.048265  
1 1 1 5  5  7  o 14.444 0.4700 209.519  13.541  228.673   19.220  190.643   19.080  15.102 0.6363 13.786 0.6920 1.316165       0.9400963 
1 1 1 5  5  8  o 19.851 0.4725 395.341  18.756  401.401   26.503  389.262   26.546  20.004 0.6624 19.698 0.6738 0.3058624      0.9449100 
1 1 1 5  5  9  o 11.853 0.4839 140.887  11.472  142.032   16.208  139.738   16.240  11.902 0.6809 11.805 0.6878 0.9683990E-01  0.9678823 
1 1 1 5  5  10 o 32.879 0.5183 1084.85  34.077  1069.09   48.143  1100.68   48.242  32.639 0.7375 33.119 0.7283 -0.4800873     1.036516  
1 1 1 5  5  11 o 22.087 0.4812 489.551  21.256  496.712   30.170  482.492   29.952  22.248 0.6780 21.927 0.6830 0.3213406      0.9624008 
1 1 1 5  5  12 o 13.273 0.4870 176.974  12.926  177.565   18.425  176.400   18.139  13.295 0.6929 13.252 0.6844 0.4294109E-01  0.9739411 
1 1 1 5  5  13 o 13.065 0.4922 171.526  12.859  174.511   18.391  168.672   17.985  13.176 0.6979 12.954 0.6942 0.2219696      0.9843321 
1 1 1 5  5  14 o 17.145 0.6310 294.326  20.093  288.336   24.168  307.734   36.161  16.907 0.7147 17.383 1.0401 -0.4758072     1.262013  
1 1 1 5  5  15 o 17.589 0.5259 315.167  18.358  274.606   26.241  354.048   25.692  16.458 0.7972 18.720 0.6862 -2.262695      1.051886  
1 1 1 5  5  16 o 10.537 0.7147 116.953  14.573  125.256   18.845  104.602   22.983  11.060 0.8519 10.013 1.1477 1.047716       1.429334  
1 1 1 5  5  17 o 9.8663 0.7877 100.614  14.683  97.751    17.938  106.427   25.561  9.7279 0.9220 10.005 1.2774 -0.2767849     1.575410  
1 1 1 5  5  18 o 5.9192 0.8744 38.205   9.9486  41.886    15.189  35.440    13.166  6.1565 1.2755 5.6819 1.1964 0.4746752      1.748805  
1 1 1 5  5  19 o 8.0734 0.8180 64.062   12.685  91.166    21.937  50.448    15.547  9.2471 1.1861 6.8997 1.1267 2.347402       1.635928  
1 1 1 5  5  20 o 7.4343 0.7899 58.168   11.651  66.071    17.911  52.371    15.341  7.8560 1.1400 7.0126 1.0938 0.8434291      1.579846  
1 1 1 5  5  21 o 10.072 0.6772 106.393  13.592  114.432   20.306  99.868    18.294  10.404 0.9759 9.7390 0.9392 0.6651583      1.354421  
1 1 1 5  5  22 o 8.2152 0.8060 71.014   13.121  85.561    19.971  59.968    17.403  8.9547 1.1151 7.4757 1.1640 1.478952       1.611955  
1 1 1 5  5  23 o 6.7299 0.9913 51.935   13.069  43.012    19.340  59.434    17.730  6.0395 1.5822 7.4203 1.1947 -1.380800      1.982587  
1 1 1 5  5  24 o 8.0436 0.9263 71.687   14.382  64.605    21.150  77.780    19.616  7.5492 1.4536 8.5381 1.1487 -0.9888411     1.852687  
1 1 1 5  5  25 o 13.644 0.6675 194.825  18.184  192.364   26.383  197.053   25.098  13.543 0.9741 13.746 0.9129 -0.2030334     1.335014  
1 1 1 5  5  26 o 17.000 0.5799 296.721  19.521  281.536   25.598  317.824   30.177  16.517 0.7749 17.484 0.8630 -0.9671669     1.159848  
1 1 1 5  5  27 o 2.2535 0.7506 -10.2305 8.4346  -17.0105  14.646  -6.8661   10.317  2.3255 1.1124 2.1815 1.0080 0.1440132      1.501132  
1 1 1 5  5  28 o 9.0766 0.7301 91.878   12.720  74.760    19.598  104.337   16.721  8.2064 1.1941 9.9468 0.8405 -1.740453      1.460242  
1 1 1 5  5  29 o 7.9415 0.8071 70.149   12.198  96.183    19.202  52.534    15.795  9.2531 1.0376 6.6300 1.2367 2.623069       1.614289  
1 1 1 5  5  30 o 5.8198 1.0193 43.568   11.676  50.872    18.245  38.502    15.194  6.1887 1.4916 5.4508 1.3896 0.7378855      2.038550  
1 1 1 5  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  6  0  o 15.264 0.6733 236.500  20.368  234.322   28.814  238.675   28.797  15.191 0.9571 15.336 0.9472 -0.000000      0.000000  
1 1 1 5  6  1  o 9.5535 0.5097 92.905   9.5662  111.633   13.429  73.612    13.630  10.549 0.6365 8.5583 0.7963 1.990458       1.019462  
1 1 1 5  6  2  o 30.542 0.5031 936.766  30.723  963.673   43.552  910.113   43.346  30.980 0.7029 30.104 0.7199 0.8762321      1.006164  
1 1 1 5  6  3  o 12.750 0.4713 163.315  12.004  172.343   16.972  154.280   16.980  13.104 0.6476 12.396 0.6849 0.7083712      0.9425793 
1 1 1 5  6  4  o 21.708 0.4747 473.175  20.605  462.649   29.066  483.810   29.215  21.464 0.6771 21.951 0.6654 -0.4869461     0.9493434 
1 1 1 5  6  5  o 7.4113 0.5402 55.154   8.0033  52.737    11.189  57.687    11.452  7.2448 0.7722 7.5779 0.7556 -0.3331642     1.080425  
1 1 1 5  6  6  o 7.1324 0.5551 51.013   7.9110  48.171    10.996  54.063    11.390  6.9264 0.7938 7.3384 0.7761 -0.4120021     1.110119  
1 1 1 5  6  7  o 17.260 0.4710 298.840  16.257  293.985   22.948  303.731   23.033  17.119 0.6703 17.401 0.6619 -0.2821178     0.9419655 
1 1 1 5  6  8  o 19.837 0.4748 394.584  18.836  395.924   26.631  393.242   26.646  19.871 0.6701 19.803 0.6728 0.6762314E-01  0.9495636 
1 1 1 5  6  9  o 28.606 0.6212 827.477  33.305  806.956   57.964  837.592   40.694  28.316 1.0235 28.897 0.7041 -0.5814133     1.242332  
1 1 1 5  6  10 o 10.133 0.5015 103.043  10.163  101.698   14.336  104.402   14.408  10.066 0.7121 10.200 0.7063 -0.1332493     1.002959  
1 1 1 5  6  11 o 31.862 0.5162 1019.99  32.894  1020.41   46.559  1019.58   46.480  31.869 0.7305 31.856 0.7295 0.1278305E-01  1.032377  
1 1 1 5  6  12 o 13.354 0.6223 180.043  15.393  180.634   18.574  178.747   27.503  13.408 0.6927 13.299 1.0340 0.1089373      1.244573  
1 1 1 5  6  13 o 14.516 0.4875 211.971  14.150  217.733   20.157  206.374   19.868  14.711 0.6851 14.321 0.6937 0.3899775      0.9749465 
1 1 1 5  6  14 o 11.487 0.5764 132.307  12.885  128.031   16.312  139.400   21.012  11.258 0.7244 11.716 0.8967 -0.4580717     1.152773  
1 1 1 5  6  15 o 14.541 0.6238 212.822  15.368  209.851   17.526  222.706   31.966  14.409 0.6081 14.673 1.0893 -0.2640467     1.247526  
1 1 1 5  6  16 o 13.920 0.6769 201.464  17.623  206.609   21.597  191.212   30.484  14.257 0.7574 13.584 1.1221 0.6726770      1.353788  
1 1 1 5  6  17 o 11.491 0.7668 140.448  16.547  146.465   20.483  129.146   28.072  11.941 0.8577 11.040 1.2714 0.9013929      1.533609  
1 1 1 5  6  18 o 6.5479 0.8364 44.919   10.613  54.330    16.706  38.550    13.743  7.1617 1.1664 5.9342 1.1992 1.227514       1.672890  
1 1 1 5  6  19 o 7.8798 1.0686 71.172   15.109  72.472    18.151  68.238    27.268  8.2570 1.0991 7.5025 1.8329 0.7545085      2.137209  
1 1 1 5  6  20 o 7.0059 0.8621 54.426   11.463  49.886    17.949  57.553    14.896  6.6246 1.3986 7.3872 1.0082 -0.7626143     1.724148  
1 1 1 5  6  21 o 5.8279 1.0095 39.793   11.611  35.989    18.050  42.478    15.165  5.5172 1.5641 6.1386 1.2768 -0.6214480     2.019064  
1 1 1 5  6  22 o 4.0958 1.0295 16.841   11.148  7.1125    17.080  24.062    14.715  3.5664 1.4735 4.6252 1.4382 -1.058733      2.059025  
1 1 1 5  6  23 o 6.8835 0.9870 56.136   13.045  41.175    20.197  66.844    17.087  5.8572 1.6523 7.9098 1.0801 -2.052581      1.974035  
1 1 1 5  6  24 o 3.8047 1.0653 10.843   11.929  13.969    18.327  8.5446    15.714  4.0444 1.5746 3.5650 1.4354 0.4793200      2.130631  
1 1 1 5  6  25 o 8.8686 0.8807 84.287   15.547  94.391    23.381  76.278    20.816  9.3371 1.2521 8.4002 1.2390 0.9369097      1.761497  
1 1 1 5  6  26 o 4.6277 1.1583 21.429   14.050  34.108    20.336  9.8483    19.434  5.3920 1.6931 3.8635 1.5812 1.528444       2.316576  
1 1 1 5  6  27 o 6.3814 1.1509 50.435   15.404  32.540    22.070  67.433    21.509  5.1702 1.7716 7.5927 1.4696 -2.422548      2.301791  
1 1 1 5  6  28 f 5.8010 1.1737 42.741   14.174  42.274    18.427  43.418    22.182  5.8367 1.5518 5.7653 1.7614 0.7130766E-01  2.347487  
1 1 1 5  6  29 o 9.0090 0.7391 88.767   13.073  102.755   21.042  79.974    16.683  9.5153 1.1057 8.5027 0.9810 1.012590       1.478188  
1 1 1 5  6  30 o 3.5491 0.9887 14.240   10.991  1.2803    19.237  20.520    13.391  3.1207 1.4171 3.9776 1.3791 -0.8568766     1.977377  
1 1 1 5  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  7  0  o 11.174 0.7145 128.354  15.659  133.758   22.468  123.250   21.835  11.410 1.0023 10.937 1.0185 -0.000000      0.000000  
1 1 1 5  7  1  o 10.860 0.4975 118.489  10.805  120.428   15.256  116.537   15.305  10.950 0.6966 10.770 0.7105 0.1792755      0.9950281 
1 1 1 5  7  2  o 34.369 0.5226 1187.03  35.920  1177.73   50.813  1196.33   50.786  34.233 0.7422 34.504 0.7359 -0.2707367     1.045180  
1 1 1 5  7  3  o 21.563 0.4754 466.724  20.504  468.254   29.010  465.197   28.984  21.599 0.6716 21.528 0.6732 0.7081795E-01  0.9508749 
1 1 1 5  7  4  o 9.4044 0.5120 89.064   9.5931  96.685    13.444  81.159    13.693  9.8175 0.6847 8.9914 0.7614 0.8260593      1.024005  
1 1 1 5  7  5  o 43.331 0.5696 1885.81  49.359  1912.27   69.977  1859.60   69.634  43.634 0.8019 43.028 0.8092 0.6067924      1.139182  
1 1 1 5  7  6  o 4.7986 0.6894 24.052   6.3885  25.583    8.9573  22.468    9.1140  4.9625 0.9368 4.6347 1.0116 0.3278351      1.378793  
1 1 1 5  7  7  o 24.313 0.4842 592.841  23.542  595.831   33.227  589.826   33.360  24.375 0.6816 24.252 0.6878 0.1237755      0.9683014 
1 1 1 5  7  8  o 38.049 0.5418 1452.80  41.225  1472.13   58.368  1433.55   58.234  38.302 0.7619 37.795 0.7704 0.5066948      1.083535  
1 1 1 5  7  9  o 22.121 0.4810 490.930  21.277  494.294   29.964  487.509   30.218  22.198 0.6749 22.044 0.6854 0.1539516      0.9619215 
1 1 1 5  7  10 o 8.9884 0.5228 81.183   9.3746  88.767    13.389  73.890    13.130  9.4018 0.7121 8.5750 0.7656 0.8267756      1.045548  
1 1 1 5  7  11 o 26.266 0.4972 693.464  26.100  723.513   36.980  663.637   36.843  26.836 0.6890 25.697 0.7169 1.139330       0.9943076 
1 1 1 5  7  12 o 14.556 0.5746 214.609  16.037  217.789   20.099  209.036   26.606  14.721 0.6827 14.392 0.9243 0.3288107      1.149112  
1 1 1 5  7  13 o 11.606 0.5012 135.884  11.633  133.118   16.468  138.639   16.434  11.487 0.7168 11.725 0.7008 -0.2380571     1.002475  
1 1 1 5  7  14 o 16.490 0.4900 274.448  16.145  258.806   22.490  291.076   23.189  16.003 0.7027 16.976 0.6830 -0.9733028     0.9799179 
1 1 1 5  7  15 o 16.699 0.6104 282.891  17.474  280.158   20.058  291.492   35.586  16.637 0.6028 16.760 1.0616 -0.1231556     1.220815  
1 1 1 5  7  16 o 5.2176 0.9579 26.777   8.2880  24.895    9.1389  35.497    19.669  4.8252 0.9804 5.6099 1.6458 -0.7846942     1.915707  
1 1 1 5  7  17 o 4.5494 0.9012 25.075   8.0281  28.342    8.7476  7.6293    20.214  5.2470 0.8336 3.8518 1.5981 1.395170       1.802421  
1 1 1 5  7  18 f 5.8588 0.9573 42.719   9.6714  46.860    10.858  26.825    21.274  6.7486 0.8045 4.9690 1.7373 1.779574       1.914540  
1 1 1 5  7  19 o 4.0646 0.9779 15.930   6.9959  15.830    7.3977  16.779    21.520  3.8099 0.9687 4.3194 1.6991 -0.5095108     1.955823  
1 1 1 5  7  20 o 5.0184 1.0199 29.791   10.768  24.891    17.666  32.688    13.583  4.6761 1.5851 5.3606 1.2838 -0.6845093     2.039791  
1 1 1 5  7  21 o 3.4412 1.0043 6.7877   10.942  8.0157    17.733  6.0328    13.904  3.6333 1.5012 3.2490 1.3344 0.3842199      2.008583  
1 1 1 5  7  22 o 4.6105 1.0889 23.726   11.757  21.622    18.299  25.205    15.343  4.5025 1.6078 4.7186 1.4688 -0.2160211     2.177743  
1 1 1 5  7  23 o 9.2139 0.8182 91.795   14.916  88.435    22.501  94.428    19.922  9.0086 1.2488 9.4192 1.0575 -0.4105806     1.636445  
1 1 1 5  7  24 o 8.3650 0.9658 81.441   14.892  53.875    22.012  104.708   20.223  6.7613 1.6437 9.9686 1.0143 -3.207301      1.931509  
1 1 1 5  7  25 o 5.1843 1.0971 27.546   13.693  52.118    20.686  8.3832    18.268  6.6655 1.5765 3.7031 1.5263 2.962346       2.194270  
1 1 1 5  7  26 o 2.6532 0.8433 -19.0112 11.659  -66.6393  19.528  7.3705    14.534  1.9317 0.9800 3.3746 1.3726 -1.442868      1.686586  
1 1 1 5  7  27 o 3.2228 0.9704 -5.5090  13.003  -34.6580  19.887  16.260    17.186  2.4124 1.1857 4.0331 1.5365 -1.620719      1.940807  
1 1 1 5  7  28 o 4.1286 1.1764 14.728   15.128  27.982    23.229  4.9652    19.936  4.7503 1.7919 3.5068 1.5246 1.243484       2.352756  
1 1 1 5  7  29 o 6.2270 1.2906 56.060   17.121  61.943    25.032  50.888    23.469  6.5365 1.8380 5.9174 1.8125 0.6191468      2.581296  
1 1 1 5  7  30 o 5.5389 0.9506 47.015   12.354  15.294    21.486  62.680    15.099  3.7220 1.6004 7.3558 1.0263 -3.633764      1.901187  
1 1 1 5  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  8  0  o 45.158 0.8236 2052.51  74.276  2039.47   104.973 2065.59   105.112 45.014 1.1678 45.303 1.1618 -0.000000      0.000000  
1 1 1 5  8  1  o 34.149 0.5228 1170.33  35.704  1161.87   50.462  1178.82   50.525  34.025 0.7415 34.273 0.7371 -0.2480278     1.045557  
1 1 1 5  8  2  o 6.5602 0.6046 43.319   7.9159  44.858    10.976  41.650    11.427  6.6830 0.8212 6.4373 0.8876 0.2457886      1.209186  
1 1 1 5  8  3  o 33.955 0.5214 1157.29  35.409  1148.61   50.091  1165.95   50.061  33.828 0.7404 34.083 0.7344 -0.2553291     1.042829  
1 1 1 5  8  4  o 29.280 0.5022 860.397  29.411  859.992   41.631  860.801   41.556  29.273 0.7111 29.287 0.7095 -0.1400185E-01 1.004490  
1 1 1 5  8  5  o 30.549 0.5079 936.396  31.033  939.830   43.877  932.959   43.898  30.605 0.7168 30.493 0.7198 0.1125031      1.015850  
1 1 1 5  8  6  o 15.588 0.4803 243.652  14.972  240.317   21.150  247.002   21.197  15.481 0.6831 15.695 0.6753 -0.2143517     0.9605249 
1 1 1 5  8  7  o 4.3563 0.7865 19.856   6.8846  21.202    9.7180  18.499    9.7547  4.4992 1.0912 4.2134 1.1330 0.2857451      1.573018  
1 1 1 5  8  8  o 5.3643 0.6971 29.501   7.3098  32.278    10.390  26.780    10.286  5.6651 0.9170 5.0636 1.0501 0.6014671      1.394162  
1 1 1 5  8  9  f 2.9571 0.7789 6.6613   6.1897  5.3085    8.7432  8.0204    8.7639  2.8323 1.0918 3.0818 1.1113 -0.2494791     1.557877  
1 1 1 5  8  10 o 24.654 0.5968 613.354  27.852  616.318   34.300  607.616   47.718  24.769 0.6924 24.539 0.9723 0.2300701      1.193656  
1 1 1 5  8  11 o 14.731 0.4945 218.114  14.558  228.101   20.673  208.289   20.505  15.067 0.6861 14.395 0.7122 0.6718807      0.9889175 
1 1 1 5  8  12 o 15.923 0.4916 255.512  15.648  264.298   22.074  246.637   22.185  16.200 0.6813 15.645 0.7090 0.5551710      0.9832900 
1 1 1 5  8  13 f 7.7850 0.5938 61.469   9.2321  65.419    13.102  57.573    13.011  8.0365 0.8152 7.5334 0.8636 0.5031810      1.187517  
1 1 1 5  8  14 f 7.3323 0.5647 54.122   8.2288  47.410    10.981  62.719    12.427  6.8190 0.8052 7.8455 0.7920 -1.026509      1.129413  
1 1 1 5  8  15 o 13.790 0.6750 195.362  16.561  195.647   19.444  194.607   31.606  13.890 0.7000 13.690 1.1544 0.1997681      1.349994  
1 1 1 5  8  16 o 2.6824 0.7770 3.7099   6.3974  8.1419    6.7819  -32.0860  19.274  2.8942 0.9821 2.4707 1.2043 0.4234643      1.553975  
1 1 1 5  8  17 o 9.8703 0.7465 92.511   12.019  86.028    13.356  120.114   27.559  9.1688 0.7283 10.572 1.3034 -1.403094      1.493084  
1 1 1 5  8  18 o 5.8584 0.9703 46.561   9.9782  52.556    11.028  19.491    23.432  7.1435 0.7719 4.5732 1.7804 2.570280       1.940572  
1 1 1 5  8  19 o 13.635 0.7391 202.796  16.312  207.839   18.502  185.198   34.562  14.258 0.6488 13.012 1.3281 1.246022       1.478112  
1 1 1 5  8  20 o 7.6435 0.9297 59.186   10.732  55.750    11.798  75.671    25.840  7.3271 0.8051 7.9600 1.6761 -0.6328926     1.859438  
1 1 1 5  8  21 o 7.7487 1.1754 72.859   17.082  78.975    20.984  60.846    29.411  8.5490 1.2273 6.9485 2.0051 1.600472       2.350881  
1 1 1 5  8  22 o 4.2744 1.0330 19.301   11.837  1.5140    19.489  29.700    14.901  3.4627 1.5064 5.0861 1.4139 -1.623434      2.065982  
1 1 1 5  8  23 o 6.6944 1.0500 50.300   13.581  60.590    21.107  43.031    17.740  7.2700 1.5014 6.1188 1.4684 1.151129       2.100069  
1 1 1 5  8  24 o 9.0220 0.8710 87.476   15.614  90.333    23.580  85.245    20.836  9.1194 1.2929 8.9246 1.1674 0.1948786      1.741904  
1 1 1 5  8  25 o 3.6266 1.0612 -0.4379  13.223  22.124    21.282  -14.6235  16.875  4.6093 1.7199 2.6440 1.2437 1.965392       2.122481  
1 1 1 5  8  26 o 7.9824 1.0237 72.443   15.890  87.324    23.585  60.074    21.502  8.8505 1.3324 7.1143 1.5546 1.736182       2.047487  
1 1 1 5  8  27 o 3.3372 1.0550 -4.9633  14.120  9.9226    23.069  -13.8804  17.855  3.9572 1.6785 2.7172 1.2785 1.239974       2.109993  
1 1 1 5  8  28 o 3.5727 1.0965 4.6504   14.746  18.594    22.419  -5.9814   19.577  4.1332 1.6957 3.0122 1.3906 1.120976       2.192981  
1 1 1 5  8  29 o 3.6993 1.1324 11.363   15.176  14.592    23.811  9.1530    19.696  3.8832 1.6772 3.5154 1.5219 0.3677230      2.264724  
1 1 1 5  8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  8  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  9  0  o 53.561 0.8996 2890.11  96.244  2915.70   136.411 2864.74   135.809 53.799 1.2694 53.324 1.2751 -0.000000      0.000000  
1 1 1 5  9  1  o 44.634 0.5792 2001.49  51.700  1964.80   72.878  2038.67   73.355  44.221 0.8240 45.047 0.8142 -0.8261986     1.158430  
1 1 1 5  9  2  o 37.108 0.5380 1382.41  39.927  1405.10   56.554  1359.86   56.376  37.412 0.7558 36.803 0.7659 0.6091423      1.076064  
1 1 1 5  9  3  o 29.522 0.5042 874.345  29.770  870.590   42.055  878.117   42.148  29.458 0.7138 29.585 0.7123 -0.1272602     1.008426  
1 1 1 5  9  4  o 12.470 0.4932 156.118  12.284  165.463   17.348  146.721   17.395  12.846 0.6752 12.094 0.7192 0.7515984      0.9864674 
1 1 1 5  9  5  o 36.121 0.5342 1309.05  38.585  1335.36   54.640  1282.88   54.495  36.484 0.7488 35.757 0.7620 0.7260551      1.068369  
1 1 1 5  9  6  o 39.034 0.6734 1537.97  49.599  1516.42   85.426  1548.93   60.918  38.788 1.1012 39.280 0.7754 -0.4911995     1.346820  
1 1 1 5  9  7  o 32.763 0.5205 1077.43  34.103  1069.33   48.101  1085.62   48.358  32.639 0.7369 32.887 0.7352 -0.2479210     1.040921  
1 1 1 5  9  8  o 21.722 0.6101 477.771  24.667  466.300   43.497  483.210   29.949  21.504 1.0114 21.940 0.6825 -0.4361725     1.220126  
1 1 1 5  9  9  o 11.750 0.5150 138.831  12.096  143.691   17.077  133.936   17.136  11.958 0.7141 11.543 0.7423 0.4153156      1.029974  
1 1 1 5  9  10 o 5.6228 0.6875 32.270   7.5606  35.165    11.080  29.748    10.342  5.9037 0.9384 5.3419 1.0049 0.5618067      1.374949  
1 1 1 5  9  11 o 4.1274 1.0153 13.748   8.8945  11.545    10.075  21.531    18.935  3.5028 1.1970 4.7520 1.6403 -1.249247      2.030617  
1 1 1 5  9  12 o 12.020 0.5203 146.022  12.503  150.331   17.622  141.655   17.741  12.200 0.7222 11.839 0.7493 0.3617249      1.040667  
1 1 1 5  9  13 o 8.2906 0.5854 69.936   9.7026  70.392    13.555  69.456    13.894  8.3206 0.8146 8.2606 0.8410 0.5999088E-01  1.170792  
1 1 1 5  9  14 o 4.7605 0.7517 24.179   6.9379  22.848    9.2501  25.892    10.490  4.6168 1.0282 4.9042 1.0969 -0.2874169     1.503447  
1 1 1 5  9  15 o 13.400 0.6640 182.231  14.904  179.383   16.919  192.100   31.491  13.290 0.6365 13.511 1.1654 -0.2208261     1.327908  
1 1 1 5  9  16 o 3.4932 0.9554 6.4970   6.7948  4.6657    7.2726  19.076    19.060  2.5653 0.9938 4.4210 1.6320 -1.855759      1.910738  
1 1 1 5  9  17 o 12.884 0.7442 178.878  17.310  186.219   20.772  162.194   31.313  13.469 0.7711 12.299 1.2730 1.169833       1.488329  
1 1 1 5  9  18 o 4.8443 0.8982 32.022   8.9466  37.831    9.7273  0.1293    22.792  6.0441 0.8047 3.6446 1.6061 2.399578       1.796373  
1 1 1 5  9  19 o 14.843 0.6941 234.246  17.179  235.733   19.601  229.318   35.674  15.170 0.6460 14.517 1.2287 0.6529570      1.388185  
1 1 1 5  9  20 o 5.9058 1.0555 44.752   10.283  47.409    11.075  28.130    27.700  6.7516 0.8202 5.0599 1.9452 1.691681       2.111024  
1 1 1 5  9  21 o 3.7028 0.9397 14.460   7.2414  16.660    7.5368  -11.9611  26.117  3.9117 0.9685 3.4939 1.6106 0.4177246      1.879409  
1 1 1 5  9  22 o 3.7897 1.1226 3.9517   8.4085  1.7796    8.7789  28.074    29.256  2.4814 1.0430 5.0979 1.9881 -2.616558      2.245113  
1 1 1 5  9  23 o 9.8508 1.0379 100.958  19.590  86.205    23.899  131.177   34.204  8.8970 1.3431 10.805 1.5828 -1.907550      2.075875  
1 1 1 5  9  24 o 4.3245 1.1240 18.802   13.404  4.8689    22.550  26.415    16.668  3.8264 1.6422 4.8226 1.5350 -0.9961603     2.247910  
1 1 1 5  9  25 o 12.214 0.7885 162.042  18.795  132.036   27.715  187.594   25.575  11.046 1.2545 13.382 0.9556 -2.335228      1.576989  
1 1 1 5  9  26 o 11.642 0.8054 148.615  18.461  137.521   27.916  157.236   24.610  11.156 1.2512 12.128 1.0146 -0.9718609     1.610894  
1 1 1 5  9  27 o 4.7139 1.2445 24.240   15.853  38.838    24.896  14.286    20.559  5.4253 1.8804 4.0025 1.6308 1.422795       2.489064  
1 1 1 5  9  28 o 7.4439 1.2510 77.206   18.271  73.229    28.026  80.146    24.097  7.0417 1.9318 7.8462 1.5900 -0.8045731     2.501977  
1 1 1 5  9  29 o 5.8272 1.2895 54.343   17.324  43.942    27.784  60.959    22.160  5.1189 1.9528 6.5355 1.6846 -1.416599      2.579051  
1 1 1 5  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  10 0  o 36.753 0.7629 1358.70  55.963  1389.36   79.431  1328.48   78.858  37.167 1.0706 36.338 1.0873 -0.000000      0.000000  
1 1 1 5  10 1  o 21.904 0.4865 481.104  21.315  479.923   30.105  482.292   30.183  21.877 0.6880 21.931 0.6881 -0.5391312E-01 0.9730891 
1 1 1 5  10 2  o 31.950 0.5163 1023.94  32.992  1030.52   46.589  1017.31   46.728  32.053 0.7267 31.846 0.7336 0.2070541      1.032663  
1 1 1 5  10 3  o 5.0679 0.7367 27.173   7.3303  17.869    10.567  35.805    10.177  4.1649 1.2019 5.9709 0.8523 -1.806001      1.473375  
1 1 1 5  10 4  o 24.268 0.5971 590.532  27.414  595.125   47.236  588.200   33.662  24.321 0.9711 24.215 0.6951 0.1059628      1.194222  
1 1 1 5  10 5  o 4.0127 0.8204 16.481   7.0305  19.858    10.020  13.206    9.8669  4.3574 1.1376 3.6681 1.1825 0.6893113      1.640815  
1 1 1 5  10 6  o 34.388 0.5286 1187.32  36.352  1162.90   51.177  1212.20   51.645  34.030 0.7519 34.745 0.7432 -0.7155685     1.057230  
1 1 1 5  10 7  o 13.980 0.4966 196.312  13.881  193.010   19.720  199.555   19.542  13.863 0.7113 14.097 0.6931 -0.2346153     0.9931366 
1 1 1 5  10 8  o 22.030 0.4938 487.711  21.750  501.188   30.730  474.182   30.789  22.336 0.6879 21.723 0.7087 0.6131477      0.9876189 
1 1 1 5  10 9  o 11.514 0.5299 133.006  12.155  150.224   17.640  117.440   16.772  12.224 0.7215 10.804 0.7762 1.420361       1.059755  
1 1 1 5  10 10 o 21.939 0.5022 484.783  22.018  504.151   31.059  465.217   31.217  22.383 0.6938 21.495 0.7262 0.8880558      1.004349  
1 1 1 5  10 11 o 13.179 0.5279 175.637  13.902  183.668   19.615  167.531   19.706  13.486 0.7272 12.873 0.7654 0.6128454      1.055801  
1 1 1 5  10 12 o 12.221 0.5453 151.040  13.313  144.134   18.332  158.747   19.366  11.926 0.7685 12.515 0.7737 -0.5888681     1.090534  
1 1 1 5  10 13 o 20.420 0.5062 424.075  20.667  420.357   28.860  427.989   29.609  20.331 0.7097 20.509 0.7218 -0.1778774     1.012307  
1 1 1 5  10 14 o 15.965 0.6350 249.414  17.163  239.234   19.451  285.205   36.474  15.367 0.6329 16.563 1.1011 -1.196094      1.270000  
1 1 1 5  10 15 o 5.6780 0.9302 45.620   10.089  54.697    11.214  7.0691    23.111  7.3152 0.7665 4.0409 1.6951 3.274340       1.860359  
1 1 1 5  10 16 o 13.501 0.7046 194.331  15.610  197.864   17.742  182.226   32.841  13.944 0.6362 13.058 1.2575 0.8866100      1.409289  
1 1 1 5  10 17 o 4.1960 1.0776 14.570   9.1078  12.535    9.9090  25.650    23.121  3.4988 1.1871 4.8932 1.7989 -1.394421      2.155270  
1 1 1 5  10 18 o 18.063 0.6987 364.310  20.688  383.868   23.770  303.203   42.015  19.400 0.6126 16.726 1.2560 2.673964       1.397416  
1 1 1 5  10 19 o 2.7365 0.8689 0.8109   7.3060  3.0329    7.7413  -17.2950  22.098  2.4542 1.0004 3.0188 1.4210 -0.5646014     1.737868  
1 1 1 5  10 20 o 17.289 0.7058 321.208  20.080  326.591   22.854  302.984   42.048  17.875 0.6393 16.704 1.2586 1.171091       1.411685  
1 1 1 5  10 21 o 6.7110 1.0598 30.295   10.754  20.218    11.517  98.905    30.051  4.2631 1.2618 9.1590 1.7032 -4.895885      2.119695  
1 1 1 5  10 22 o 17.750 0.7422 343.040  21.490  350.829   24.432  316.409   45.176  18.512 0.6599 16.988 1.3297 1.524137       1.484409  
1 1 1 5  10 23 o 2.9051 0.9130 3.7661   6.4597  5.6741    6.6171  -34.9242  29.797  2.5874 0.9603 3.2227 1.5531 -0.6352103     1.826037  
1 1 1 5  10 24 o 11.215 0.9634 131.131  16.398  127.025   18.007  151.076   39.687  11.068 0.8135 11.362 1.7466 -0.2936888     1.926706  
1 1 1 5  10 25 o 4.3463 1.2936 13.130   19.003  18.077    23.662  4.1414    31.895  4.4322 1.7695 4.2604 1.8875 0.1718006      2.587218  
1 1 1 5  10 26 o 9.9121 0.9517 112.530  18.230  100.338   28.507  120.965   23.711  9.2816 1.5357 10.543 1.1245 -1.261075      1.903390  
1 1 1 5  10 27 o 8.5746 1.0584 88.823   17.463  85.512    26.566  91.342    23.173  8.2252 1.6719 8.9239 1.2984 -0.6986818     2.116858  
1 1 1 5  10 28 o 5.8374 1.2615 51.032   17.202  34.189    27.086  62.417    22.270  4.8585 1.9078 6.8163 1.6510 -1.957808      2.523002  
1 1 1 5  10 29 o 2.9033 0.9824 -12.0868 15.930  -18.1615  25.983  -8.4277   20.165  2.9552 1.4306 2.8514 1.3469 0.1038237      1.964872  
1 1 1 5  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  11 0  o 26.038 0.7077 683.361  36.724  669.738   52.061  696.853   51.811  25.776 1.0135 26.300 0.9882 -0.000000      0.000000  
1 1 1 5  11 1  o 17.768 0.4853 316.699  17.246  318.510   24.451  314.907   24.328  17.818 0.6861 17.717 0.6866 0.1010876      0.9706258 
1 1 1 5  11 2  o 20.211 0.4876 409.886  19.704  414.020   27.678  405.637   28.058  20.315 0.6812 20.107 0.6977 0.2083054      0.9751270 
1 1 1 5  11 3  o 13.511 0.5092 183.227  13.755  177.061   19.377  189.490   19.528  13.281 0.7295 13.741 0.7106 -0.4595737     1.018351  
1 1 1 5  11 4  o 30.568 0.5135 938.169  31.392  943.412   44.301  932.881   44.489  30.655 0.7226 30.482 0.7298 0.1727676      1.026969  
1 1 1 5  11 5  o 14.320 0.5020 205.930  14.376  203.393   20.228  208.520   20.436  14.231 0.7107 14.410 0.7091 -0.1783743     1.003945  
1 1 1 5  11 6  o 43.380 0.5787 1893.51  50.202  1910.77   71.035  1876.28   70.959  43.578 0.8150 43.181 0.8216 0.3972168      1.157302  
1 1 1 5  11 7  o 12.219 0.5285 150.187  12.906  147.739   18.492  152.513   18.022  12.120 0.7629 12.317 0.7316 -0.1970978     1.056964  
1 1 1 5  11 8  o 14.364 0.5111 207.463  14.681  209.176   20.658  205.715   20.869  14.424 0.7161 14.303 0.7295 0.1212673      1.022232  
1 1 1 5  11 9  o 9.5255 0.5776 91.918   10.959  99.825    15.333  83.663    15.668  9.9506 0.7705 9.1004 0.8608 0.8502254      1.155279  
1 1 1 5  11 10 o 4.9424 0.8303 26.131   8.1383  21.440    11.570  30.724    11.449  4.4957 1.2445 5.3890 1.0995 -0.8932467     1.660612  
1 1 1 5  11 11 o 3.2963 0.8475 9.3782   7.2302  8.8142    10.398  9.9062    10.060  3.2613 1.2051 3.3313 1.1919 -0.7006788E-01 1.694914  
1 1 1 5  11 12 o 12.357 0.5407 155.725  13.355  159.073   18.752  152.278   19.025  12.496 0.7503 12.217 0.7786 0.2784204      1.081317  
1 1 1 5  11 13 o 11.793 0.5593 141.274  13.174  133.502   18.094  150.042   19.218  11.449 0.7902 12.137 0.7917 -0.6881399     1.118520  
1 1 1 5  11 14 o 16.558 0.6336 275.649  18.124  269.195   20.818  295.857   36.835  16.284 0.6392 16.831 1.0943 -0.5466805     1.267277  
1 1 1 5  11 15 o 4.1183 1.0689 14.891   9.1811  14.252    9.9843  18.389    23.364  3.6842 1.1897 4.5524 1.7763 -0.8681774     2.137890  
1 1 1 5  11 16 o 4.1740 0.8141 21.925   9.2240  32.012    10.026  -33.6404  23.532  5.5534 0.9027 2.7946 1.3549 2.758877       1.628105  
1 1 1 5  11 17 o 4.3333 0.9784 22.841   9.8946  28.166    10.884  -2.5085   23.747  5.0527 1.1076 3.6140 1.6132 1.438671       1.956877  
1 1 1 5  11 18 o 7.8689 0.8797 46.846   11.331  30.024    12.525  122.676   26.591  5.1554 1.2316 10.582 1.2564 -5.427007      1.759346  
1 1 1 5  11 19 o 6.4258 1.0265 41.863   10.600  38.485    11.696  57.407    25.087  6.0377 0.9686 6.8138 1.8102 -0.7761135     2.053005  
1 1 1 5  11 20 o 9.9497 1.0480 121.625  14.527  127.900   16.114  94.387    33.574  11.157 0.7222 8.7428 1.9676 2.413748       2.095935  
1 1 1 5  11 21 o 6.7983 1.1065 40.659   11.864  32.433    12.959  83.224    29.479  5.3665 1.2333 8.2301 1.8375 -2.863590      2.212974  
1 1 1 5  11 22 o 19.778 0.6995 404.202  23.452  399.185   26.801  420.598   48.448  19.759 0.6782 19.797 1.2236 -0.3812981E-01 1.399015  
1 1 1 5  11 23 o 4.5643 0.9588 27.183   9.9585  33.013    10.434  -32.3725  33.351  5.6210 0.9282 3.5076 1.6781 2.113407       1.917653  
1 1 1 5  11 24 o 4.0478 1.0380 17.780   9.4611  21.373    9.8392  -26.2855  34.457  4.3998 1.1164 3.6957 1.7502 0.7040248      2.075906  
1 1 1 5  11 25 o 12.034 1.1939 186.576  18.540  194.531   20.279  146.071   45.758  13.703 0.7400 10.365 2.2702 3.338091       2.387730  
1 1 1 5  11 26 o 6.9635 1.5088 63.139   22.234  48.567    27.339  91.605    38.210  6.0062 1.9705 7.9208 2.2854 -1.914690      3.017588  
1 1 1 5  11 27 o 6.6043 1.4850 71.584   22.319  74.520    27.031  65.294    39.565  7.2348 1.8583 5.9737 2.3169 1.261134       2.970077  
1 1 1 5  11 28 o 5.5124 1.2553 47.183   17.792  23.223    27.572  64.278    23.290  4.2869 1.8272 6.7379 1.7219 -2.450949      2.510678  
1 1 1 5  11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  11 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  12 0  o 15.138 0.7109 233.109  21.301  226.680   29.978  239.663   30.271  14.922 1.0153 15.354 0.9953 -0.000000      0.000000  
1 1 1 5  12 1  o 14.866 0.6074 218.400  17.089  210.542   20.838  234.535   29.861  14.479 0.7196 15.254 0.9788 -0.7748642     1.214879  
1 1 1 5  12 2  o 22.654 0.4939 515.435  22.371  499.492   31.609  531.435   31.665  22.301 0.7087 23.006 0.6882 -0.7048473     0.9878394 
1 1 1 5  12 3  o 17.981 0.4940 324.932  17.734  348.239   25.185  302.012   24.975  18.623 0.6762 17.338 0.7202 1.284824       0.9879057 
1 1 1 5  12 4  o 9.1246 0.5785 83.679   10.549  88.028    15.217  79.655    14.638  9.3529 0.8135 8.8963 0.8227 0.4565439      1.156977  
1 1 1 5  12 5  o 2.9677 0.8171 4.2191   7.1939  10.167    10.718  -0.6573   9.7049  3.4312 1.2299 2.5043 1.0761 0.9269390      1.634238  
1 1 1 5  12 6  o 12.021 0.5495 145.422  13.210  143.016   18.758  147.789   18.605  11.921 0.7867 12.121 0.7675 -0.1991396     1.099092  
1 1 1 5  12 7  o 11.137 0.5600 125.057  12.458  121.000   17.867  128.895   17.380  10.959 0.8152 11.315 0.7680 -0.3566399     1.120000  
1 1 1 5  12 8  o 4.7107 0.8420 23.995   8.2718  32.551    11.315  14.174    12.123  5.5691 1.0545 3.8523 1.3130 1.716822       1.684069  
1 1 1 5  12 9  o 16.508 0.5143 275.273  16.978  283.458   24.128  267.246   23.896  16.753 0.7201 16.264 0.7346 0.4894104      1.028698  
1 1 1 5  12 10 f 11.629 0.7507 133.196  15.801  126.192   18.519  151.943   30.296  11.146 0.8307 12.112 1.2507 -0.9658289     1.501467  
1 1 1 5  12 11 o 9.5105 0.6197 92.804   11.782  95.133    16.578  90.426    16.746  9.6355 0.8603 9.3856 0.8921 0.2499075      1.239342  
1 1 1 5  12 12 o 25.468 0.5224 659.101  26.602  667.933   37.296  649.955   37.956  25.648 0.7271 25.288 0.7505 0.3600159      1.044899  
1 1 1 5  12 13 o 2.5113 0.7626 -0.9061  7.0655  3.7184    9.9842  -5.5453   10.000  2.7880 1.1363 2.2347 1.0175 0.5532877      1.525231  
1 1 1 5  12 14 o 9.0857 0.9287 97.479   12.941  104.098   14.789  75.846    26.736  10.083 0.7333 8.0882 1.7064 1.994929       1.857333  
1 1 1 5  12 15 o 17.035 0.7018 307.079  19.689  310.612   22.371  294.937   41.475  17.465 0.6405 16.605 1.2489 0.8599148      1.403516  
1 1 1 5  12 16 o 5.3084 1.1062 28.677   10.421  25.988    11.525  40.742    24.408  4.8230 1.1997 5.7938 1.8590 -0.9708138     2.212477  
1 1 1 5  12 17 o 5.7663 1.0187 47.348   11.341  54.512    12.328  7.8967    28.929  7.2411 0.8512 4.2914 1.8511 2.949666       2.037448  
1 1 1 5  12 18 o 7.7964 1.0708 72.215   12.691  73.767    14.097  65.577    29.156  8.4170 0.8374 7.1759 1.9711 1.241097       2.141593  
1 1 1 5  12 19 o 7.3493 1.0951 66.420   12.271  69.130    13.516  53.717    29.266  8.1672 0.8275 6.5314 2.0278 1.635808       2.190166  
1 1 1 5  12 20 o 5.9048 1.1272 36.750   11.098  34.418    12.170  48.258    27.039  5.5896 1.1275 6.2200 1.9521 -0.6303682     2.254372  
1 1 1 5  12 21 o 7.4369 1.0834 58.835   12.522  56.206    13.812  70.963    29.667  7.3242 0.9429 7.5496 1.9508 -0.2254663     2.166741  
1 1 1 5  12 22 o 5.3552 1.2196 31.046   11.789  30.755    12.642  32.989    32.640  5.2482 1.2265 5.4623 2.1083 -0.2140727     2.439123  
1 1 1 5  12 23 o 8.8514 1.1697 115.402  14.900  128.966   16.502  55.567    34.660  11.189 0.7375 6.5142 2.2202 4.674315       2.339475  
1 1 1 5  12 24 o 3.6762 1.1547 2.7389   10.737  1.7288    11.330  11.645    33.643  2.7572 1.1732 4.5952 1.9892 -1.837934      2.309340  
1 1 1 5  12 25 o 7.1080 1.3017 59.500   13.991  58.155    14.905  69.465    40.583  7.3712 1.0110 6.8448 2.3992 0.5263438      2.603501  
1 1 1 5  12 26 o 6.5193 1.3206 46.436   12.752  43.162    13.449  75.597    40.140  6.1779 1.1301 6.8606 2.3871 -0.6827183     2.641111  
1 1 1 5  12 27 o 4.3990 1.2227 21.806   11.360  21.957    11.787  19.841    42.569  4.2454 1.2811 4.5526 2.0829 -0.3072028     2.445379  
1 1 1 5  12 28 o 4.7622 1.4399 38.829   23.501  35.557    28.510  45.766    41.512  4.6673 1.9132 4.8571 2.1525 -0.1898432     2.879874  
1 1 1 5  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  13 0  o 13.228 0.7534 179.249  19.623  177.767   27.265  180.842   28.265  13.174 1.0501 13.281 1.0806 -0.000000      0.000000  
1 1 1 5  13 1  o 4.0910 0.7869 15.803   8.1527  -2.6384   12.009  31.566    11.103  2.6823 1.1743 5.4998 1.0477 -2.817528      1.573742  
1 1 1 5  13 2  o 18.195 0.5060 332.623  18.408  337.406   26.394  328.092   25.687  18.321 0.7203 18.068 0.7109 0.2534447      1.011994  
1 1 1 5  13 3  o 7.1430 0.9236 60.533   11.449  72.498    13.915  35.452    20.146  8.4859 0.8199 5.8001 1.6552 2.685751       1.847104  
1 1 1 5  13 4  o 13.596 0.5321 185.934  14.469  187.151   20.459  184.716   20.466  13.640 0.7499 13.551 0.7552 0.8957767E-01  1.064276  
1 1 1 5  13 5  o 8.3670 0.6312 70.600   10.538  64.352    14.680  77.242    15.137  7.9830 0.9195 8.7509 0.8649 -0.7679186     1.262331  
1 1 1 5  13 6  o 13.553 0.5339 184.930  14.455  178.819   19.887  191.775   21.049  13.318 0.7467 13.789 0.7632 -0.4714527     1.067715  
1 1 1 5  13 7  o 12.421 0.5556 156.191  13.773  167.991   19.504  144.454   19.453  12.894 0.7563 11.947 0.8141 0.9471521      1.111238  
1 1 1 5  13 8  o 5.3418 0.8855 30.620   9.3327  26.186    13.253  34.981    13.144  4.9467 1.3164 5.7370 1.1848 -0.7902699     1.771098  
1 1 1 5  13 9  o 13.476 0.5412 184.620  14.569  192.649   20.421  176.298   20.790  13.782 0.7409 13.171 0.7892 0.6103630      1.082499  
1 1 1 5  13 10 o 5.7959 0.8445 36.328   9.4565  36.017    13.087  36.667    13.680  5.7761 1.1729 5.8157 1.2153 -0.3963375E-01 1.688952  
1 1 1 5  13 11 o 3.2343 0.8624 6.9829   8.0525  13.983    11.323  -0.1796   11.454  3.7537 1.2691 2.7149 1.1679 1.038756       1.724701  
1 1 1 5  13 12 o 13.039 0.5599 173.945  14.584  171.688   20.094  176.458   21.200  12.956 0.7755 13.122 0.8078 -0.1662664     1.119776  
1 1 1 5  13 13 o 17.716 0.6717 325.558  20.060  325.018   22.920  327.324   41.467  17.868 0.6414 17.564 1.1805 0.3043118      1.343485  
1 1 1 5  13 14 o 7.6514 0.9918 53.963   12.108  47.024    13.381  85.290    28.433  6.7127 0.9967 8.5900 1.7151 -1.877288      1.983652  
1 1 1 5  13 15 o 11.650 0.8529 153.947  15.478  159.809   17.428  132.059   33.676  12.482 0.6981 10.819 1.5563 1.662632       1.705747  
1 1 1 5  13 16 o 4.2417 0.9831 21.338   9.8923  26.577    10.851  -4.4566   24.076  4.9036 1.1296 3.5799 1.6092 1.323708       1.966134  
1 1 1 5  13 17 o 12.125 0.8124 148.473  15.687  141.973   17.405  176.602   36.208  11.723 0.7424 12.527 1.4452 -0.8037806     1.624758  
1 1 1 5  13 18 o 4.3413 1.0428 21.761   10.267  25.338    11.194  2.7945    25.777  4.7604 1.1813 3.9223 1.7188 0.8380568      2.085591  
1 1 1 5  13 19 o 6.3922 1.1622 43.101   11.709  41.228    12.650  54.307    30.943  6.2524 1.0116 6.5319 2.0928 -0.2794480     2.324455  
1 1 1 5  13 20 o 3.9093 1.0367 15.510   10.176  19.272    10.999  -6.8383   26.810  4.1581 1.2337 3.6604 1.6663 0.4976811      2.073318  
1 1 1 5  13 21 o 13.686 0.7264 192.200  19.882  192.200   19.882  0.0000    0.0000  13.686 0.7264 ?      ?      ?              ?         
1 1 1 5  13 22 o 8.2104 1.1027 71.816   13.435  69.076    14.710  85.601    32.993  8.1390 0.9037 8.2819 2.0118 -0.1429434     2.205460  
1 1 1 5  13 23 o 10.010 1.0870 119.383  15.527  123.183   17.220  102.851   35.917  10.923 0.7882 9.0971 2.0261 1.826265       2.173995  
1 1 1 5  13 24 o 3.8825 1.1527 10.921   10.428  11.695    10.926  3.0007    34.947  3.4351 1.2405 4.3299 1.9431 -0.8947961     2.305380  
1 1 1 5  13 25 o 4.6835 1.0784 29.181   12.037  35.086    12.756  -18.8145  36.367  5.5563 1.1841 3.8107 1.8027 1.745659       2.156771  
1 1 1 5  13 26 o 4.1927 1.2590 9.9560   11.356  6.1178    11.926  47.266    37.182  2.9854 1.2321 5.4000 2.1959 -2.414546      2.517937  
1 1 1 5  13 27 o 3.8980 1.1823 14.480   11.174  14.843    11.564  9.3792    43.355  3.5704 1.2778 4.2256 1.9895 -0.6552231     2.364522  
1 1 1 5  13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  14 0  f 18.949 0.7288 364.264  27.358  329.787   38.102  400.952   39.305  18.006 1.0666 19.892 0.9936 -0.000000      0.000000  
1 1 1 5  14 1  o 19.963 0.5131 401.058  20.484  400.772   28.715  401.354   29.229  19.957 0.7194 19.969 0.7319 -0.1231003E-01 1.026259  
1 1 1 5  14 2  o 17.708 0.5173 315.826  18.315  313.560   26.205  317.989   25.608  17.644 0.7426 17.772 0.7205 -0.1279221     1.034662  
1 1 1 5  14 3  o 15.476 0.5187 241.379  16.051  242.400   22.543  240.329   22.860  15.510 0.7267 15.441 0.7402 0.6860161E-01  1.037327  
1 1 1 5  14 4  o 12.145 0.5560 148.969  13.502  154.116   19.274  144.008   18.921  12.352 0.7802 11.938 0.7925 0.4138231      1.112067  
1 1 1 5  14 5  o 5.1761 0.9012 28.496   9.5485  18.363    13.288  39.315    13.730  4.2549 1.3723 6.0974 1.1684 -1.842537      1.802344  
1 1 1 5  14 6  o 10.327 0.6060 108.252  12.479  109.321   17.043  107.017   18.321  10.388 0.8203 10.266 0.8923 0.1221552      1.212099  
1 1 1 5  14 7  o 2.8675 0.8255 3.1620   7.5685  -0.4895   10.800  6.6859    10.610  2.6316 1.1331 3.1033 1.2008 -0.4716280     1.651041  
1 1 1 5  14 8  o 10.159 0.6177 105.731  12.541  107.908   17.513  103.441   17.965  10.272 0.8525 10.046 0.8942 0.2260647      1.235443  
1 1 1 5  14 9  o 11.015 0.6065 124.519  13.315  134.332   18.679  114.380   18.986  11.470 0.8143 10.560 0.8990 0.9098902      1.212940  
1 1 1 5  14 10 o 3.9467 0.9284 15.689   8.6045  18.602    12.516  13.079    11.849  4.2012 1.3294 3.6922 1.2962 0.5089178      1.856759  
1 1 1 5  14 11 o 8.5051 0.6744 75.002   11.426  81.902    16.080  67.966    16.238  8.9161 0.9017 8.0941 1.0031 0.8220539      1.348821  
1 1 1 5  14 12 o 17.574 0.5428 317.836  19.014  336.825   26.439  297.493   27.365  18.141 0.7287 17.006 0.8046 1.134726       1.085516  
1 1 1 5  14 13 o 10.821 0.7745 100.326  14.317  82.273    15.991  173.284   32.145  8.9148 0.8969 12.727 1.2629 -3.811994      1.548972  
1 1 1 5  14 14 o 3.8417 1.0457 13.739   10.502  17.750    11.416  -8.3262   26.778  4.0352 1.2688 3.6481 1.6625 0.3870914      2.091372  
1 1 1 5  14 15 o 12.389 0.8483 174.096  16.530  181.016   18.678  149.089   35.505  13.280 0.7033 11.498 1.5439 1.781037       1.696521  
1 1 1 5  14 16 o 5.5200 1.1701 30.380   11.730  25.390    13.074  50.963    26.553  4.7111 1.3296 6.3290 1.9257 -1.617880      2.340143  
1 1 1 5  14 17 o 6.0233 1.1770 32.467   11.653  25.884    12.705  67.359    29.251  4.7708 1.2973 7.2759 1.9643 -2.505177      2.354030  
1 1 1 5  14 18 o 10.707 0.9757 137.128  15.575  145.273   17.645  108.388   33.146  11.881 0.7425 9.5327 1.8046 2.348565       1.951408  
1 1 1 5  14 19 o 5.4632 1.1996 33.288   11.852  32.763    12.841  36.311    30.801  5.4035 1.2174 5.5228 2.0674 -0.1193247     2.399220  
1 1 1 5  14 20 o 11.078 0.8368 118.131  15.608  107.820   17.521  157.776   34.355  10.197 0.8591 11.959 1.4363 -1.762159      1.673631  
1 1 1 5  14 21 o 9.8451 1.1509 129.417  15.699  140.591   17.472  82.595    35.765  11.690 0.7473 8.0005 2.1771 3.689107       2.301802  
1 1 1 5  14 22 o 8.5995 1.1182 77.567   14.424  73.284    15.824  98.607    35.072  8.3534 0.9472 8.8456 2.0260 -0.4921608     2.236460  
1 1 1 5  14 23 o 7.1178 1.2033 50.009   13.124  44.278    14.236  82.453    33.870  6.3165 1.1700 7.9190 2.1031 -1.602587      2.406591  
1 1 1 5  14 24 o 8.3780 1.2576 103.909  16.045  112.301   17.502  59.703    40.169  10.344 0.8460 6.4117 2.3687 3.932720       2.515207  
1 1 1 5  14 25 o 7.4114 1.2824 63.012   14.551  59.095    15.708  86.701    38.631  7.3432 1.0695 7.4796 2.3311 -0.1364102     2.564719  
1 1 1 5  14 26 o 3.8974 1.1980 12.585   12.851  12.702    13.617  11.629    38.886  3.5045 1.3592 4.2902 1.9731 -0.7857807     2.395983  
1 1 1 5  14 27 f 6.6724 1.1422 80.235   16.006  88.596    17.283  29.858    42.424  8.8488 0.9766 4.4959 2.0652 4.352915       2.284490  
1 1 1 5  14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  15 0  o 13.587 0.7934 190.393  21.209  182.408   29.657  198.751   30.342  13.284 1.1353 13.889 1.1086 -0.000000      0.000000  
1 1 1 5  15 1  o 3.0064 0.8953 1.5779   9.1755  2.6605    12.563  0.3400    13.433  3.0278 1.2583 2.9849 1.2739 0.4283428E-01  1.790589  
1 1 1 5  15 2  o 7.3406 0.7705 56.251   10.864  67.731    15.457  45.043    15.273  8.1595 0.9472 6.5217 1.2156 1.637707       1.541066  
1 1 1 5  15 3  o 16.407 0.5329 272.366  17.476  278.619   24.443  265.829   24.995  16.604 0.7360 16.211 0.7709 0.3938141      1.065887  
1 1 1 5  15 4  o 6.6580 0.7850 46.228   10.163  40.609    14.302  51.962    14.446  6.1831 1.1998 7.1329 1.0126 -0.9498849     1.569998  
1 1 1 5  15 5  o 15.144 0.5441 232.785  16.458  216.822   23.101  249.236   23.452  14.611 0.7905 15.678 0.7479 -1.066806      1.088282  
1 1 1 5  15 6  o 3.1054 0.9239 2.7482   9.6288  -21.0768  21.214  8.9296    10.806  2.9300 1.3832 3.2807 1.2253 -0.3506732     1.847857  
1 1 1 5  15 7  o 9.6135 0.6349 94.850   12.202  93.818    16.975  95.953    17.550  9.5623 0.8876 9.6648 0.9079 -0.1025000     1.269737  
1 1 1 5  15 8  o 4.5022 0.9410 21.580   9.0477  19.677    12.275  23.843    13.388  4.3058 1.3092 4.6987 1.3520 -0.3928485     1.881932  
1 1 1 5  15 9  o 9.9808 0.8981 102.810  15.423  99.959    17.695  111.825   31.465  9.8464 0.8985 10.115 1.5554 -0.2687445     1.796250  
1 1 1 5  15 10 o 6.9500 0.7631 50.332   10.599  52.909    15.276  47.939    14.718  7.1232 1.0723 6.7768 1.0859 0.3463917      1.526116  
1 1 1 5  15 11 o 10.953 0.6251 124.094  13.686  118.913   19.113  129.548   19.608  10.716 0.8918 11.191 0.8760 -0.4756842     1.250103  
1 1 1 5  15 12 o 8.3793 0.6550 72.813   10.964  71.551    15.099  74.219    15.946  8.3084 0.9087 8.4502 0.9435 -0.1418438     1.309924  
1 1 1 5  15 13 o 10.138 0.9967 117.602  15.280  120.188   17.180  107.811   33.427  10.785 0.7965 9.4913 1.8273 1.293674       1.993310  
1 1 1 5  15 14 f 5.4836 1.1649 33.635   12.110  32.780    13.582  36.949    26.748  5.3969 1.2780 5.5704 1.9480 -0.1735559     2.329854  
1 1 1 5  15 15 o 6.6806 1.0875 63.757   12.893  72.101    14.294  27.339    29.862  8.3053 0.8605 5.0560 1.9975 3.249275       2.174939  
1 1 1 5  15 16 o 5.2458 1.1693 28.346   11.497  25.234    12.771  41.653    26.406  4.7083 1.3089 5.7834 1.9381 -1.075070      2.338693  
1 1 1 5  15 17 o 6.4325 1.0841 59.626   13.216  69.107    14.588  16.241    31.207  8.1431 0.8957 4.7219 1.9745 3.421272       2.168209  
1 1 1 5  15 18 o 6.9217 1.1380 62.826   13.564  68.234    15.150  40.972    30.454  8.0638 0.9394 5.7797 2.0731 2.284083       2.275958  
1 1 1 5  15 19 o 8.0925 1.0852 66.373   14.039  60.482    15.617  91.193    32.054  7.5620 1.0326 8.6230 1.9091 -1.061007      2.170408  
1 1 1 5  15 20 o 8.8726 1.1699 109.064  15.244  120.409   17.010  62.764    34.363  10.799 0.7876 6.9462 2.2033 3.852804       2.339809  
1 1 1 5  15 21 o 10.258 1.0654 121.688  16.142  123.729   18.006  113.338   36.426  10.924 0.8241 9.5917 1.9649 1.332713       2.130734  
1 1 1 5  15 22 o 5.6001 1.3487 25.702   13.392  19.984    14.378  63.151    36.799  4.2859 1.4301 6.9143 2.2870 -2.628398      2.697353  
1 1 1 5  15 23 o 5.8217 1.2105 43.882   13.544  46.465    14.750  29.992    34.209  6.4435 1.1883 5.2000 2.1093 1.243481       2.421018  
1 1 1 5  15 24 o 13.760 0.9041 204.811  19.571  199.761   21.778  226.012   44.619  13.809 0.7885 13.711 1.6272 0.9881687E-01  1.808149  
1 1 1 5  15 25 o 5.6684 1.2630 44.486   13.673  44.550    14.574  44.014    39.500  6.1171 1.2338 5.2197 2.2042 0.8973742      2.526052  
1 1 1 5  15 26 o 5.7182 1.3279 46.859   14.861  45.294    15.882  57.871    42.128  6.0042 1.3547 5.4322 2.2842 0.5720029      2.655743  
1 1 1 5  15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  16 0  f 2.5337 1.1535 0.7612   13.522  4.5878    19.308  -2.9219   18.943  2.7028 1.7003 2.3646 1.5593 -0.000000      0.000000  
1 1 1 5  16 1  o 8.8515 0.6793 80.323   12.020  83.344    17.281  77.492    16.729  9.0131 0.9587 8.6900 0.9626 0.3230953      1.358507  
1 1 1 5  16 2  o 9.4835 0.6780 92.317   12.751  77.214    17.623  108.913   18.474  8.6539 1.0182 10.313 0.8956 -1.659176      1.356063  
1 1 1 5  16 3  o 7.4952 0.7870 59.294   11.365  48.114    15.826  71.197    16.329  6.6822 1.2295 8.3081 0.9827 -1.625896      1.574001  
1 1 1 5  16 4  o 7.6038 0.7349 59.653   11.150  54.660    15.242  65.402    16.354  7.2603 1.0497 7.9473 1.0289 -0.6870046     1.469845  
1 1 1 5  16 5  o 8.3503 0.7035 72.399   11.644  77.281    15.830  66.642    17.189  8.6792 0.9120 8.0213 1.0714 0.6579657      1.407010  
1 1 1 5  16 6  o 11.004 0.6248 123.898  13.743  122.413   19.683  125.311   19.198  10.935 0.9000 11.073 0.8669 -0.1379728     1.249602  
1 1 1 5  16 7  o 12.350 0.6040 156.594  14.916  159.910   21.357  153.436   20.842  12.477 0.8558 12.223 0.8526 0.2539806      1.208019  
1 1 1 5  16 8  o 8.2277 0.7188 70.303   11.825  71.911    16.691  68.682    16.756  8.3264 1.0023 8.1290 1.0306 0.1974688      1.437641  
1 1 1 5  16 9  o 24.083 0.5379 595.496  25.843  633.208   36.212  556.352   36.893  24.886 0.7276 23.279 0.7924 1.606625       1.075744  
1 1 1 5  16 10 o 9.9253 0.6670 103.779  12.993  123.317   18.129  83.147    18.630  10.942 0.8284 8.9084 1.0456 2.033757       1.334029  
1 1 1 5  16 11 o 3.0425 0.8991 3.3428   9.1603  4.7342    12.655  1.8114    13.277  3.1001 1.2732 2.9849 1.2700 0.1152024      1.798288  
1 1 1 5  16 12 o 2.9022 0.9465 -4.3600  9.9869  -2.5339   10.956  -13.3304  24.284  2.4856 1.1035 3.3188 1.5380 -0.8331988     1.892926  
1 1 1 5  16 13 o 9.3414 1.0809 100.604  15.076  101.793   16.807  95.704    34.106  9.9010 0.8488 8.7817 1.9882 1.119397       2.161755  
1 1 1 5  16 14 o 3.6329 1.0596 -6.5403  10.259  -14.3426  11.233  32.697    25.190  2.0195 0.9682 5.2463 1.8850 -3.226815      2.119113  
1 1 1 5  16 15 o 6.1883 1.0079 59.110   13.595  74.050    15.093  -5.1537   31.303  8.4062 0.8977 3.9703 1.8048 4.435897       2.015712  
1 1 1 5  16 16 o 10.296 0.9198 114.441  15.546  113.765   17.607  116.835   33.117  10.473 0.8406 10.119 1.6364 0.3542061      1.839685  
1 1 1 5  16 17 o 3.3370 1.0782 -5.5171  11.272  -7.7733   12.219  7.3630    29.195  2.3895 1.1016 4.2845 1.8538 -1.895025      2.156430  
1 1 1 5  16 18 o 10.537 1.1224 136.720  16.742  142.756   18.621  111.255   38.247  11.741 0.7930 9.3321 2.1000 2.408993       2.244702  
1 1 1 5  16 19 o 10.445 1.0157 119.555  16.440  118.340   18.457  124.223   36.174  10.677 0.8643 10.214 1.8384 0.4628601      2.031449  
1 1 1 5  16 20 o 7.1536 1.1887 65.173   14.306  69.074    15.865  48.202    33.092  8.1103 0.9781 6.1969 2.1668 1.913394       2.377315  
1 1 1 5  16 21 o 4.2138 1.2050 11.521   12.373  8.9949    13.566  24.009    30.167  3.4297 1.3491 4.9979 1.9970 -1.568178      2.410015  
1 1 1 5  16 22 o 2.2706 1.0719 -12.1419 12.736  -12.1419  12.736  0.0000    0.0000  2.2706 1.0719 ?      ?      ?              ?         
1 1 1 5  16 23 o 8.5310 1.2567 88.030   16.242  86.916    17.852  93.385    39.132  9.0142 0.9902 8.0478 2.3101 0.9664373      2.513419  
1 1 1 5  16 24 o 5.6695 1.3025 41.505   14.491  41.262    15.675  42.936    38.000  5.8726 1.3612 5.4665 2.2211 0.4061208      2.604982  
1 1 1 5  16 25 o 4.1000 1.2451 14.970   13.783  13.623    14.761  24.131    38.500  3.6064 1.4106 4.5937 2.0521 -0.9872208     2.490128  
1 1 1 5  16 26 o 5.6277 1.2178 53.773   15.802  57.675    17.145  31.740    40.737  6.7591 1.3156 4.4962 2.0496 2.262848       2.435517  
1 1 1 5  16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  16 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  17 0  o 5.9275 1.4617 48.197   16.105  38.851    22.801  57.501    22.750  5.0962 2.1860 6.7587 1.9409 -0.000000      0.000000  
1 1 1 5  17 1  o 8.5232 0.7581 76.047   12.577  56.138    17.668  96.501    17.908  7.3411 1.2033 9.7053 0.9226 -2.364222      1.516289  
1 1 1 5  17 2  f 7.0187 0.8391 51.641   11.429  43.117    15.548  61.663    16.858  6.3176 1.2744 7.7197 1.0918 -1.402106      1.678198  
1 1 1 5  17 3  o 24.911 0.5297 631.298  26.388  623.265   36.973  639.638   37.675  24.751 0.7469 25.071 0.7514 -0.3204231     1.059433  
1 1 1 5  17 4  o 15.922 0.5649 259.514  17.939  235.680   25.187  284.055   25.557  15.165 0.8304 16.679 0.7662 -1.513841      1.129886  
1 1 1 5  17 5  o 6.1421 0.9123 41.050   11.188  24.677    15.385  59.426    16.299  4.7449 1.4698 7.5393 1.0809 -2.794361      1.824501  
1 1 1 5  17 6  o 15.219 0.5684 236.862  17.286  230.690   23.886  243.649   25.048  15.014 0.7954 15.423 0.8120 -0.4085627     1.136725  
1 1 1 5  17 7  o 10.974 0.6462 125.243  14.060  106.663   19.852  143.945   19.917  10.125 0.9803 11.823 0.8423 -1.697387      1.292474  
1 1 1 5  17 8  o 5.2997 0.9811 31.810   10.976  42.985    15.300  19.962    15.755  6.2423 1.2688 4.3570 1.4967 1.885343       1.962106  
1 1 1 5  17 9  o 9.0984 0.7073 86.932   12.707  71.261    17.886  102.904   18.057  8.2308 1.0865 9.9660 0.9059 -1.735188      1.414634  
1 1 1 5  17 10 o 3.7751 0.9155 10.332   9.8069  26.950    14.073  -5.3539   13.673  4.8862 1.3796 2.6640 1.2037 2.222109       1.830909  
1 1 1 5  17 11 o 14.854 0.6582 227.817  19.048  246.121   31.085  216.812   24.103  15.258 1.0186 14.450 0.8340 0.8079748      1.316493  
1 1 1 5  17 12 o 5.9018 1.2152 39.574   13.158  38.697    14.637  43.266    30.030  5.8726 1.2822 5.9311 2.0647 -0.5845976E-01 2.430392  
1 1 1 5  17 13 o 4.8556 1.2058 24.831   12.452  23.366    13.892  30.817    28.083  4.5269 1.3958 5.1842 1.9668 -0.6573186     2.411690  
1 1 1 5  17 14 o 4.4943 1.0655 24.490   12.198  31.931    13.353  -13.0384  29.988  5.3049 1.2744 3.6837 1.7078 1.621228       2.130935  
1 1 1 5  17 15 o 5.3281 1.2318 30.634   13.128  28.877    14.724  37.444    28.985  5.0322 1.4078 5.6241 2.0219 -0.5919161     2.463699  
1 1 1 5  17 16 o 3.9405 1.1846 7.5929   12.387  6.5410    13.451  13.461    31.770  3.2570 1.3221 4.6241 1.9659 -1.367137      2.369168  
1 1 1 5  17 17 f 13.353 0.8126 193.083  18.387  194.484   21.156  188.759   37.173  13.712 0.7714 12.993 1.4305 0.7190599      1.625228  
1 1 1 5  17 18 o 17.063 0.8396 330.301  22.602  345.348   25.596  277.035   48.158  18.365 0.6969 15.762 1.5277 2.602982       1.679103  
1 1 1 5  17 19 f 3.2411 1.0319 -0.1436  11.220  2.8187    12.181  -16.7264  28.820  2.9235 1.2287 3.5588 1.6581 -0.6353734     2.063783  
1 1 1 5  17 20 o 15.080 0.8167 241.159  20.408  238.800   23.153  249.377   43.211  15.211 0.7611 14.949 1.4453 0.2616558      1.633453  
1 1 1 5  17 21 o 7.2241 1.2531 63.412   15.359  63.609    17.030  62.556    35.546  7.6897 1.1073 6.7585 2.2483 0.9311900      2.506209  
1 1 1 5  17 22 o 10.173 1.0103 102.520  17.081  91.095    19.039  149.629   38.662  9.2124 1.0334 11.133 1.7363 -1.920885      2.020561  
1 1 1 5  17 23 o 5.3020 1.3570 29.892   14.514  25.527    15.770  54.067    37.108  4.6034 1.4959 6.0006 2.2645 -1.397255      2.714022  
1 1 1 5  17 24 o 4.1194 1.2646 14.629   14.460  12.546    15.534  28.154    39.581  3.5570 1.4289 4.6818 2.0868 -1.124819      2.529128  
1 1 1 5  17 25 o 7.3899 1.2254 99.587   17.253  106.968   18.419  46.759    49.278  9.8018 0.9396 4.9780 2.2634 4.823818       2.450709  
1 1 1 5  17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  18 0  o 3.9598 1.5011 24.128   16.668  31.404    23.898  17.236    23.259  4.4235 2.2122 3.4961 2.0297 -0.000000      0.000000  
1 1 1 5  18 1  o 10.508 0.6698 114.021  14.004  99.379    19.461  129.745   20.166  9.7918 0.9937 11.224 0.8983 -1.432574      1.339581  
1 1 1 5  18 2  f 3.7259 0.9971 11.707   10.198  12.324    14.322  11.072    14.524  3.7631 1.4096 3.6887 1.4108 0.7439852E-01  1.994271  
1 1 1 5  18 3  o 19.742 0.5480 398.210  21.615  373.878   30.033  424.358   31.134  19.111 0.7858 20.373 0.7641 -1.262156      1.096019  
1 1 1 5  18 4  o 6.6763 0.9145 48.746   11.748  44.294    15.995  53.961    17.312  6.3339 1.3061 7.0188 1.2804 -0.6848979     1.829023  
1 1 1 5  18 5  o 6.3155 0.9378 45.109   11.598  53.968    15.597  34.151    17.346  7.1589 1.0893 5.4722 1.5270 1.686668       1.875687  
1 1 1 5  18 6  o 5.5475 0.9640 34.570   11.080  48.750    15.771  20.746    15.571  6.6801 1.2256 4.4149 1.4882 2.265178       1.927911  
1 1 1 5  18 7  o 12.205 0.6226 154.478  15.152  144.977   21.777  163.394   21.096  11.821 0.9211 12.589 0.8379 -0.7676811     1.245150  
1 1 1 5  18 8  o 2.9408 0.9720 -12.5258 11.195  -15.4959  12.625  -1.5959   24.218  2.1682 1.0359 3.7135 1.6450 -1.545295      1.944015  
1 1 1 5  18 9  o 10.110 0.6768 107.427  13.657  114.352   19.235  100.388   19.392  10.457 0.9197 9.7627 0.9932 0.6946621      1.353609  
1 1 1 5  18 10 o 9.2416 0.7427 91.754   13.491  106.137   18.644  75.945    19.546  10.071 0.9256 8.4123 1.1617 1.658711       1.485421  
1 1 1 5  18 11 o 12.280 0.8610 169.824  17.726  176.578   20.509  149.880   35.244  13.061 0.7851 11.498 1.5326 1.562760       1.721957  
1 1 1 5  18 12 o 4.9013 1.2400 25.326   13.344  24.058    14.939  30.330    29.680  4.5951 1.4522 5.2075 2.0103 -0.6124024     2.480001  
1 1 1 5  18 13 o 7.2878 1.2394 58.975   15.107  55.653    16.795  73.053    34.573  7.1770 1.1701 7.3986 2.1853 -0.2216425     2.478812  
1 1 1 5  18 14 o 13.610 0.8470 196.194  19.133  193.833   21.708  204.408   40.495  13.698 0.7924 13.523 1.4973 0.1756678      1.694048  
1 1 1 5  18 15 o 5.8569 1.2271 43.458   14.159  46.782    15.545  27.259    34.314  6.4839 1.2439 5.2299 2.1157 1.254048       2.454259  
1 1 1 5  18 16 o 3.4528 1.1272 -9.4828  11.919  -13.0904  12.802  14.003    32.664  2.2552 1.0676 4.6504 1.9856 -2.395248      2.254452  
1 1 1 5  18 17 f 4.2041 1.1833 15.197   12.831  17.727    13.994  1.8469    32.146  4.1092 1.4106 4.2990 1.9003 -0.1898050     2.366589  
1 1 1 5  18 18 o 7.5245 1.2121 73.605   15.806  79.882    17.857  50.895    33.966  8.7051 1.0257 6.3439 2.1965 2.361196       2.424165  
1 1 1 5  18 19 o 7.7315 1.2590 63.215   15.843  56.888    17.589  90.423    36.474  7.1417 1.2784 8.3214 2.1693 -1.179711      2.517995  
1 1 1 5  18 20 o 9.1560 1.1732 97.693   16.683  97.581    18.709  98.129    36.857  9.6199 0.9724 8.6921 2.1355 0.9277601      2.346471  
1 1 1 5  18 21 o 5.5381 1.3463 26.658   14.178  19.068    15.451  67.105    35.668  4.1781 1.4789 6.8980 2.2501 -2.719944      2.692660  
1 1 1 5  18 22 o 8.0646 1.2577 91.951   16.903  98.752    18.895  64.706    37.820  9.5835 0.9858 6.5458 2.3142 3.037692       2.515405  
1 1 1 5  18 23 o 5.8091 1.4220 38.120   15.864  29.251    17.314  84.511    39.598  4.7378 1.5688 6.8803 2.3722 -2.142506      2.844052  
1 1 1 5  18 24 o 7.6919 1.3305 86.389   16.911  85.671    18.440  90.188    42.413  8.6865 1.0614 6.6973 2.4403 1.989213       2.661099  
1 1 1 5  18 25 o 4.6362 1.2603 34.088   15.618  35.631    16.699  23.317    44.125  5.0154 1.5274 4.2571 2.0052 0.7582769      2.520658  
1 1 1 5  18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  18 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  19 0  o 5.9769 1.4204 50.703   17.436  73.760    24.593  27.398    24.725  7.8467 1.7994 4.1070 2.1983 -0.000000      0.000000  
1 1 1 5  19 1  o 6.3237 1.0141 45.074   12.537  47.581    17.590  42.485    17.873  6.5246 1.3905 6.1228 1.4766 0.4018731      2.028272  
1 1 1 5  19 2  o 18.743 0.5637 361.142  21.115  378.601   29.927  343.838   29.795  19.206 0.7791 18.281 0.8149 0.9250526      1.127442  
1 1 1 5  19 3  o 4.5426 1.0801 21.509   11.596  17.019    15.404  27.381    17.615  4.1302 1.4751 4.9550 1.5781 -0.8247643     2.160186  
1 1 1 5  19 4  o 3.8162 1.0129 10.752   11.460  22.225    15.557  -2.8633   16.947  4.5256 1.4865 3.1069 1.3762 1.418756       2.025734  
1 1 1 5  19 5  o 9.4321 0.7297 93.639   13.692  83.023    19.351  104.282   19.376  8.8689 1.0910 9.9953 0.9692 -1.126362      1.459333  
1 1 1 5  19 6  o 4.2360 0.9217 16.870   10.437  34.838    14.365  -3.2225   15.190  5.5637 1.3122 2.9082 1.2948 2.655466       1.843477  
1 1 1 5  19 7  o 10.344 0.6823 112.541  14.098  107.863   20.104  117.068   19.776  10.117 0.9936 10.571 0.9354 -0.4535742     1.364647  
1 1 1 5  19 8  o 8.8032 0.7554 82.435   13.209  94.270    18.877  71.081    18.489  9.4562 0.9981 8.1503 1.1342 1.305887       1.510883  
1 1 1 5  19 9  o 8.2808 0.7935 73.721   12.998  85.193    18.345  62.157    18.419  8.9773 1.0217 7.5842 1.2143 1.393172       1.586959  
1 1 1 5  19 10 o 2.6952 0.8582 -4.5142  9.7004  -2.0525   14.386  -6.5666   13.136  2.8583 1.2669 2.5321 1.1580 0.3262150      1.716416  
1 1 1 5  19 11 o 7.6057 1.1862 62.362   15.214  57.206    17.150  81.407    32.963  7.2714 1.1793 7.9400 2.0586 -0.6685696     2.372441  
1 1 1 5  19 12 o 8.9882 1.1266 99.380   16.068  105.240   18.401  80.569    32.970  10.028 0.9175 7.9485 2.0578 2.079526       2.253107  
1 1 1 5  19 13 o 7.4309 1.2305 63.907   15.313  63.173    17.094  66.889    34.454  7.7014 1.1098 7.1604 2.1965 0.5410151      2.460962  
1 1 1 5  19 14 o 13.281 0.8510 196.097  19.079  201.925   22.067  178.840   37.973  13.968 0.7899 12.594 1.5075 1.373213       1.701936  
1 1 1 5  19 15 o 14.685 0.8313 224.100  20.171  217.608   22.754  247.931   43.593  14.501 0.7845 14.868 1.4660 -0.3669939     1.662692  
1 1 1 5  19 16 f 8.2062 1.3447 78.787   21.558  61.323    27.951  104.431   33.870  7.0767 1.9242 9.3356 1.8790 -2.258922      2.689454  
1 1 1 5  19 17 o 6.8715 1.2770 56.545   15.502  57.409    17.132  52.641    36.409  7.3234 1.1697 6.4195 2.2705 0.9038482      2.554051  
1 1 1 5  19 18 o 7.7967 1.2874 69.686   16.036  67.690    17.621  79.303    38.682  7.9594 1.1069 7.6340 2.3247 0.3254108      2.574754  
1 1 1 5  19 19 o 4.9097 1.3049 11.347   13.878  2.6127    15.114  58.297    35.043  3.1681 1.3517 6.6514 2.2326 -3.483276      2.609894  
1 1 1 5  19 20 o 4.3256 1.2532 16.677   15.129  19.183    16.638  4.7084    36.363  4.2221 1.5299 4.4291 1.9853 -0.2070441     2.506384  
1 1 1 5  19 21 f 4.9181 1.1824 31.399   14.630  38.408    16.229  0.9840    33.807  5.6805 1.4296 4.1558 1.8838 1.524699       2.364842  
1 1 1 5  19 22 f 3.4823 1.1311 0.9531   13.718  1.8466    14.874  -4.1364   35.498  3.0051 1.3115 3.9595 1.8433 -0.9543841     2.262250  
1 1 1 5  19 23 o 5.0619 1.3896 23.737   15.445  14.172    16.794  76.197    39.331  3.7063 1.4868 6.4174 2.3481 -2.711052      2.779264  
1 1 1 5  19 24 o 3.1845 1.0746 -1.5967  13.932  1.3983    14.717  -27.4401  43.232  2.8508 1.2715 3.5182 1.7328 -0.6673861     2.149267  
1 1 1 5  19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  20 0  o 5.2942 1.3297 36.730   18.540  75.956    26.279  -2.1451   26.161  7.8341 1.9376 2.7543 1.8216 -0.000000      0.000000  
1 1 1 5  20 1  o 12.676 0.6361 167.392  16.120  167.697   22.520  167.072   23.085  12.695 0.8869 12.657 0.9119 0.3776741E-01  1.272108  
1 1 1 5  20 2  o 16.528 0.5903 282.962  19.479  261.046   27.171  306.136   27.940  15.854 0.8569 17.201 0.8122 -1.347216      1.180629  
1 1 1 5  20 3  o 3.7868 1.0522 11.372   11.619  8.5781    15.546  14.906    17.488  3.5381 1.4266 4.0355 1.5470 -0.4974036     2.104330  
1 1 1 5  20 4  o 6.6513 0.9532 49.782   12.236  45.078    16.798  55.098    17.858  6.2965 1.3726 7.0061 1.3230 -0.7096643     1.906406  
1 1 1 5  20 5  o 13.276 0.6278 183.919  16.651  185.133   23.080  182.600   24.047  13.335 0.8653 13.217 0.9097 0.1189213      1.255561  
1 1 1 5  20 6  o 9.1786 0.7847 89.335   14.264  73.839    19.525  107.073   20.889  8.2933 1.1771 10.064 1.0378 -1.770557      1.569311  
1 1 1 5  20 7  f 7.6575 0.9083 65.220   13.461  72.936    18.757  57.025    19.331  8.2456 1.1374 7.0694 1.4166 1.176167       1.816676  
1 1 1 5  20 8  o 3.6402 1.0191 8.1549   11.828  19.560    16.425  -4.1315   17.048  4.2674 1.5233 3.0131 1.3543 1.254283       2.038286  
1 1 1 5  20 9  o 6.8523 0.9572 53.142   12.809  57.991    17.592  47.670    18.686  7.3105 1.2032 6.3941 1.4890 0.9163651      1.914334  
1 1 1 5  20 10 o 4.7207 1.0434 28.327   13.047  39.322    14.399  -22.1015  30.837  5.9129 1.2563 3.5284 1.6663 2.384548       2.086868  
1 1 1 5  20 11 o 4.4824 1.2450 13.253   14.097  7.2037    16.000  34.243    29.802  3.4946 1.4329 5.4703 2.0364 -1.975657      2.490017  
1 1 1 5  20 12 f 4.8402 1.2653 23.156   13.980  21.564    15.683  29.314    30.848  4.4337 1.4936 5.2467 2.0428 -0.8130441     2.530550  
1 1 1 5  20 13 f 3.4422 1.0770 1.1036   13.611  7.3837    15.269  -23.2035  30.039  3.4324 1.4028 3.4520 1.6346 -0.1953340E-01 2.153957  
1 1 1 5  20 14 o 14.200 0.8126 205.470  19.944  195.341   22.830  238.106   40.980  13.722 0.8318 14.677 1.3961 -0.9547462     1.625121  
1 1 1 5  20 15 o 12.036 0.8858 150.079  18.170  144.395   20.723  168.978   37.788  11.788 0.8790 12.284 1.5381 -0.4956484     1.771591  
1 1 1 5  20 16 o 13.367 0.8685 177.943  19.595  165.961   22.109  221.827   42.311  12.636 0.8749 14.098 1.5006 -1.462192      1.737007  
1 1 1 5  20 17 o 6.2973 1.2991 45.552   15.257  43.142    17.195  54.469    33.078  6.1228 1.4301 6.4718 2.1691 -0.3490043     2.598118  
1 1 1 5  20 18 o 6.8270 1.3523 55.538   16.178  54.680    17.745  59.763    39.375  6.9806 1.3194 6.6734 2.3611 0.3072309      2.704696  
1 1 1 5  20 19 o 7.0113 1.2035 70.826   16.829  82.378    19.149  31.624    35.274  8.7353 1.0961 5.2873 2.1429 3.448043       2.406939  
1 1 1 5  20 20 o 6.1995 1.2402 54.246   16.285  60.504    17.816  22.458    40.153  7.3992 1.2039 4.9997 2.1687 2.399459       2.480439  
1 1 1 5  20 21 o 3.9591 1.2324 9.7674   14.757  10.325    15.928  6.3863    39.213  3.5400 1.4381 4.3782 2.0017 -0.8381977     2.464719  
1 1 1 5  20 22 o 6.7216 1.2367 72.512   17.227  79.520    19.056  41.160    40.303  8.3374 1.1428 5.1059 2.1935 3.231462       2.473356  
1 1 1 5  20 23 o 5.5439 1.1983 52.354   16.218  58.526    17.552  16.315    42.411  6.8323 1.3324 4.2556 1.9922 2.576672       2.396656  
1 1 1 5  20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 0  o 10.414 1.1962 121.931  22.230  95.888    29.753  154.843   33.447  8.9499 1.8889 11.877 1.4683 -0.000000      0.000000  
1 1 1 5  21 1  o 5.5276 1.0682 35.813   12.917  49.632    17.801  20.443    18.773  6.6151 1.3896 4.4401 1.6226 2.175064       2.136349  
1 1 1 5  21 2  o 6.7006 0.9987 51.342   13.767  23.437    19.006  82.148    19.970  4.6385 1.6405 8.7628 1.1395 -4.124248      1.997364  
1 1 1 5  21 3  o 3.8957 1.0200 12.257   11.554  24.663    16.029  -1.1573   16.668  4.6694 1.5073 3.1220 1.3747 1.547351       2.040096  
1 1 1 5  21 4  o 4.0558 1.0207 11.307   12.195  -7.7958   16.807  32.547    17.722  2.8571 1.3078 5.2544 1.5676 -2.397256      2.041488  
1 1 1 5  21 5  o 6.0996 1.0807 43.703   13.270  35.342    18.238  53.108    19.343  5.4476 1.5810 6.7515 1.4739 -1.303875      2.161450  
1 1 1 5  21 6  o 10.715 0.7582 123.390  16.091  140.228   22.580  106.016   22.936  11.519 0.9801 9.9109 1.1571 1.607718       1.516441  
1 1 1 5  21 7  o 2.8815 0.9668 -13.6897 12.696  -12.1288  14.535  -18.7142  26.079  2.4786 1.1622 3.2845 1.5454 -0.8059168     1.933625  
1 1 1 5  21 8  o 11.638 0.7154 144.301  16.519  153.552   22.534  133.554   24.288  12.093 0.9317 11.183 1.0859 0.9099226      1.430799  
1 1 1 5  21 9  o 12.224 0.6488 155.768  15.818  151.969   21.475  160.273   23.386  12.078 0.8890 12.371 0.9452 -0.2933130     1.297593  
1 1 1 5  21 10 o 4.8754 1.2671 16.209   14.855  5.6506    17.059  49.322    30.210  3.4860 1.4590 6.2647 2.0722 -2.778719      2.534280  
1 1 1 5  21 11 o 4.7477 1.2376 24.961   15.064  29.949    16.905  5.7246    33.198  5.0806 1.5345 4.4147 1.9421 0.6658902      2.475194  
1 1 1 5  21 12 o 3.7385 1.1277 7.0833   13.783  11.404    15.633  -8.0018   29.210  3.6995 1.4504 3.7775 1.7272 -0.7796025E-01 2.255438  
1 1 1 5  21 13 o 16.694 0.8174 298.431  22.831  299.718   26.090  294.221   47.174  17.065 0.7644 16.323 1.4451 0.7425346      1.634806  
1 1 1 5  21 14 o 8.9559 1.1067 83.455   17.006  75.036    19.523  109.937   34.626  8.3697 1.1663 9.5422 1.8812 -1.172500      2.213435  
1 1 1 5  21 15 o 6.4701 1.3032 53.319   16.367  56.702    18.280  39.647    36.752  7.1190 1.3329 5.8212 2.2399 1.297760       2.606461  
1 1 1 5  21 16 o 10.203 1.1746 130.830  18.264  139.479   20.808  101.799   38.122  11.552 0.9006 8.8538 2.1698 2.697847       2.349265  
1 1 1 5  21 17 o 8.9566 1.2877 101.612  18.044  105.317   20.159  86.685    40.465  9.9790 1.0101 7.9341 2.3691 2.044885       2.575414  
1 1 1 5  21 18 o 5.0610 1.2838 30.674   15.420  33.361    17.192  19.621    34.872  5.2853 1.5353 4.8367 2.0581 0.4486599      2.567649  
1 1 1 5  21 19 o 9.1555 1.2881 105.297  18.341  105.798   20.471  103.258   41.293  9.9109 1.0328 8.4001 2.3602 1.510847       2.576245  
1 1 1 5  21 20 o 4.7469 1.2718 28.113   16.092  32.362    17.877  9.9744    36.937  5.0774 1.5863 4.4164 1.9885 0.6610436      2.543690  
1 1 1 5  21 21 o 3.3236 1.1217 -17.4769 21.240  -1.7788   25.702  -51.2951  37.723  3.4808 1.6021 3.1665 1.5704 0.3143072      2.243357  
1 1 1 5  21 22 o 3.3571 1.0777 3.5399   14.917  11.599    16.036  -48.2304  40.642  3.4690 1.4299 3.2453 1.6129 0.2236969      2.155489  
1 1 1 5  21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  21 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  22 0  o 3.9610 1.5525 26.196   18.097  27.821    25.324  24.501    25.871  4.0586 2.2080 3.8634 2.1829 -0.000000      0.000000  
1 1 1 5  22 1  f 12.204 0.7102 157.685  17.300  171.009   24.776  145.008   24.167  12.727 0.9733 11.680 1.0346 1.047405       1.420470  
1 1 1 5  22 2  o 10.432 0.7618 115.500  15.841  105.088   21.465  127.955   23.476  9.9154 1.0824 10.948 1.0722 -1.032402      1.523525  
1 1 1 5  22 3  o 5.0262 1.1241 29.310   12.890  36.260    18.263  22.411    18.196  5.5319 1.5750 4.5206 1.6044 1.011205       2.248274  
1 1 1 5  22 4  o 5.4401 1.1747 35.279   13.868  34.563    18.371  36.227    21.145  5.3981 1.5925 5.4821 1.7272 -0.8395863E-01 2.349362  
1 1 1 5  22 5  o 3.9462 0.9878 5.5193   12.800  34.134    17.796  -25.1504  18.424  5.3876 1.5612 2.5047 1.2106 2.882941       1.975559  
1 1 1 5  22 6  o 5.7649 1.1069 38.652   13.055  35.581    17.637  42.375    19.417  5.5262 1.5388 6.0036 1.5914 -0.4773226     2.213748  
1 1 1 5  22 7  f 3.6692 1.0523 8.8634   12.089  6.0108    17.031  11.761    17.164  3.5049 1.4616 3.8336 1.5144 -0.3286815     2.104653  
1 1 1 5  22 8  o 6.8457 1.0409 54.023   13.863  62.829    19.599  45.208    19.610  7.4801 1.3602 6.2114 1.5760 1.268766       2.081822  
1 1 1 5  22 9  o 7.7729 1.2725 75.678   17.402  78.788    19.849  65.347    36.177  8.5607 1.1593 6.9851 2.2655 1.575583       2.544913  
1 1 1 5  22 10 o 4.0836 1.2282 8.1772   15.070  5.6867    17.145  16.637    31.600  3.4730 1.4586 4.6941 1.9763 -1.221135      2.456306  
1 1 1 5  22 11 o 4.1975 1.2076 -2.5192  14.613  -15.1616  16.625  40.419    30.639  2.6077 1.2291 5.7873 2.0790 -3.179549      2.415100  
1 1 1 5  22 12 f 11.520 0.9102 134.036  18.621  123.423   21.502  165.865   37.236  10.848 0.9911 12.192 1.5271 -1.344054      1.820464  
1 1 1 5  22 13 o 14.464 0.8053 204.748  20.514  185.893   23.511  264.896   41.992  13.369 0.8793 15.559 1.3495 -2.189354      1.610660  
1 1 1 5  22 14 o 9.4435 1.1918 98.853   17.792  95.268    19.951  112.780   39.322  9.4825 1.0520 9.4045 2.1389 0.7793999E-01  2.383593  
1 1 1 5  22 15 o 18.689 0.7518 348.855  24.701  326.305   28.420  418.504   49.947  17.760 0.8001 19.618 1.2730 -1.858137      1.503545  
1 1 1 5  22 16 o 3.8195 1.2211 -3.2684  16.417  -6.9854   18.566  10.056    35.152  3.0412 1.3853 4.5978 2.0112 -1.556606      2.442101  
1 1 1 5  22 17 o 6.7059 1.3844 48.687   17.845  35.904    20.563  87.668    35.910  5.4096 1.7031 8.0023 2.1831 -2.592638      2.768885  
1 1 1 5  22 18 o 6.6358 1.3571 62.997   18.750  68.534    20.971  40.940    41.856  7.6562 1.4219 5.6155 2.3119 2.040629       2.714160  
1 1 1 5  22 19 o 4.4156 1.3112 12.913   16.286  5.7499    18.299  40.207    35.720  3.4489 1.4797 5.3824 2.1651 -1.933566      2.622498  
1 1 1 5  22 20 o 6.8761 1.4426 45.162   17.219  27.847    18.705  141.295   44.076  4.5884 1.6269 9.1638 2.3827 -4.575335      2.885124  
1 1 1 5  22 21 o 3.3045 1.1462 -19.5183 16.883  -26.6138  18.532  15.098    40.934  2.3520 1.1537 4.2570 1.9810 -1.905082      2.292433  
1 1 1 5  22 22 o 4.2414 1.2445 26.892   17.112  30.730    18.682  6.8962    42.642  4.5500 1.6246 3.9329 1.8857 0.6170936      2.488984  
1 1 1 5  22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  22 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  23 0  o 4.3189 1.3986 20.020   18.439  -16.2388  25.983  56.806    26.171  2.3626 1.6317 6.2751 2.2719 -0.000000      0.000000  
1 1 1 5  23 1  o 3.7202 1.0801 8.0902   13.026  2.9219    18.564  13.104    18.284  3.4671 1.4891 3.9733 1.5651 -0.5062709     2.160299  
1 1 1 5  23 2  o 5.9458 1.1330 41.562   13.762  42.234    18.792  40.784    20.211  6.0184 1.5514 5.8732 1.6516 0.1451788      2.265907  
1 1 1 5  23 3  o 11.306 0.7672 136.743  17.195  149.086   23.647  122.897   25.047  11.905 0.9932 10.707 1.1696 1.197848       1.534426  
1 1 1 5  23 4  o 6.9233 1.1011 56.011   14.878  60.385    20.440  51.083    21.697  7.2771 1.4553 6.5695 1.6528 0.7075610      2.202151  
1 1 1 5  23 5  o 9.6486 0.8153 100.027  15.671  107.294   21.877  92.368    22.459  10.044 1.0890 9.2529 1.2136 0.7913713      1.630594  
1 1 1 5  23 6  o 2.6209 0.8710 -17.2649 12.022  -5.5324   16.716  -29.8355  17.303  2.9460 1.3310 2.2959 1.1238 0.6500928      1.741967  
1 1 1 5  23 7  o 4.4416 1.1229 19.655   13.651  32.337    18.709  5.2144    19.963  5.2355 1.6207 3.6476 1.5548 1.587883       2.245854  
1 1 1 5  23 8  o 8.3640 0.9214 76.577   14.841  60.905    19.937  96.054    22.225  7.3004 1.4166 9.4276 1.1787 -2.127197      1.842828  
1 1 1 5  23 9  o 7.2352 1.2103 71.927   17.503  86.260    20.479  33.084    33.714  8.9853 1.1396 5.4850 2.1356 3.500298       2.420623  
1 1 1 5  23 10 o 3.4595 1.1182 -5.0534  15.070  -1.2784   17.045  -18.5754  32.259  3.1689 1.3929 3.7500 1.7496 -0.5810845     2.236340  
1 1 1 5  23 11 o 5.8579 1.3285 40.168   16.063  39.687    18.324  41.767    33.382  5.8370 1.5454 5.8788 2.1614 -0.4179287E-01 2.657049  
1 1 1 5  23 12 o 9.5652 1.2479 114.281  18.627  119.916   21.091  94.295    39.718  10.682 0.9872 8.4482 2.2923 2.234032       2.495831  
1 1 1 5  23 13 o 5.9817 1.3426 44.370   17.021  46.293    19.474  38.146    35.033  6.2792 1.5581 5.6842 2.1870 0.5950551      2.685241  
1 1 1 5  23 14 o 6.8118 1.3615 51.952   17.390  45.795    20.026  70.830    35.065  6.2513 1.5962 7.3724 2.2062 -1.121023      2.723092  
1 1 1 5  23 15 o 7.6109 1.2438 84.423   18.679  100.275   21.621  37.778    37.088  9.6344 1.1221 5.5874 2.2201 4.046986       2.487569  
1 1 1 5  23 16 o 4.4682 1.2239 19.782   17.256  32.272    19.924  -17.7155  34.522  5.1556 1.6817 3.7807 1.7786 1.374851       2.447806  
1 1 1 5  23 17 o 4.6559 1.2970 24.282   17.782  31.410    19.824  -5.0627   40.223  5.0474 1.6790 4.2645 1.9774 0.7828693      2.594067  
1 1 1 5  23 18 o 4.4633 1.2055 22.982   17.511  36.337    19.189  -43.5291  42.821  5.3178 1.6405 3.6088 1.7667 1.708987       2.410952  
1 1 1 5  23 19 o 4.3979 1.2872 23.878   18.232  29.485    20.253  -0.0870   41.872  4.6814 1.6892 4.1145 1.9427 0.5669427      2.574383  
1 1 1 5  23 20 o 3.9470 1.2660 12.245   17.873  12.244    19.522  12.250    44.430  3.6375 1.5436 4.2566 2.0071 -0.6191552     2.532033  
1 1 1 5  23 21 o 3.9680 1.2569 17.724   17.288  17.575    18.725  18.586    44.996  3.7720 1.5489 4.1639 1.9800 -0.3918736     2.513855  
1 1 1 5  23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  24 0  o 9.9970 1.3882 119.350  24.692  115.517   34.603  123.326   35.245  9.7940 1.9971 10.200 1.9288 -0.000000      0.000000  
1 1 1 5  24 1  o 4.2132 1.1368 16.499   13.467  10.875    18.692  22.570    19.420  3.8527 1.5604 4.5737 1.6535 -0.7210405     2.273583  
1 1 1 5  24 2  o 6.5902 1.0725 50.688   14.691  72.028    20.942  30.010    20.615  8.1060 1.2918 5.0744 1.7124 3.031511       2.144958  
1 1 1 5  24 3  o 7.8157 1.0342 69.671   15.804  74.803    22.234  64.430    22.469  8.2194 1.3525 7.4121 1.5648 0.8073411      2.068301  
1 1 1 5  24 4  f 3.5846 1.0583 3.7088   13.092  -6.7073   17.650  16.450    19.520  2.9751 1.3534 4.1942 1.6272 -1.219155      2.116514  
1 1 1 5  24 5  o 9.1985 0.8901 91.888   16.234  77.067    22.277  108.671   23.706  8.3650 1.3316 10.032 1.1815 -1.666833      1.780176  
1 1 1 5  24 6  o 4.1634 1.2605 8.9770   16.696  10.308    19.085  4.6356    34.463  3.8626 1.5722 4.4642 1.9707 -0.6016197     2.521021  
1 1 1 5  24 7  o 8.9329 0.8884 85.990   15.855  85.567    22.911  86.378    21.964  8.8957 1.2877 8.9702 1.2243 -0.7451916E-01 1.776838  
1 1 1 5  24 8  o 5.0229 1.3737 23.592   17.222  20.876    19.609  32.752    36.012  4.5070 1.6567 5.5387 2.1918 -1.031766      2.747480  
1 1 1 5  24 9  o 8.4084 1.2387 92.417   18.534  104.511   21.921  62.095    34.709  9.9112 1.1059 6.9056 2.2169 3.005694       2.477427  
1 1 1 5  24 10 o 5.7874 1.3158 41.242   16.745  44.850    19.304  30.278    33.651  6.2039 1.5580 5.3710 2.1209 0.8329034      2.631612  
1 1 1 5  24 11 o 3.9576 1.2313 4.4518   15.963  5.1304    17.902  1.8189    35.263  3.5135 1.4838 4.4016 1.9652 -0.8880966     2.462514  
1 1 1 5  24 12 o 10.601 1.1450 132.061  20.328  136.462   23.879  120.475   38.742  11.354 1.0516 9.8488 2.0342 1.505214       2.289932  
1 1 1 5  24 13 o 4.3655 1.2696 15.006   17.883  23.546    20.500  -12.1841  36.579  4.6517 1.6963 4.0793 1.8895 0.5724068      2.539187  
1 1 1 5  24 14 o 4.1589 1.2601 10.610   17.641  13.875    20.630  1.7279    34.026  4.0658 1.6419 4.2520 1.9120 -0.1861787     2.520287  
1 1 1 5  24 15 o 8.1511 1.2451 108.521  21.116  134.775   24.155  23.443    43.483  11.162 1.0820 5.1400 2.2429 6.022284       2.490196  
1 1 1 5  24 16 f 5.4541 1.3614 40.714   18.849  46.499    21.878  24.053    37.128  6.0127 1.7277 4.8956 2.1043 1.117132       2.722703  
1 1 1 5  24 17 o 5.4808 1.4784 39.481   19.401  34.396    21.698  59.752    43.323  5.0703 1.7556 5.8913 2.3793 -0.8210669     2.956886  
1 1 1 5  24 18 o 5.0579 1.2854 38.993   18.730  49.180    21.248  3.4834    39.669  5.9862 1.6969 4.1296 1.9311 1.856655       2.570754  
1 1 1 5  24 19 o 4.5194 1.0704 26.777   17.517  51.062    19.168  -96.2403  43.141  6.1421 1.5580 2.8967 1.4682 3.245415       2.140762  
1 1 1 5  24 20 o 4.0739 1.2053 22.255   18.808  34.893    21.125  -26.0627  41.307  4.7270 1.7222 3.4208 1.6866 1.306170       2.410556  
1 1 1 5  24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 0  o 4.6689 1.7061 37.028   20.509  38.314    28.982  35.737    29.025  4.7514 2.4228 4.5864 2.4027 -0.000000      0.000000  
1 1 1 5  25 1  o 16.447 0.6390 281.796  20.987  298.519   29.622  264.941   29.738  16.958 0.8734 15.935 0.9331 1.023418       1.278075  
1 1 1 5  25 2  o 10.682 0.8101 121.416  17.292  115.254   24.237  127.804   24.678  10.394 1.1659 10.969 1.1249 -0.5750599     1.620110  
1 1 1 5  25 3  o 3.7440 1.0927 5.1074   13.854  17.496    20.003  -6.3132   19.205  4.3318 1.6559 3.1561 1.4262 1.175670       2.185451  
1 1 1 5  25 4  o 7.5549 1.1185 65.205   16.345  54.145    22.061  78.665    24.338  6.7976 1.6413 8.3122 1.5200 -1.514571      2.237032  
1 1 1 5  25 5  o 6.4813 1.0892 49.340   15.388  74.509    21.444  22.622    22.095  8.2782 1.2952 4.6845 1.7515 3.593633       2.178415  
1 1 1 5  25 6  o 4.3962 1.1979 18.205   14.902  16.473    21.293  19.868    20.864  4.3101 1.6918 4.4824 1.6965 -0.1723299     2.395877  
1 1 1 5  25 7  o 12.125 0.9867 161.993  21.149  162.609   24.870  160.383   40.196  12.435 1.0000 11.814 1.7012 0.6216211      1.973369  
1 1 1 5  25 8  o 8.2636 1.2326 100.642  19.522  125.464   22.944  35.556    37.154  10.883 1.0541 5.6438 2.2285 5.239596       2.465264  
1 1 1 5  25 9  o 6.2826 1.3455 50.234   17.568  53.302    20.152  40.524    35.855  6.7674 1.5254 5.7978 2.2168 0.9696708      2.690926  
1 1 1 5  25 10 o 7.6025 1.3099 71.657   18.630  74.661    21.731  63.326    36.186  8.2722 1.3135 6.9328 2.2667 1.339376       2.619737  
1 1 1 5  25 11 o 5.4029 1.3963 31.735   18.143  27.267    21.403  43.141    34.197  4.9134 1.7405 5.8924 2.1838 -0.9789472     2.792538  
1 1 1 5  25 12 o 5.4234 1.4134 32.008   18.477  24.989    21.687  50.597    35.292  4.7221 1.7412 6.1248 2.2269 -1.402750      2.826786  
1 1 1 5  25 13 o 4.2514 1.2899 11.734   18.833  16.284    22.098  -0.3388   35.997  4.2382 1.7036 4.2646 1.9373 -0.2645111E-01 2.579835  
1 1 1 5  25 14 o 4.0768 1.2547 7.4303   19.555  18.812    22.725  -25.0384  38.383  4.3558 1.7356 3.7979 1.8123 0.5578361      2.509336  
1 1 1 5  25 15 f 9.8089 1.3222 120.407  22.295  115.290   25.935  134.896   43.640  10.060 1.2890 9.5574 2.3089 0.5028553      2.644345  
1 1 1 5  25 16 o 6.6911 1.3579 74.165   20.368  81.971    23.321  49.061    41.821  8.0479 1.5042 5.3343 2.2612 2.713609       2.715778  
1 1 1 5  25 17 o 3.6730 1.1931 3.5846   18.261  7.9953    20.609  -12.5331  39.397  3.5567 1.5482 3.7894 1.8158 -0.2327414     2.386205  
1 1 1 5  25 18 o 3.8006 1.2354 9.1891   19.528  12.725    21.782  -5.2921   44.084  3.7039 1.6019 3.8972 1.8810 -0.1933234     2.470720  
1 1 1 5  25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  25 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 0  o 2.9372 1.3507 -4.0388  19.995  -23.6024  27.898  16.625    28.672  2.3164 1.6204 3.5580 2.1616 -0.000000      0.000000  
1 1 1 5  26 1  o 6.7975 1.1794 54.317   16.154  41.095    22.273  68.989    23.462  5.8671 1.7590 7.7279 1.5715 -1.860771      2.358743  
1 1 1 5  26 2  o 9.8333 0.8991 105.613  17.292  130.405   24.622  81.481    24.292  11.072 1.1119 8.5948 1.4132 2.477103       1.798174  
1 1 1 5  26 3  o 6.9807 1.1844 57.451   16.419  47.873    22.706  67.949    23.772  6.3206 1.7408 7.6408 1.6066 -1.320214      2.368845  
1 1 1 5  26 4  o 4.9467 1.2386 26.647   15.374  20.877    20.728  33.703    22.922  4.5318 1.6961 5.3617 1.8056 -0.8298526     2.477300  
1 1 1 5  26 5  o 9.0714 0.9849 92.349   17.160  109.269   24.298  75.510    24.240  10.062 1.2074 8.0808 1.5563 1.981213       1.969740  
1 1 1 5  26 6  o 5.6240 1.2351 37.821   15.454  43.578    22.104  32.318    21.615  6.0038 1.7400 5.2442 1.7535 0.7595749      2.470254  
1 1 1 5  26 7  o 6.7473 1.3388 41.893   18.873  18.945    22.168  102.323   35.973  4.4673 1.7338 9.0274 2.0404 -4.560064      2.677599  
1 1 1 5  26 8  o 12.586 0.9776 176.473  21.593  179.731   25.395  167.973   41.025  13.089 0.9701 12.083 1.6976 1.005300       1.955194  
1 1 1 5  26 9  o 6.2974 1.2950 54.554   19.249  69.170    22.826  18.565    35.818  7.6968 1.5366 4.8980 2.0850 2.798721       2.590078  
1 1 1 5  26 10 o 5.9923 1.4208 28.395   19.532  7.4160    22.486  92.867    39.419  3.8636 1.6485 8.1210 2.3145 -4.257420      2.841592  
1 1 1 5  26 11 o 3.8091 1.2259 -2.2496  19.210  1.6243    22.698  -12.0295  36.064  3.6317 1.6015 3.9864 1.8565 -0.3546321     2.451786  
1 1 1 5  26 12 o 13.850 1.0923 236.177  25.315  252.342   29.729  193.545   48.279  15.379 0.9665 12.321 1.9593 3.058274       2.184692  
1 1 1 5  26 13 o 5.8267 1.3408 49.620   21.078  66.109    24.807  6.7962    39.977  7.1786 1.7449 4.4748 2.0362 2.703814       2.681530  
1 1 1 5  26 14 o 6.1142 1.3369 59.721   21.663  76.248    25.089  11.302    42.942  7.6916 1.6781 4.5368 2.0817 3.154875       2.673881  
1 1 1 5  26 15 o 6.1376 1.4270 61.881   20.809  65.815    24.017  50.032    41.681  6.9170 1.7382 5.3583 2.2636 1.558656       2.853960  
1 1 1 5  26 16 o 4.7851 1.4019 32.943   20.209  30.771    23.171  39.846    41.309  4.6502 1.7811 4.9201 2.1654 -0.2698460     2.803809  
1 1 1 5  26 17 o 3.1028 1.0732 -18.5495 19.768  -9.7177   22.063  -54.5109  44.519  2.9512 1.3984 3.2544 1.6284 -0.3031743     2.146458  
1 1 1 5  26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  26 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 0  o 5.4068 1.8361 50.288   23.044  52.637    30.641  47.229    34.964  5.6536 2.5376 5.1600 2.6544 -0.000000      0.000000  
1 1 1 5  27 1  o 10.966 0.8349 129.768  18.209  144.033   25.692  115.370   25.812  11.622 1.1054 10.311 1.2517 1.310698       1.669874  
1 1 1 5  27 2  o 8.2949 1.1565 83.184   18.648  49.121    26.850  114.929   25.920  6.2961 1.9403 10.294 1.2590 -3.997617      2.312965  
1 1 1 5  27 3  o 7.4415 1.1309 64.411   16.334  60.265    22.786  68.792    23.426  7.1719 1.6260 7.7111 1.5723 -0.5391636     2.261860  
1 1 1 5  27 4  o 4.6870 1.1817 20.489   15.547  0.8557    22.350  38.898    21.642  3.6557 1.6012 5.7182 1.7383 -2.062501      2.363360  
1 1 1 5  27 5  o 9.5772 1.2947 110.965  22.220  112.936   26.740  106.567   39.940  10.148 1.3175 9.0066 2.2292 1.141098       2.589478  
1 1 1 5  27 6  o 5.3369 1.3805 33.580   18.443  33.660    22.157  33.400    33.280  5.2894 1.7753 5.3843 2.1146 -0.9487963E-01 2.760980  
1 1 1 5  27 7  o 5.9628 1.2100 47.470   19.720  74.288    23.853  -10.4402  35.052  7.9296 1.5596 3.9960 1.8504 3.933614       2.420020  
1 1 1 5  27 8  o 5.1076 1.4152 29.109   19.537  29.292    22.630  28.573    38.717  4.9791 1.7869 5.2361 2.1952 -0.2570472     2.830492  
1 1 1 5  27 9  o 4.1410 1.1779 6.0830   18.961  32.761    22.386  -61.6444  35.668  5.1733 1.7836 3.1087 1.5391 2.064622       2.355866  
1 1 1 5  27 10 o 8.0248 1.4267 71.935   21.400  50.008    25.001  132.023   41.387  6.1962 1.8649 9.8535 2.1597 -3.657265      2.853444  
1 1 1 5  27 11 o 6.4752 1.3833 63.245   21.643  77.385    25.818  29.818    39.694  7.8395 1.6959 5.1110 2.1858 2.728551       2.766542  
1 1 1 5  27 12 o 8.9669 1.3374 127.426  23.535  156.855   28.418  63.163    41.994  11.776 1.2066 6.1574 2.3873 5.618921       2.674872  
1 1 1 5  27 13 o 5.3775 1.4828 47.013   22.332  47.300    25.826  46.163    44.463  5.5771 1.9162 5.1779 2.2635 0.3991756      2.965661  
1 1 1 5  27 14 o 4.2596 1.3438 13.068   20.493  4.3558    23.842  37.711    40.097  3.5672 1.6026 4.9521 2.1575 -1.384911      2.687607  
1 1 1 5  27 15 o 6.0915 1.4218 66.540   21.293  70.915    24.420  52.663    43.493  7.0323 1.7446 5.1506 2.2454 1.881773       2.843518  
1 1 1 5  27 16 o 3.3037 1.1399 -14.3345 20.122  -20.2288  23.148  3.8911    40.704  2.7530 1.3368 3.8545 1.8466 -1.101507      2.279714  
1 1 1 5  27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  27 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 0  o 7.6105 1.7829 85.516   24.677  96.452    33.606  72.720    36.351  8.5750 2.2681 6.6461 2.7516 -0.000000      0.000000  
1 1 1 5  28 1  f 10.815 0.9068 129.451  19.335  104.476   26.797  156.579   27.927  9.6341 1.3907 11.996 1.1640 -2.362343      1.813540  
1 1 1 5  28 2  o 3.7741 1.1248 0.2181   16.116  -23.0300  22.910  22.991    22.675  2.9205 1.3954 4.6276 1.7644 -1.707068      2.249556  
1 1 1 5  28 3  o 5.3145 1.2972 34.596   16.768  31.920    23.478  37.382    23.957  5.1485 1.8230 5.4805 1.8460 -0.3319397     2.594401  
1 1 1 5  28 4  o 4.8096 1.2648 25.998   16.295  31.077    23.713  21.453    22.429  5.0924 1.8290 4.5268 1.7476 0.5656338      2.529689  
1 1 1 5  28 5  o 4.0783 1.2777 5.4919   19.453  9.1750    22.879  -4.1183   36.957  3.9443 1.6722 4.2122 1.9322 -0.2679656     2.555342  
1 1 1 5  28 6  o 5.3936 1.3856 37.612   20.550  47.843    24.302  11.933    38.501  6.1081 1.8387 4.6792 2.0734 1.428929       2.771213  
1 1 1 5  28 7  o 4.2345 1.3035 10.299   19.414  11.344    23.078  7.7709    35.904  4.0244 1.6914 4.4445 1.9838 -0.4200873     2.606957  
1 1 1 5  28 8  o 4.9195 1.3011 28.931   20.025  45.071    23.316  -16.4359  39.091  5.8791 1.8075 3.9600 1.8720 1.919032       2.602191  
1 1 1 5  28 9  o 5.9019 1.4860 41.259   20.800  25.661    24.654  79.779    38.743  4.6754 1.8246 7.1285 2.3461 -2.453044      2.972088  
1 1 1 5  28 10 o 4.3911 1.3395 5.4823   20.558  -14.0108  24.695  49.482    37.102  3.1630 1.4930 5.6193 2.2244 -2.456242      2.678998  
1 1 1 5  28 11 o 3.8334 1.2776 -6.2374  21.566  -17.2265  25.079  24.954    42.253  3.0420 1.4553 4.6249 2.1002 -1.582918      2.555102  
1 1 1 5  28 12 o 7.8425 1.4879 95.497   22.738  93.274    26.778  101.241   43.051  8.3985 1.6531 7.2865 2.4745 1.112047       2.975820  
1 1 1 5  28 13 o 4.8816 1.3481 38.719   21.399  50.106    24.701  4.4577    42.846  5.6799 1.8735 4.0834 1.9389 1.596490       2.696172  
1 1 1 5  28 14 o 3.4566 1.1718 -4.9719  20.153  -6.9585   23.190  1.1567    40.731  3.0723 1.4491 3.8410 1.8420 -0.7686896     2.343692  
1 1 1 5  28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 0  o 10.429 1.5249 136.413  27.952  143.738   38.873  128.570   40.223  10.905 1.9745 9.9529 2.3244 -0.000000      0.000000  
1 1 1 5  29 1  o 4.3650 1.2098 16.110   16.734  -2.7696   24.164  33.508    23.197  3.5455 1.6012 5.1845 1.8141 -1.639077      2.419639  
1 1 1 5  29 2  o 11.609 0.8725 150.179  20.216  159.288   28.481  140.931   28.698  12.010 1.1858 11.209 1.2801 0.8005295      1.744921  
1 1 1 5  29 3  o 5.2046 1.3179 34.159   17.441  38.237    25.010  30.298    24.336  5.4318 1.8846 4.9774 1.8427 0.4544110      2.635743  
1 1 1 5  29 4  o 4.7716 1.3420 15.398   18.777  -1.5671   22.541  53.866    33.942  3.4539 1.5544 6.0894 2.1881 -2.635471      2.684004  
1 1 1 5  29 5  o 4.7974 1.3923 13.375   20.122  -3.8505   23.667  58.294    38.219  3.4358 1.5647 6.1589 2.3035 -2.723147      2.784632  
1 1 1 5  29 6  o 4.6488 1.3867 22.251   21.136  22.843    25.399  20.918    38.116  4.5384 1.8257 4.7592 2.0877 -0.2208109     2.773362  
1 1 1 5  29 7  o 11.850 1.2422 187.629  24.188  199.918   28.739  157.782   44.788  13.422 1.0706 10.278 2.2419 3.143953       2.484399  
1 1 1 5  29 8  o 3.8509 1.2280 6.8217   20.398  17.884    23.570  -26.1902  40.716  4.0834 1.7124 3.6183 1.7607 0.4651389      2.456067  
1 1 1 5  29 9  o 4.9318 1.4602 25.355   21.810  9.5080    25.443  69.265    42.353  3.8316 1.6923 6.0319 2.3801 -2.200338      2.920409  
1 1 1 5  29 10 o 4.7163 1.3733 32.325   21.355  38.543    25.106  16.050    40.615  5.0739 1.8730 4.3588 2.0090 0.7151446      2.746695  
1 1 1 5  29 11 o 5.1199 1.4857 34.468   21.947  16.978    25.547  83.744    42.880  3.9979 1.7320 6.2420 2.4145 -2.244130      2.971453  
1 1 1 5  29 12 f 5.7885 1.5256 62.244   22.389  54.945    26.486  80.514    41.903  5.6807 1.9408 5.8962 2.3545 -0.2154779     3.051289  
1 1 1 5  29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 0  o 4.9931 1.9026 52.965   26.363  53.596    35.256  52.164    39.706  5.1019 2.6548 4.8843 2.7260 -0.000000      0.000000  
1 1 1 5  30 1  o 3.5447 1.1098 -3.5007  17.401  -33.7669  26.116  20.666    23.337  2.8194 1.3801 4.2701 1.7384 -1.450733      2.219631  
1 1 1 5  30 2  o 3.3917 1.0930 -2.6762  16.761  -14.6146  24.560  7.7298    22.930  3.0987 1.4704 3.6847 1.6177 -0.5859976     2.186081  
1 1 1 5  30 3  o 4.5020 1.2888 25.164   20.163  39.710    24.150  -8.3103   36.635  5.2190 1.8488 3.7851 1.7960 1.433850       2.577546  
1 1 1 5  30 4  o 4.6462 1.3620 29.121   20.034  28.668    24.223  30.102    35.641  4.5904 1.8036 4.7019 2.0413 -0.1114631     2.723994  
1 1 1 5  30 5  o 5.3343 1.4385 44.093   20.821  43.588    25.204  45.179    36.947  5.4172 1.8912 5.2513 2.1681 0.1658630      2.877035  
1 1 1 5  30 6  o 4.1290 1.2785 14.120   21.187  26.413    25.163  -15.8226  39.271  4.5119 1.8164 3.7462 1.7998 0.7656820      2.557060  
1 1 1 5  30 7  o 7.4388 1.5092 84.943   22.140  76.514    26.167  106.185   41.540  7.3493 1.7956 7.5283 2.4262 -0.1790309     3.018332  
1 1 1 5  30 8  o 3.5445 1.1920 -15.6271 20.287  -33.0088  24.238  25.029    37.070  2.6454 1.3019 4.4436 1.9972 -1.798173      2.384054  
1 1 1 5  30 9  o 3.6246 1.2155 -0.5103  21.053  -0.7146   24.245  0.1161    42.451  3.3262 1.5398 3.9230 1.8811 -0.5967941     2.430937  
1 1 1 5  30 10 o 3.6218 1.1981 4.4326   21.289  11.879    24.912  -15.7299  40.992  3.6834 1.6477 3.5601 1.7398 0.1233377      2.396214  
1 1 1 5  30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  30 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 0  o 2.7435 1.3339 -7.8630  23.870  -15.6551  33.076  0.6055    34.482  2.5510 1.7800 2.9361 1.9872 -0.000000      0.000000  
1 1 1 5  31 1  o 5.7057 1.2605 48.940   18.865  17.359    27.833  75.775    25.657  4.1019 1.7920 7.3095 1.7732 -3.207582      2.521003  
1 1 1 5  31 2  o 3.8126 1.2326 3.6483   19.432  -6.2468   23.524  24.909    34.481  3.1860 1.4890 4.4392 1.9648 -1.253177      2.465293  
1 1 1 5  31 3  f 4.5268 1.3727 15.246   21.398  -7.2915   25.711  66.033    38.595  3.2637 1.5352 5.7899 2.2761 -2.526173      2.745466  
1 1 1 5  31 4  o 5.2730 1.4349 48.649   21.747  51.954    25.678  40.262    40.900  5.7078 1.9112 4.8382 2.1408 0.8696866      2.869725  
1 1 1 5  31 5  o 3.8099 1.2416 -3.1229  20.703  -24.2756  25.341  39.339    35.904  2.8435 1.3849 4.7763 2.0612 -1.932798      2.483232  
1 1 1 5  31 6  o 3.2288 1.1277 -35.5508 21.762  -57.9727  26.175  14.637    39.161  2.3838 1.2003 4.0738 1.9094 -1.690017      2.255337  
1 1 1 5  31 7  o 3.7763 1.1703 5.5780   21.315  35.443    24.706  -81.3664  42.154  4.6538 1.8237 2.8987 1.4672 1.755053       2.340612  
1 1 1 5  31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  31 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  32 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  33 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  34 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  35 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 5  36 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  1  0  o 10.497 0.7184 114.368  14.574  99.243    20.760  129.065   20.464  9.7625 1.0991 11.232 0.9254 -0.000000      0.000000  
1 1 1 6  1  1  o 46.531 0.5976 2175.49  55.612  2159.20   78.588  2191.82   78.706  46.356 0.8477 46.706 0.8426 -0.3502693     1.195173  
1 1 1 6  1  2  o 53.156 0.6388 2840.85  67.913  2816.57   95.871  2865.29   96.217  52.927 0.9057 53.385 0.9012 -0.4572144     1.277642  
1 1 1 6  1  3  o 18.802 0.4791 354.691  18.016  347.627   25.429  361.810   25.527  18.614 0.6831 18.991 0.6721 -0.3769150     0.9582890 
1 1 1 6  1  4  o 11.675 0.6594 130.119  14.815  163.955   25.541  112.962   18.188  12.753 1.0014 10.597 0.8582 2.156126       1.318776  
1 1 1 6  1  5  o 5.5073 0.7861 37.646   7.0208  19.789    14.805  42.827    7.9745  4.4792 1.4489 6.5355 0.6101 -2.056304      1.572120  
1 1 1 6  1  6  o 16.146 0.4875 261.635  15.741  267.473   22.305  255.842   22.219  16.326 0.6831 15.966 0.6958 0.3599443      0.9750965 
1 1 1 6  1  7  o 22.237 0.4928 496.605  21.912  507.359   31.006  485.877   30.969  22.478 0.6897 21.995 0.7040 0.4829121      0.9855327 
1 1 1 6  1  8  o 20.027 0.4884 402.657  19.560  407.524   27.681  397.803   27.643  20.148 0.6869 19.906 0.6944 0.2425861      0.9767281 
1 1 1 6  1  9  o 10.198 0.5189 104.324  10.572  97.341    14.753  111.693   15.156  9.8469 0.7491 10.550 0.7183 -0.7026157     1.037865  
1 1 1 6  1  10 o 23.243 0.4984 541.925  23.163  524.969   32.630  559.146   32.885  22.876 0.7132 23.611 0.6964 -0.7346344     0.9968087 
1 1 1 6  1  11 o 29.214 0.5153 856.256  30.107  853.343   42.468  859.199   42.689  29.164 0.7281 29.264 0.7294 -0.9972763E-01 1.030588  
1 1 1 6  1  12 o 14.813 0.5014 220.157  14.850  213.578   20.811  226.982   21.197  14.587 0.7133 15.039 0.7048 -0.4514608     1.002775  
1 1 1 6  1  13 o 18.721 0.4963 352.016  18.582  345.345   26.058  358.916   26.504  18.540 0.7028 18.901 0.7011 -0.3609829     0.9926860 
1 1 1 6  1  14 o 13.670 0.5094 187.908  13.924  187.972   19.472  187.841   19.918  13.674 0.7120 13.667 0.7287 0.6488800E-02  1.018816  
1 1 1 6  1  15 o 18.406 0.5011 341.707  18.413  314.849   25.755  369.788   26.334  17.661 0.7291 19.150 0.6876 -1.488840      1.002213  
1 1 1 6  1  16 o 4.3452 0.8460 20.338   7.6492  23.276    10.317  16.752    11.398  4.6640 1.1201 4.0264 1.2681 0.6376228      1.691965  
1 1 1 6  1  17 o 15.104 0.5150 232.023  15.540  241.459   21.817  222.306   22.141  15.423 0.7073 14.785 0.7487 0.6375818      1.029985  
1 1 1 6  1  18 o 2.9968 0.7302 8.0300   5.0310  10.954    8.9144  6.6636    6.0943  3.3247 1.1260 2.6689 0.9300 0.6557734      1.460436  
1 1 1 6  1  19 o 8.6396 0.4936 75.058   8.4590  86.210    13.005  66.881    11.137  9.1846 0.7080 8.0946 0.6879 1.090006       0.9871567 
1 1 1 6  1  20 o 7.8340 0.5214 62.855   8.1148  65.218    12.292  61.029    10.804  7.9534 0.7727 7.7145 0.7002 0.2388768      1.042800  
1 1 1 6  1  21 o 11.410 0.4756 139.878  10.116  112.609   16.713  155.642   12.708  10.432 0.8010 12.388 0.5129 -1.955521      0.9511810 
1 1 1 6  1  22 o 3.5957 0.7471 13.259   5.6624  18.467    9.1993  10.082    7.1847  4.0819 1.1014 3.1096 1.0097 0.9722612      1.494150  
1 1 1 6  1  23 o 5.1319 0.6781 28.960   6.6412  22.850    10.049  33.698    8.8492  4.5485 1.1136 5.7153 0.7742 -1.166802      1.356263  
1 1 1 6  1  24 o 4.3759 0.7053 22.233   6.4473  10.165    9.8626  31.239    8.5197  3.2589 1.1784 5.4929 0.7755 -2.233974      1.410664  
1 1 1 6  1  25 o 13.813 0.4164 194.727  11.469  181.851   16.451  206.904   15.998  13.356 0.6159 14.270 0.5606 -0.9136953     0.8327950 
1 1 1 6  1  26 o 5.4126 0.7292 31.948   7.6544  25.905    11.053  37.517    10.611  4.8268 1.1595 5.9984 0.8844 -1.171655      1.458304  
1 1 1 6  1  27 o 12.986 0.4481 172.506  11.622  160.558   16.226  185.093   16.655  12.517 0.6481 13.454 0.6190 -0.9367085     0.8962214 
1 1 1 6  1  28 o 10.356 0.5045 111.208  10.427  113.821   14.401  108.327   15.118  10.498 0.6859 10.215 0.7400 0.2830582      1.008978  
1 1 1 6  1  29 o 4.0224 0.9055 18.148   8.6685  10.031    12.130  26.621    12.393  3.3070 1.2828 4.7378 1.2783 -1.430813      1.810977  
1 1 1 6  1  30 o 7.2108 0.6938 58.384   9.8592  61.914    13.204  53.935    14.822  7.5339 0.8763 6.8876 1.0760 0.6462708      1.387685  
1 1 1 6  1  31 o 6.8770 0.8063 59.319   10.204  72.707    13.618  42.179    15.409  8.1049 0.8401 5.6491 1.3765 2.455870       1.612583  
1 1 1 6  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  1  36 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  2  0  o 21.449 0.6817 464.211  29.104  472.395   41.454  456.255   40.871  21.636 0.9623 21.261 0.9657 -0.000000      0.000000  
1 1 1 6  2  1  o 42.931 0.5722 1851.51  49.133  1842.66   69.423  1860.38   69.546  42.828 0.8105 43.034 0.8080 -0.2060280     1.144479  
1 1 1 6  2  2  f 21.274 0.4791 454.178  20.381  446.461   28.820  461.899   28.827  21.093 0.6832 21.456 0.6718 -0.3628101     0.9581292 
1 1 1 6  2  3  o 29.911 0.5085 898.442  30.418  882.286   42.959  914.685   43.075  29.641 0.7247 30.182 0.7136 -0.5412369     1.017024  
1 1 1 6  2  4  o 22.094 0.4836 489.866  21.366  501.116   30.265  478.689   30.168  22.348 0.6771 21.841 0.6906 0.5072861      0.9672095 
1 1 1 6  2  5  o 40.488 0.5621 1646.88  45.518  1645.19   64.424  1648.56   64.320  40.467 0.7960 40.509 0.7939 -0.4190445E-01 1.124225  
1 1 1 6  2  6  o 25.971 0.4994 677.260  25.940  676.853   36.732  677.665   36.639  25.963 0.7074 25.979 0.7052 -0.1589394E-01 0.9988214 
1 1 1 6  2  7  o 29.826 0.5941 899.278  30.901  887.260   60.894  903.446   35.862  29.644 1.0271 30.008 0.5975 -0.3642807     1.188251  
1 1 1 6  2  8  o 19.053 0.5665 368.159  18.691  357.365   37.083  371.835   21.641  18.844 0.9839 19.263 0.5617 -0.4189835     1.133005  
1 1 1 6  2  9  f 12.834 0.5653 161.020  12.684  174.697   25.486  156.517   14.623  13.173 0.9673 12.495 0.5851 0.6779299      1.130552  
1 1 1 6  2  10 o 19.955 0.5553 390.961  19.460  417.881   38.709  381.856   22.512  20.389 0.9493 19.522 0.5766 0.8664913      1.110651  
1 1 1 6  2  11 f 12.119 0.5897 147.923  12.313  146.781   24.747  148.298   14.195  12.073 1.0249 12.164 0.5835 -0.9075737E-01 1.179338  
1 1 1 6  2  12 o 23.255 0.5029 542.957  23.386  534.674   32.928  551.387   33.221  23.076 0.7135 23.434 0.7088 -0.3584976     1.005702  
1 1 1 6  2  13 f 30.231 0.5237 918.838  31.655  895.052   44.664  942.843   44.870  29.836 0.7485 30.625 0.7326 -0.7897110     1.047325  
1 1 1 6  2  14 o 22.277 0.5014 499.213  22.329  476.949   31.427  521.908   31.730  21.773 0.7217 22.781 0.6964 -1.007811      1.002897  
1 1 1 6  2  15 o 10.822 0.6941 123.676  14.079  105.237   23.481  134.027   17.592  10.130 1.1590 11.513 0.7640 -1.383285      1.388139  
1 1 1 6  2  16 o 18.541 0.5073 348.744  18.779  321.866   26.294  376.725   26.828  17.804 0.7384 19.278 0.6958 -1.474003      1.014606  
1 1 1 6  2  17 o 11.450 0.5504 133.944  12.549  145.113   17.515  122.161   17.989  11.954 0.7326 10.947 0.8217 1.007568       1.100835  
1 1 1 6  2  18 o 5.2429 0.9324 31.905   10.109  40.624    13.107  19.102    15.883  6.1542 1.1055 4.3316 1.5019 1.822572       1.864883  
1 1 1 6  2  19 o 6.7694 0.6682 47.369   8.9171  46.235    11.614  48.998    13.917  6.6909 0.8679 6.8478 1.0162 -0.1568565     1.336361  
1 1 1 6  2  20 o 17.498 0.5601 316.424  19.567  318.216   28.543  314.835   26.875  17.528 0.8142 17.467 0.7693 0.6100273E-01  1.120161  
1 1 1 6  2  21 o 8.6138 0.6433 77.973   10.821  78.988    13.954  76.442    17.138  8.7290 0.7993 8.4987 1.0083 0.2302656      1.286675  
1 1 1 6  2  22 o 5.0246 0.7022 28.244   6.7991  20.419    10.169  34.569    9.1432  4.2762 1.1597 5.7730 0.7919 -1.496820      1.404319  
1 1 1 6  2  23 o 7.0601 0.5398 51.114   7.5240  53.099    11.697  49.713    9.8266  7.1610 0.8167 6.9591 0.7060 0.2018580      1.079592  
1 1 1 6  2  24 o 3.8300 0.6764 16.718   6.4000  -0.5493   10.357  27.384    8.1401  2.5188 1.0970 5.1411 0.7917 -2.622225      1.352815  
1 1 1 6  2  25 o 13.583 0.4308 189.160  11.630  173.441   16.915  203.252   16.017  13.027 0.6493 14.138 0.5664 -1.111678      0.8616120 
1 1 1 6  2  26 o 5.1519 0.7959 29.609   7.8075  27.893    12.574  30.686    9.9601  4.9733 1.2621 5.3305 0.9700 -0.3572512     1.591760  
1 1 1 6  2  27 f 7.3145 0.6120 55.860   8.8422  68.076    12.895  45.018    12.148  8.0926 0.7967 6.5363 0.9293 1.556301       1.224037  
1 1 1 6  2  28 o 12.570 0.4741 163.246  11.902  155.390   16.954  170.882   16.714  12.259 0.6915 12.881 0.6488 -0.6219110     0.9481812 
1 1 1 6  2  29 o 5.0577 0.8681 30.314   8.8093  23.537    12.340  37.356    12.580  4.4257 1.3051 5.6896 1.1451 -1.263940      1.736264  
1 1 1 6  2  30 o 4.3897 0.8945 24.175   8.9588  33.843    12.280  13.176    13.099  5.2999 1.1879 3.4796 1.3376 1.820296       1.788974  
1 1 1 6  2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  3  0  o 26.280 0.6966 696.354  36.488  680.805   51.678  711.810   51.524  25.983 0.9978 26.576 0.9723 -0.000000      0.000000  
1 1 1 6  3  1  o 19.817 0.4719 394.160  18.700  401.532   26.422  386.760   26.470  20.003 0.6604 19.631 0.6742 0.3728447      0.9437838 
1 1 1 6  3  2  o 35.295 0.5292 1251.07  37.358  1253.98   52.824  1248.15   52.841  35.336 0.7475 35.253 0.7494 0.8274460E-01  1.058468  
1 1 1 6  3  3  o 29.149 0.5022 852.764  29.276  847.064   41.414  858.458   41.391  29.051 0.7128 29.247 0.7076 -0.1954880     1.004377  
1 1 1 6  3  4  o 15.976 0.4725 256.148  15.093  248.359   21.357  263.921   21.333  15.733 0.6787 16.220 0.6576 -0.4870949     0.9450558 
1 1 1 6  3  5  o 14.753 0.4742 218.428  13.990  215.489   19.734  221.397   19.836  14.653 0.6734 14.853 0.6678 -0.1999760     0.9483358 
1 1 1 6  3  6  o 19.850 0.4806 395.644  19.081  398.475   27.054  392.843   26.916  19.921 0.6790 19.779 0.6804 0.1414471      0.9612745 
1 1 1 6  3  7  o 13.871 0.4831 193.120  13.396  186.266   18.899  200.041   18.990  13.623 0.6936 14.119 0.6725 -0.4962854     0.9661258 
1 1 1 6  3  8  o 10.327 0.5023 107.025  10.372  108.611   14.632  105.424   14.705  10.404 0.7032 10.249 0.7173 0.1544704      1.004527  
1 1 1 6  3  9  o 14.449 0.4859 209.386  14.042  213.230   19.961  205.620   19.756  14.580 0.6845 14.318 0.6899 0.2628918      0.9718839 
1 1 1 6  3  10 o 42.470 0.6653 1817.94  49.143  1803.17   97.386  1822.98   56.922  42.299 1.1512 42.641 0.6675 -0.3413086     1.330662  
1 1 1 6  3  11 o 9.7424 0.6790 106.046  10.765  77.169    21.470  115.744   12.442  8.7388 1.2284 10.746 0.5789 -2.007072      1.358033  
1 1 1 6  3  12 o 24.852 0.5867 628.618  25.203  606.867   50.055  636.005   29.170  24.522 1.0206 25.182 0.5792 -0.6595936     1.173486  
1 1 1 6  3  13 o 11.586 0.6667 137.886  14.529  127.934   24.756  143.116   17.945  11.243 1.1010 11.929 0.7522 -0.6866140     1.333359  
1 1 1 6  3  14 o 16.617 0.6175 278.411  19.485  281.287   33.312  276.916   24.024  16.655 1.0001 16.580 0.7245 0.7529449E-01  1.234918  
1 1 1 6  3  15 o 16.146 0.6480 271.806  19.321  246.302   33.811  284.172   23.543  15.516 1.0896 16.777 0.7016 -1.261593      1.295964  
1 1 1 6  3  16 o 18.375 0.6168 330.317  21.456  395.285   38.197  300.369   25.934  19.578 0.9755 17.171 0.7551 2.407194       1.233631  
1 1 1 6  3  17 o 14.769 0.6535 220.127  18.259  237.288   31.892  211.759   22.270  15.127 1.0541 14.410 0.7728 0.7177324      1.307020  
1 1 1 6  3  18 o 4.6602 0.9763 23.599   10.658  35.339    14.483  9.7343    15.740  5.6499 1.3076 3.6704 1.4501 1.979513       1.952639  
1 1 1 6  3  19 o 2.1114 0.7079 -13.2845 8.1451  -21.9447  12.865  -7.4905   10.523  2.0167 0.9832 2.2061 1.0188 -0.1893461     1.415871  
1 1 1 6  3  20 o 9.3037 0.6952 90.434   12.835  97.011    19.652  85.542    16.949  9.5752 1.0262 9.0322 0.9382 0.5430279      1.390458  
1 1 1 6  3  21 o 13.881 0.6050 201.097  16.746  203.840   24.708  198.767   22.774  13.947 0.8858 13.815 0.8243 0.1322231      1.209978  
1 1 1 6  3  22 o 5.8988 1.0323 40.789   12.129  36.199    18.181  44.470    16.283  5.5399 1.5694 6.2576 1.3414 -0.7177091     2.064541  
1 1 1 6  3  23 o 3.6376 1.0687 7.6086   12.412  2.6592    21.796  9.9840    15.100  3.6811 1.5973 3.5940 1.4202 0.8701730E-01  2.137359  
1 1 1 6  3  24 o 14.694 0.5710 219.276  16.576  196.970   21.492  252.027   26.042  13.808 0.7783 15.581 0.8357 -1.772828      1.141976  
1 1 1 6  3  25 o 2.4620 0.7497 -6.5078  8.0124  -27.8244  12.765  7.3496    10.292  1.8588 0.9203 3.0652 1.1837 -1.206447      1.499387  
1 1 1 6  3  26 o 17.572 0.4919 315.904  17.247  334.651   25.466  300.020   23.441  18.045 0.7056 17.099 0.6855 0.9461937      0.9837569 
1 1 1 6  3  27 o 5.7811 0.8687 35.193   9.5373  51.078    15.932  26.321    11.906  6.7505 1.2252 4.8118 1.2319 1.938747       1.737447  
1 1 1 6  3  28 o 9.4000 0.6263 92.954   11.349  95.306    18.770  91.599    14.249  9.4258 0.9957 9.3742 0.7600 0.5160046E-01  1.252579  
1 1 1 6  3  29 o 2.7544 0.8417 1.1090   8.9287  -10.0208  14.709  7.6027    11.235  2.4780 1.1642 3.0309 1.2160 -0.5529499     1.683495  
1 1 1 6  3  30 o 4.2923 1.0231 23.327   10.176  27.848    16.519  20.562    12.918  4.5439 1.5328 4.0406 1.3555 0.5033016      2.046227  
1 1 1 6  3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  4  0  o 22.824 0.6830 525.497  31.050  520.601   44.032  530.339   43.792  22.716 0.9732 22.932 0.9586 -0.000000      0.000000  
1 1 1 6  4  1  o 29.945 0.5041 899.982  30.188  903.107   42.680  896.854   42.704  29.998 0.7114 29.893 0.7143 0.1044712      1.008106  
1 1 1 6  4  2  o 23.210 0.4804 540.611  22.294  555.559   31.525  525.655   31.533  23.532 0.6698 22.888 0.6889 0.6442356      0.9608325 
1 1 1 6  4  3  o 7.5364 0.5322 57.081   8.0156  55.728    11.472  58.371    11.204  7.4483 0.7701 7.6245 0.7347 -0.1761489     1.064394  
1 1 1 6  4  4  o 36.757 0.5372 1357.43  39.488  1378.70   55.955  1336.32   55.735  37.045 0.7552 36.469 0.7642 0.5757484      1.074384  
1 1 1 6  4  5  o 25.242 0.4893 639.916  24.701  631.080   34.899  648.787   34.967  25.067 0.6961 25.418 0.6878 -0.3505249     0.9786264 
1 1 1 6  4  6  o 12.361 0.4817 153.404  11.907  154.819   16.765  151.964   16.914  12.419 0.6750 12.303 0.6874 0.1158991      0.9633685 
1 1 1 6  4  7  o 13.302 0.4842 177.496  12.880  181.428   18.243  173.588   18.188  13.449 0.6782 13.155 0.6913 0.2945395      0.9684299 
1 1 1 6  4  8  o 25.772 0.4950 666.483  25.511  679.179   36.152  653.890   36.005  26.018 0.6948 25.527 0.7052 0.4902744      0.9899618 
1 1 1 6  4  9  o 16.536 0.4835 274.249  15.987  267.703   22.671  280.723   22.547  16.339 0.6938 16.733 0.6737 -0.3939342     0.9670845 
1 1 1 6  4  10 o 14.208 0.4875 202.514  13.848  210.445   19.677  194.732   19.493  14.485 0.6792 13.932 0.6996 0.5525417      0.9750575 
1 1 1 6  4  11 o 10.013 0.5183 100.810  10.366  96.388    14.810  105.057   14.514  9.7962 0.7559 10.230 0.7094 -0.4337196     1.036613  
1 1 1 6  4  12 o 21.113 0.6029 448.048  23.874  451.264   41.833  446.495   29.074  21.144 0.9893 21.082 0.6895 0.6146812E-01  1.205859  
1 1 1 6  4  13 o 17.048 0.5994 304.896  17.176  270.414   34.708  316.078   19.765  16.347 1.0616 17.749 0.5568 -1.402662      1.198781  
1 1 1 6  4  14 o 31.403 0.6650 1022.57  39.302  934.065   66.530  1070.02   48.709  30.250 1.0997 32.555 0.7481 -2.305033      1.330011  
1 1 1 6  4  15 f 4.3413 0.9882 19.831   9.5206  13.060    17.804  22.543    11.267  4.0913 1.5626 4.5912 1.2100 -0.4999328     1.976312  
1 1 1 6  4  16 f 14.271 0.7511 211.708  21.346  203.900   31.297  218.500   29.189  13.997 1.1180 14.545 1.0034 -0.5479984     1.502297  
1 1 1 6  4  17 o 3.4451 0.9243 9.7666   8.7448  9.8752    12.990  9.6766    11.826  3.4939 1.3347 3.3963 1.2791 0.9762502E-01  1.848680  
1 1 1 6  4  18 o 5.4066 0.8960 31.760   9.5379  40.380    14.465  25.130    12.686  6.0579 1.2358 4.7554 1.2977 1.302468       1.791986  
1 1 1 6  4  19 o 9.7567 0.6735 100.485  12.926  90.657    19.487  108.205   17.272  9.2824 1.0497 10.231 0.8441 -0.9486609     1.346969  
1 1 1 6  4  20 o 13.548 0.6061 190.891  16.352  190.311   24.232  191.376   22.159  13.504 0.8972 13.592 0.8152 -0.8734703E-01 1.212216  
1 1 1 6  4  21 o 10.839 0.6821 123.079  14.695  132.285   22.320  116.035   19.523  11.174 0.9988 10.504 0.9293 0.6690311      1.364225  
1 1 1 6  4  22 o 11.398 0.6897 138.240  15.496  120.166   22.794  153.774   21.131  10.639 1.0712 12.157 0.8691 -1.517277      1.379441  
1 1 1 6  4  23 o 3.1276 0.9611 0.4268   11.124  2.6079    16.766  -1.2881   14.867  3.3024 1.4167 2.9527 1.2993 0.3496797      1.922272  
1 1 1 6  4  24 o 15.924 0.6273 262.694  19.940  285.337   29.149  242.780   27.336  16.572 0.8795 15.276 0.8947 1.295712       1.254615  
1 1 1 6  4  25 o 6.0316 0.9716 38.268   13.901  77.128    20.455  4.9208    18.949  8.4700 1.2075 3.5933 1.5225 4.876751       1.943245  
1 1 1 6  4  26 o 12.791 0.6610 172.246  16.489  176.459   21.289  165.928   26.069  13.056 0.8153 12.527 1.0406 0.5290203      1.321917  
1 1 1 6  4  27 o 8.2067 0.7844 75.834   11.986  60.418    18.377  87.245    15.811  7.2960 1.3074 9.1175 0.8671 -1.821549      1.568834  
1 1 1 6  4  28 f 8.5272 0.7291 77.718   12.318  86.078    19.058  71.721    16.142  8.8897 1.0719 8.1647 0.9885 0.7249594      1.458171  
1 1 1 6  4  29 o 4.1949 1.0575 21.897   11.071  23.918    17.169  20.459    14.484  4.3183 1.5557 4.0715 1.4329 0.2467661      2.115066  
1 1 1 6  4  30 o 3.1511 0.9591 6.4555   10.753  5.0255    17.497  7.3233    13.631  3.2025 1.4094 3.0998 1.3011 0.1027164      1.918162  
1 1 1 6  4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  5  0  o 3.8679 1.1579 21.321   9.0641  22.437    13.057  20.283    12.593  3.9825 1.6491 3.7532 1.6258 -0.000000      0.000000  
1 1 1 6  5  1  o 13.925 0.4758 194.702  13.244  201.085   18.672  188.239   18.787  14.156 0.6595 13.694 0.6859 0.4615746      0.9515763 
1 1 1 6  5  2  o 12.004 0.4852 144.715  11.638  137.219   16.426  152.272   16.492  11.690 0.7025 12.317 0.6695 -0.6268158     0.9704250 
1 1 1 6  5  3  o 2.8560 0.7295 6.8183   5.3507  6.0409    7.5035  7.6227    7.6323  2.7688 1.0236 2.9432 1.0397 -0.1743877     1.458993  
1 1 1 6  5  4  o 21.109 0.4768 447.423  20.128  453.333   28.518  441.557   28.412  21.248 0.6711 20.969 0.6775 0.2785988      0.9535729 
1 1 1 6  5  5  o 26.816 0.4942 721.938  26.503  713.080   37.525  730.753   37.436  26.651 0.7040 26.981 0.6938 -0.3297787     0.9884006 
1 1 1 6  5  6  o 5.0632 0.6910 26.514   6.8235  22.106    9.7378  30.766    9.5644  4.5932 1.0785 5.5333 0.8643 -0.9400930     1.382029  
1 1 1 6  5  7  o 8.9091 0.5233 79.732   9.3191  82.231    13.105  77.174    13.255  9.0512 0.7239 8.7670 0.7559 0.2842226      1.046671  
1 1 1 6  5  8  o 19.366 0.4800 376.089  18.592  377.190   26.322  374.992   26.264  19.394 0.6786 19.338 0.6791 0.5664063E-01  0.9600224 
1 1 1 6  5  9  o 20.308 0.6051 421.064  22.925  395.023   39.840  433.956   28.032  19.813 1.0054 20.802 0.6738 -0.9889927     1.210248  
1 1 1 6  5  10 o 11.075 0.4970 123.078  11.008  123.338   15.502  122.813   15.634  11.087 0.6991 11.063 0.7066 0.2403355E-01  0.9940148 
1 1 1 6  5  11 o 28.100 0.5063 793.156  28.450  797.539   40.480  788.877   39.993  28.177 0.7183 28.024 0.7136 0.1525745      1.012502  
1 1 1 6  5  12 o 16.837 0.6189 283.960  19.400  281.039   23.432  290.327   34.593  16.723 0.7006 16.951 1.0203 -0.2279835     1.237707  
1 1 1 6  5  13 o 18.201 0.4919 333.269  17.895  336.113   25.793  330.628   24.849  18.274 0.7057 18.128 0.6854 0.1463966      0.9837565 
1 1 1 6  5  14 o 12.589 0.5697 158.169  14.116  148.407   18.175  173.009   22.408  12.117 0.7500 13.061 0.8578 -0.9442673     1.139453  
1 1 1 6  5  15 o 14.680 0.6695 228.358  18.236  199.955   31.259  243.013   22.454  13.888 1.1254 15.471 0.7256 -1.583239      1.339062  
1 1 1 6  5  16 o 4.5399 1.3225 22.148   12.741  0.0000    0.0000  22.148    12.741  ?      ?      4.5399 1.3225 ?              ?         
1 1 1 6  5  17 o 4.9965 0.9637 27.000   9.8303  32.112    15.171  23.300    12.907  5.3773 1.3977 4.6158 1.3272 0.7615438      1.927468  
1 1 1 6  5  18 o 4.7987 1.1499 24.446   12.734  22.866    15.839  27.334    21.411  4.5851 1.4997 5.0124 1.7435 -0.4273386     2.299699  
1 1 1 6  5  19 o 14.735 0.5923 224.346  17.413  235.104   25.715  215.235   23.665  15.049 0.8544 14.420 0.8206 0.6294765      1.184592  
1 1 1 6  5  20 o 8.0037 0.7711 67.121   12.165  74.255    19.217  62.351    15.714  8.3242 1.1543 7.6832 1.0226 0.6409397      1.542116  
1 1 1 6  5  21 o 7.9117 0.8304 66.601   13.007  75.429    20.222  60.372    16.987  8.3316 1.2136 7.4918 1.1337 0.8397026      1.660738  
1 1 1 6  5  22 o 9.5480 0.7513 95.205   14.239  108.835   21.801  85.065    18.805  10.128 1.0762 8.9675 1.0485 1.160977       1.502539  
1 1 1 6  5  23 f 4.5464 0.9669 20.449   12.146  -7.7047   18.337  42.457    16.213  2.9999 1.3705 6.0930 1.3644 -3.093125      1.933822  
1 1 1 6  5  24 o 12.822 0.6928 173.143  17.621  161.985   26.065  182.536   23.914  12.396 1.0513 13.249 0.9025 -0.8527632     1.385591  
1 1 1 6  5  25 o 12.976 0.7255 179.576  18.598  158.876   27.331  197.426   25.380  12.208 1.1195 13.745 0.9232 -1.537639      1.451053  
1 1 1 6  5  26 f 13.790 0.7138 202.562  19.428  177.666   28.538  224.065   26.522  12.922 1.1043 14.657 0.9047 -1.735252      1.427569  
1 1 1 6  5  27 o 3.9912 1.0404 4.0937   14.477  -33.4347  21.392  35.807    19.665  2.5686 1.2556 5.4138 1.6592 -2.845178      2.080760  
1 1 1 6  5  28 o 9.0707 0.8803 93.180   15.688  95.424    20.615  90.091    24.183  9.3086 1.1073 8.8328 1.3689 0.4758205      1.760696  
1 1 1 6  5  29 f 4.3289 1.0766 23.466   11.305  24.291    18.898  23.006    14.108  4.3649 1.6223 4.2930 1.4159 0.7189322E-01  2.153247  
1 1 1 6  5  30 o 2.8119 0.8967 -1.2593  11.107  -15.7973  18.802  6.5330    13.766  2.5844 1.2426 3.0393 1.2932 -0.4548521     1.793390  
1 1 1 6  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  6  0  o 13.017 0.6993 173.642  17.869  191.827   25.235  155.355   25.306  13.731 0.9287 12.304 1.0458 -0.000000      0.000000  
1 1 1 6  6  1  o 8.2775 0.5406 69.267   8.8943  76.801    12.440  61.388    12.721  8.7435 0.7114 7.8115 0.8143 0.9320016      1.081265  
1 1 1 6  6  2  o 12.665 0.4839 161.089  12.255  164.083   17.395  158.138   17.269  12.783 0.6804 12.548 0.6881 0.2343054      0.9677147 
1 1 1 6  6  3  o 24.085 0.4848 582.401  23.352  578.561   33.007  586.249   33.044  24.005 0.6875 24.165 0.6837 -0.1594810     0.9695924 
1 1 1 6  6  4  o 12.848 0.4866 165.635  12.489  176.326   17.784  155.231   17.544  13.258 0.6707 12.438 0.7052 0.8203773      0.9732293 
1 1 1 6  6  5  o 34.090 0.5232 1166.39  35.666  1149.27   50.369  1183.60   50.509  33.838 0.7443 34.341 0.7354 -0.5031815     1.046301  
1 1 1 6  6  6  f 13.659 0.4824 187.168  13.176  185.336   18.589  189.017   18.679  13.591 0.6839 13.726 0.6804 -0.1345415     0.9647029 
1 1 1 6  6  7  o 7.8215 0.5582 61.686   8.6913  67.119    12.129  55.951    12.460  8.1788 0.7415 7.4641 0.8347 0.7147388      1.116469  
1 1 1 6  6  8  o 34.906 0.5296 1222.48  36.975  1227.89   52.343  1217.08   52.238  34.983 0.7481 34.829 0.7499 0.1546135      1.059270  
1 1 1 6  6  9  o 12.149 0.4975 148.072  12.086  151.690   17.187  144.533   16.998  12.296 0.6989 12.002 0.7082 0.2941217      0.9949797 
1 1 1 6  6  10 o 10.112 0.5092 102.680  10.297  103.271   14.638  102.100   14.489  10.140 0.7218 10.083 0.7185 0.5744934E-01  1.018392  
1 1 1 6  6  11 o 6.9072 0.6091 47.948   8.4046  50.515    12.237  45.656    11.563  7.0817 0.8640 6.7328 0.8587 0.3488684      1.218154  
1 1 1 6  6  12 o 17.831 0.5713 318.169  19.682  312.596   24.719  327.822   32.532  17.634 0.7009 18.027 0.9023 -0.3933887     1.142540  
1 1 1 6  6  13 o 27.089 0.5048 740.087  27.349  748.980   38.952  731.441   38.408  27.249 0.7147 26.929 0.7131 0.3204098      1.009665  
1 1 1 6  6  14 o 10.059 0.5350 102.824  10.717  94.188    15.388  110.959   14.935  9.6403 0.7981 10.478 0.7127 -0.8372335     1.070001  
1 1 1 6  6  15 o 14.213 0.5029 205.491  14.287  203.476   20.513  207.390   19.910  14.140 0.7253 14.285 0.6969 -0.1448669     1.005858  
1 1 1 6  6  16 o 10.110 0.5414 105.352  10.837  91.897    15.708  117.573   14.970  9.4701 0.8293 10.750 0.6963 -1.279881      1.082849  
1 1 1 6  6  17 o 6.2988 0.8973 44.741   10.916  33.178    16.513  53.715    14.548  5.4214 1.4810 7.1763 1.0136 -1.754858      1.794632  
1 1 1 6  6  18 o 5.7578 0.9645 37.364   10.843  35.401    16.811  38.762    14.188  5.5822 1.4812 5.9333 1.2358 -0.3511138     1.929056  
1 1 1 6  6  19 o 2.3137 0.7645 -9.2585  8.4981  -17.2969  14.892  -5.3772   10.348  2.3606 1.1271 2.2669 1.0332 0.9372258E-01  1.529042  
1 1 1 6  6  20 f 3.9171 0.9334 15.751   10.102  -4.0824   17.180  26.234    12.490  3.0300 1.3609 4.8041 1.2777 -1.774086      1.866723  
1 1 1 6  6  21 o 4.9190 1.1003 26.804   12.007  35.790    19.144  20.977    15.416  5.4799 1.6280 4.3581 1.4807 1.121749       2.200632  
1 1 1 6  6  22 o 11.299 0.7177 132.377  16.078  157.439   24.589  113.658   21.250  12.223 1.0059 10.375 1.0241 1.847284       1.435466  
1 1 1 6  6  23 o 6.8300 1.0273 54.323   13.565  47.490    21.481  58.856    17.495  6.2818 1.6780 7.3781 1.1856 -1.096310      2.054543  
1 1 1 6  6  24 o 4.7909 1.0366 25.100   13.286  -3.9191   21.349  43.443    16.974  3.4044 1.5239 6.1773 1.4055 -2.772879      2.073125  
1 1 1 6  6  25 o 10.987 0.8027 129.567  17.521  126.167   26.075  132.366   23.657  10.809 1.2062 11.166 1.0593 -0.3572989     1.605353  
1 1 1 6  6  26 f 5.4775 1.2061 36.408   15.013  27.130    22.489  43.867    20.165  4.9043 1.7784 6.0506 1.6298 -1.146310      2.412285  
1 1 1 6  6  27 o 4.8736 1.2306 26.148   15.597  40.268    23.393  14.848    20.928  5.6384 1.8210 4.1089 1.6557 1.529535       2.461204  
1 1 1 6  6  28 o 14.236 0.7415 222.042  21.062  221.657   30.796  222.380   28.869  14.179 1.0860 14.292 1.0100 -0.1131468     1.483019  
1 1 1 6  6  29 o 5.3306 1.2669 39.085   17.000  60.668    25.282  21.274    22.967  6.4428 1.8590 4.2184 1.7218 2.224425       2.533842  
1 1 1 6  6  30 o 3.8205 1.0597 18.682   11.518  17.322    20.333  19.325    13.977  3.7905 1.5900 3.8505 1.4012 -0.5997753E-01 2.119303  
1 1 1 6  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  7  0  f 36.808 0.7616 1363.65  55.952  1392.76   79.369  1334.89   78.890  37.201 1.0688 36.414 1.0854 -0.000000      0.000000  
1 1 1 6  7  1  o 7.4479 0.5849 55.675   8.6728  48.733    12.032  63.183    12.512  6.9635 0.8639 7.9322 0.7887 -0.9687171     1.169803  
1 1 1 6  7  2  o 15.853 0.4776 252.071  15.141  247.843   21.391  256.316   21.434  15.719 0.6804 15.986 0.6704 -0.2671576     0.9551822 
1 1 1 6  7  3  o 22.750 0.4818 519.193  21.923  526.826   31.018  511.574   30.989  22.918 0.6767 22.583 0.6861 0.3351383      0.9636948 
1 1 1 6  7  4  o 25.515 0.4892 653.253  24.963  657.085   35.269  649.405   35.337  25.590 0.6891 25.440 0.6945 0.1506653      0.9783912 
1 1 1 6  7  5  o 9.6079 0.5272 93.003   10.086  102.130   14.172  83.637    14.356  10.089 0.7023 9.1265 0.7865 0.9628382      1.054461  
1 1 1 6  7  6  o 20.992 0.4817 441.937  20.220  449.841   28.512  433.939   28.680  21.181 0.6731 20.802 0.6894 0.3791180      0.9634454 
1 1 1 6  7  7  o 31.493 0.5140 994.815  32.371  972.898   45.558  1017.16   46.003  31.142 0.7315 31.844 0.7223 -0.7017937     1.028013  
1 1 1 6  7  8  o 8.9970 0.5333 81.319   9.5884  84.731    13.514  77.860    13.607  9.1880 0.7354 8.8059 0.7726 0.3820887      1.066639  
1 1 1 6  7  9  f 11.582 0.5085 134.762  11.763  143.780   16.704  125.890   16.568  11.968 0.6979 11.196 0.7399 0.7719326      1.017090  
1 1 1 6  7  10 o 9.0323 0.6125 81.432   10.836  78.699    13.872  85.708    17.355  8.8455 0.7841 9.2191 0.9412 -0.3736572     1.225057  
1 1 1 6  7  11 o 16.945 0.4878 288.416  16.527  292.840   23.707  284.233   23.053  17.071 0.6944 16.819 0.6853 0.2516689      0.9756159 
1 1 1 6  7  12 o 17.647 0.4889 313.564  17.239  331.948   24.550  295.681   24.213  18.160 0.6759 17.134 0.7066 1.025896       0.9778321 
1 1 1 6  7  13 o 10.749 0.5317 117.293  11.372  105.139   16.216  129.055   15.953  10.191 0.7956 11.306 0.7055 -1.114429      1.063325  
1 1 1 6  7  14 o 15.594 0.5010 246.802  15.616  237.161   22.049  256.504   22.120  15.284 0.7213 15.903 0.6955 -0.6195011     1.001985  
1 1 1 6  7  15 o 11.905 0.5240 144.124  12.461  151.537   17.552  136.591   17.694  12.220 0.7182 11.590 0.7633 0.6292124      1.048066  
1 1 1 6  7  16 o 8.1322 0.5850 68.774   9.3665  57.494    13.607  78.933    12.913  7.4679 0.9110 8.7965 0.7340 -1.328673      1.169905  
1 1 1 6  7  17 o 3.0524 0.9429 2.2954   7.7040  2.7492    8.2263  -0.9419   21.971  2.5082 1.0279 3.5967 1.5812 -1.088475      1.885893  
1 1 1 6  7  18 o 5.4291 1.0343 22.049   9.4894  14.697    10.374  59.725    23.485  3.7278 1.2134 7.1304 1.6753 -3.402574      2.068530  
1 1 1 6  7  19 o 4.3367 1.1401 18.044   14.349  28.559    17.693  -2.1682   24.529  4.9863 1.5809 3.6871 1.6432 1.299152       2.280186  
1 1 1 6  7  20 o 8.2803 0.8200 72.981   13.439  81.566    20.908  66.938    17.543  8.6638 1.2066 7.8968 1.1107 0.7670503      1.640031  
1 1 1 6  7  21 o 4.2189 1.0423 18.709   11.514  6.3928    18.694  26.238    14.615  3.6358 1.5248 4.8019 1.4215 -1.166037      2.084668  
1 1 1 6  7  22 o 7.0155 1.0273 56.716   13.952  50.502    21.656  61.126    18.243  6.5118 1.6583 7.5193 1.2131 -1.007482      2.054669  
1 1 1 6  7  23 o 4.5974 1.0600 22.410   13.032  -0.2894   20.596  37.568    16.830  3.4839 1.5313 5.7109 1.4661 -2.227031      2.119925  
1 1 1 6  7  24 o 9.1822 0.9713 97.908   16.303  71.337    25.032  117.480   21.483  7.8044 1.6551 10.560 1.0172 -2.755682      1.942646  
1 1 1 6  7  25 o 9.7362 0.8756 102.770  16.875  103.368   25.733  102.318   22.351  9.7052 1.3257 9.7671 1.1442 -0.6183624E-01 1.751224  
1 1 1 6  7  26 o 4.8444 1.2209 27.226   14.937  23.209    23.518  29.941    19.338  4.6687 1.7929 5.0201 1.6578 -0.3513341     2.441876  
1 1 1 6  7  27 o 6.7812 1.1556 54.280   15.796  80.269    24.590  36.019    20.612  8.1875 1.5586 5.3749 1.7066 2.812613       2.311188  
1 1 1 6  7  28 o 11.259 0.9326 153.877  19.963  116.702   29.897  183.789   26.818  9.6689 1.5461 12.850 1.0435 -3.180662      1.865279  
1 1 1 6  7  29 f 4.1526 1.1794 19.473   16.124  2.5313    23.540  34.450    22.132  3.4467 1.5661 4.8585 1.7639 -1.411828      2.358812  
1 1 1 6  7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  7  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  8  0  o 9.1365 0.8464 89.428   14.186  106.534   19.843  71.544    20.289  10.160 0.9987 8.1134 1.3669 -0.000000      0.000000  
1 1 1 6  8  1  o 26.884 0.4948 725.278  26.604  730.309   37.590  720.229   37.659  26.977 0.6967 26.790 0.7029 0.1876411      0.9896449 
1 1 1 6  8  2  o 12.433 0.4928 155.233  12.246  159.939   17.167  150.357   17.472  12.626 0.6798 12.240 0.7137 0.3860807      0.9856712 
1 1 1 6  8  3  o 12.577 0.4968 158.751  12.492  161.100   17.525  156.326   17.810  12.673 0.6915 12.482 0.7134 0.1904287      0.9935275 
1 1 1 6  8  4  o 28.749 0.5027 829.115  28.902  837.426   40.823  820.761   40.926  28.894 0.7064 28.604 0.7154 0.2900600      1.005383  
1 1 1 6  8  5  o 24.327 0.4886 593.457  23.772  586.086   33.588  600.855   33.651  24.176 0.6947 24.479 0.6873 -0.3034248     0.9772292 
1 1 1 6  8  6  o 6.9897 0.6051 49.517   8.3288  59.772    11.829  39.435    11.729  7.7169 0.7664 6.2624 0.9364 1.454536       1.210114  
1 1 1 6  8  7  o 41.636 0.5641 1741.16  46.968  1715.38   66.288  1767.15   66.559  41.326 0.8020 41.947 0.7934 -0.6209831     1.128139  
1 1 1 6  8  8  o 12.130 0.7183 145.958  17.282  169.390   26.532  128.689   22.777  12.961 1.0235 11.299 1.0080 1.662540       1.436542  
1 1 1 6  8  9  o 16.856 0.4865 285.421  16.400  292.052   23.211  278.811   23.174  17.053 0.6806 16.660 0.6955 0.3926525      0.9730830 
1 1 1 6  8  10 o 4.7400 0.7909 24.045   7.5025  16.826    10.881  30.587    10.358  4.0588 1.2323 5.4211 0.9919 -1.362361      1.581889  
1 1 1 6  8  11 o 16.304 0.6328 272.750  19.021  279.910   23.011  257.302   33.799  16.680 0.6898 15.927 1.0610 0.7529716      1.265545  
1 1 1 6  8  12 o 2.3315 0.6634 -2.3919  5.3996  8.4901    8.2883  -10.4160  7.1172  3.0696 1.0835 1.5934 0.7657 1.476113       1.326789  
1 1 1 6  8  13 o 11.663 0.5381 137.999  12.538  130.647   17.715  145.377   17.747  11.347 0.7806 11.978 0.7408 -0.6311922     1.076159  
1 1 1 6  8  14 o 8.2610 0.5984 69.968   9.8583  76.003    13.947  63.942    13.936  8.6259 0.8084 7.8960 0.8825 0.7298551      1.196817  
1 1 1 6  8  15 o 17.991 0.5036 329.745  18.121  324.079   25.494  335.529   25.761  17.834 0.7148 18.148 0.7097 -0.3146763     1.007293  
1 1 1 6  8  16 o 14.988 0.5208 229.903  15.599  238.641   21.960  221.002   22.164  15.284 0.7184 14.692 0.7543 0.5915928      1.041652  
1 1 1 6  8  17 o 5.9080 1.1187 38.036   11.867  36.591    13.438  43.157    25.292  5.7749 1.2026 6.0411 1.8867 -0.2661934     2.237385  
1 1 1 6  8  18 f 3.4238 0.9437 10.258   8.2575  13.115    8.8931  -7.6119   22.242  3.5122 1.1216 3.3353 1.5181 0.1768970      1.887494  
1 1 1 6  8  19 o 5.9987 1.0816 38.846   10.783  37.517    11.838  45.315    26.125  5.9606 0.9930 6.0367 1.9218 -0.7602310E-01 2.163192  
1 1 1 6  8  20 o 6.9139 1.0868 56.656   12.124  57.624    13.471  52.531    27.814  7.4115 0.9088 6.4162 1.9744 0.9953542      2.173504  
1 1 1 6  8  21 o 15.820 0.7709 270.399  20.140  274.471   22.957  256.790   41.963  16.356 0.7018 15.283 1.3729 1.072996       1.541828  
1 1 1 6  8  22 o 5.5264 1.0842 31.520   13.448  60.133    21.461  13.024    17.255  7.1669 1.5429 3.8858 1.5237 3.281181       2.168440  
1 1 1 6  8  23 o 8.6441 0.9648 83.967   15.765  73.205    24.256  91.838    20.744  7.9843 1.5749 9.3039 1.1148 -1.319607      1.929554  
1 1 1 6  8  24 o 6.3378 1.1716 47.265   14.895  49.691    22.870  45.479    19.628  6.4380 1.7364 6.2377 1.5735 0.2002764      2.343272  
1 1 1 6  8  25 o 11.091 0.8498 134.710  18.369  116.402   27.916  148.689   24.393  10.309 1.3539 11.873 1.0273 -1.563392      1.699521  
1 1 1 6  8  26 o 6.0956 1.1629 44.463   15.747  69.051    22.930  22.519    21.662  7.6253 1.5562 4.5659 1.7285 3.059494       2.325839  
1 1 1 6  8  27 o 4.1267 1.1976 14.339   15.441  21.382    25.004  9.9975    19.631  4.5021 1.8113 3.7514 1.5672 0.7506902      2.395178  
1 1 1 6  8  28 o 6.4878 1.2213 61.232   17.194  40.178    25.849  77.939    23.026  5.1820 1.9025 7.7935 1.5319 -2.611458      2.442564  
1 1 1 6  8  29 o 5.5104 1.3209 45.971   17.546  65.163    27.325  32.505    22.888  6.3548 1.9572 4.6660 1.7743 1.688743       2.641709  
1 1 1 6  8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  9  0  o 36.315 0.7619 1326.84  55.217  1298.29   78.015  1355.50   78.164  35.920 1.0882 36.710 1.0667 -0.000000      0.000000  
1 1 1 6  9  1  o 46.151 0.5892 2138.57  54.388  2146.59   76.975  2130.56   76.858  46.238 0.8324 46.064 0.8342 0.1733971      1.178487  
1 1 1 6  9  2  o 14.397 0.4931 208.341  14.162  193.659   20.196  222.546   19.865  13.895 0.7267 14.899 0.6667 -1.003892      0.9861827 
1 1 1 6  9  3  o 17.737 0.4872 315.490  17.280  308.467   24.420  322.533   24.455  17.539 0.6962 17.935 0.6818 -0.3964596     0.9744170 
1 1 1 6  9  4  o 10.865 0.5257 118.455  11.424  117.895   16.057  119.029   16.257  10.839 0.7407 10.891 0.7463 -0.5171871E-01 1.051478  
1 1 1 6  9  5  o 34.993 0.5307 1229.16  37.143  1236.51   52.589  1221.84   52.467  35.098 0.7492 34.888 0.7519 0.2092628      1.061444  
1 1 1 6  9  6  o 32.760 0.6330 1078.08  39.275  1075.30   48.308  1083.51   67.456  32.728 0.7380 32.792 1.0285 -0.6447220E-01 1.265929  
1 1 1 6  9  7  o 25.729 0.4961 664.674  25.525  659.819   36.009  669.578   36.188  25.634 0.7024 25.823 0.7007 -0.1891289     0.9921095 
1 1 1 6  9  8  o 29.108 0.5087 851.433  29.611  861.988   41.996  840.996   41.759  29.288 0.7169 28.928 0.7218 0.3597698      1.017331  
1 1 1 6  9  9  o 10.326 0.5471 107.264  11.297  109.119   16.037  105.437   15.917  10.415 0.7699 10.237 0.7774 0.1778135      1.094120  
1 1 1 6  9  10 o 16.237 0.4989 265.352  16.179  282.651   22.986  248.367   22.776  16.765 0.6856 15.710 0.7249 1.054828       0.9977421 
1 1 1 6  9  11 o 9.1745 0.5696 85.156   10.451  83.873    14.740  86.453    14.821  9.1045 0.8095 9.2445 0.8016 -0.1399794     1.139240  
1 1 1 6  9  12 o 12.105 0.5350 148.517  12.932  155.867   18.147  140.933   18.435  12.415 0.7309 11.796 0.7814 0.6191320      1.069951  
1 1 1 6  9  13 o 8.0377 0.6200 66.322   9.9546  63.016    14.127  69.583    14.029  7.8327 0.9018 8.2427 0.8510 -0.4099965     1.239955  
1 1 1 6  9  14 o 11.545 0.5609 136.820  12.825  156.812   18.026  116.327   18.251  12.423 0.7255 10.666 0.8555 1.756136       1.121733  
1 1 1 6  9  15 o 3.2637 0.8043 9.9586   6.6916  4.9712    10.048  13.933    8.9698  2.8888 1.1532 3.6386 1.1215 -0.7497938     1.608582  
1 1 1 6  9  16 o 15.935 0.4888 257.730  15.362  250.429   19.999  268.234   23.990  15.686 0.6375 16.185 0.7411 -0.4984360     0.9775870 
1 1 1 6  9  17 o 3.9391 1.0485 8.2428   7.9667  5.2905    8.4961  29.743    22.927  2.7381 1.0704 5.1402 1.8032 -2.402101      2.096982  
1 1 1 6  9  18 o 7.4010 1.0624 67.885   11.848  71.197    13.086  52.831    27.902  8.3009 0.7882 6.5011 1.9731 1.799727       2.124748  
1 1 1 6  9  19 o 11.518 0.8380 152.228  15.396  159.412   17.526  127.940   32.227  12.441 0.7044 10.596 1.5207 1.845068       1.675911  
1 1 1 6  9  20 o 6.9687 1.1286 64.880   12.589  69.672    13.753  40.108    31.271  8.1890 0.8397 5.7484 2.0952 2.440577       2.257220  
1 1 1 6  9  21 o 6.9103 1.0843 50.330   12.010  47.572    13.281  62.701    28.132  6.7224 0.9878 7.0983 1.9305 -0.3758860     2.168563  
1 1 1 6  9  22 o 13.344 0.8223 183.312  17.756  177.630   19.862  205.921   39.623  13.120 0.7569 13.568 1.4601 -0.4479027     1.644664  
1 1 1 6  9  23 o 10.019 1.1585 114.981  21.105  114.251   25.798  116.459   36.700  10.272 1.2557 9.7667 1.9471 0.5056047      2.316923  
1 1 1 6  9  24 o 5.5585 1.1543 29.722   15.190  64.811    24.568  8.0092    19.326  7.3663 1.7018 3.7506 1.5599 3.615681       2.308572  
1 1 1 6  9  25 o 4.8575 1.2274 25.996   14.902  32.055    23.324  21.817    19.371  5.2072 1.8192 4.5078 1.6481 0.6994047      2.454742  
1 1 1 6  9  26 o 5.4391 1.1751 30.422   15.788  63.800    24.633  7.1512    20.568  7.1573 1.7382 3.7209 1.5819 3.436338       2.350214  
1 1 1 6  9  27 o 5.3155 1.2040 36.850   16.266  14.437    24.967  53.381    21.442  4.1548 1.7534 6.4762 1.6506 -2.321445      2.408045  
1 1 1 6  9  28 o 7.4751 1.1857 79.423   18.274  48.997    27.510  103.454   24.448  5.6350 1.9753 9.3152 1.3123 -3.680222      2.371463  
1 1 1 6  9  29 o 4.7836 1.3113 34.452   17.988  56.285    28.684  20.300    23.093  5.5878 2.0111 3.9794 1.6832 1.608375       2.622530  
1 1 1 6  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  10 0  o 26.155 0.7084 689.283  36.918  715.877   52.498  663.264   51.927  26.659 0.9877 25.651 1.0158 -0.000000      0.000000  
1 1 1 6  10 1  o 33.534 0.5240 1128.62  35.143  1119.69   49.697  1137.56   49.704  33.401 0.7439 33.667 0.7382 -0.2663307     1.048011  
1 1 1 6  10 2  o 27.980 0.6161 785.997  32.567  789.690   56.229  784.132   39.951  28.007 1.0039 27.954 0.7146 0.5223846E-01  1.232205  
1 1 1 6  10 3  o 25.585 0.4977 656.807  25.467  651.111   35.961  662.537   36.071  25.473 0.7059 25.696 0.7019 -0.2230492     0.9954180 
1 1 1 6  10 4  o 13.998 0.5904 194.785  15.914  189.224   19.842  204.814   26.646  13.730 0.7226 14.266 0.9339 -0.5364571     1.180770  
1 1 1 6  10 5  o 24.858 0.4955 620.345  24.631  611.975   34.789  628.758   34.879  24.689 0.7045 25.026 0.6968 -0.3373127     0.9909430 
1 1 1 6  10 6  o 14.511 0.5030 211.518  14.598  209.804   20.592  213.250   20.698  14.452 0.7124 14.570 0.7103 -0.1183996     1.006037  
1 1 1 6  10 7  o 3.2023 0.7557 6.2388   6.6916  18.394    9.8058  -4.3554   9.1545  4.1939 1.1394 2.2107 0.9931 1.983214       1.511492  
1 1 1 6  10 8  o 30.723 0.5210 949.022  32.010  931.642   45.031  966.775   45.510  30.438 0.7397 31.008 0.7339 -0.5699596     1.041976  
1 1 1 6  10 9  o 10.596 0.5603 112.978  11.862  105.849   16.434  120.730   17.137  10.247 0.8019 10.946 0.7828 -0.6986732     1.120669  
1 1 1 6  10 10 o 10.675 0.5679 115.898  11.999  135.798   17.056  96.396    16.885  11.597 0.7354 9.7527 0.8656 1.844306       1.135828  
1 1 1 6  10 11 o 13.827 0.5319 193.669  14.684  204.833   20.659  182.268   20.876  14.236 0.7256 13.419 0.7779 0.8176193      1.063758  
1 1 1 6  10 12 o 2.6818 0.7775 0.5948   7.0839  8.4042    10.315  -6.3773   9.7459  3.1969 1.1965 2.1667 0.9933 1.030177       1.555032  
1 1 1 6  10 13 o 13.122 0.5479 175.817  14.307  193.970   20.121  157.255   20.347  13.822 0.7278 12.421 0.8191 1.401505       1.095726  
1 1 1 6  10 14 o 10.544 0.5757 113.981  12.140  116.242   17.196  111.735   17.141  10.650 0.8073 10.438 0.8211 0.2128515      1.151492  
1 1 1 6  10 15 o 9.5699 0.5981 94.634   11.429  99.614    16.060  89.524    16.268  9.8354 0.8164 9.3043 0.8742 0.5310907      1.196168  
1 1 1 6  10 16 o 7.7200 0.6121 61.251   9.3981  52.859    12.811  71.031    13.830  7.1415 0.8969 8.2985 0.8333 -1.156986      1.224255  
1 1 1 6  10 17 o 9.0071 0.9870 90.205   13.106  90.028    14.516  90.985    30.482  9.3341 0.7776 8.6801 1.8143 0.6539364      1.973901  
1 1 1 6  10 18 f 14.022 0.7713 219.005  17.259  226.073   19.538  193.908   36.817  14.849 0.6579 13.194 1.3952 1.654623       1.542526  
1 1 1 6  10 19 o 3.8424 1.1217 6.9420   9.9819  4.5119    10.713  22.938    27.486  2.8762 1.1752 4.8086 1.9111 -1.932411      2.243483  
1 1 1 6  10 20 o 12.783 0.8206 178.136  16.780  180.673   18.913  168.751   36.372  13.265 0.7129 12.302 1.4783 0.9633369      1.641238  
1 1 1 6  10 21 o 9.3358 1.0790 97.342   14.501  96.112    15.921  103.330   35.123  9.6128 0.8281 9.0587 1.9928 0.5540981      2.157974  
1 1 1 6  10 22 o 7.5861 1.1521 73.049   13.578  77.293    14.985  53.578    32.095  8.6343 0.8678 6.5378 2.1345 2.096527       2.304190  
1 1 1 6  10 23 o 5.3359 1.2629 30.184   12.329  29.816    13.153  32.846    35.376  5.1508 1.2819 5.5210 2.1763 -0.3702221     2.525805  
1 1 1 6  10 24 o 10.020 1.1815 127.657  16.510  134.412   18.261  97.409    38.639  11.400 0.8009 8.6404 2.2231 2.759733       2.362966  
1 1 1 6  10 25 o 7.4247 1.5019 67.521   21.919  55.228    26.092  96.995    40.403  6.5696 1.8865 8.2798 2.3375 -1.710199      3.003790  
1 1 1 6  10 26 o 4.3658 1.2295 18.929   16.401  9.2084    26.548  24.929    20.858  4.0897 1.7687 4.6420 1.7082 -0.5522866     2.458906  
1 1 1 6  10 27 o 3.1143 1.0243 -8.2081  15.627  -19.9899  24.787  -0.4358   20.132  2.9917 1.4353 3.2368 1.4617 -0.2450857     2.048572  
1 1 1 6  10 28 o 5.1092 1.3079 36.552   17.831  59.962    27.627  19.838    23.345  6.1205 1.9792 4.0979 1.7102 2.022554       2.615736  
1 1 1 6  10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  10 34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  11 0  o 3.3029 1.7062 16.114   14.480  16.114    14.480  0.0000    0.0000  3.3029 1.7062 3.3029 1.7062 -0.000000      0.000000  
1 1 1 6  11 1  o 26.101 0.4990 683.986  26.047  689.507   36.745  678.409   36.929  26.208 0.7010 25.995 0.7103 0.2131157      0.9979817 
1 1 1 6  11 2  o 22.167 0.4936 493.356  21.882  494.882   30.812  491.804   31.081  22.203 0.6939 22.132 0.7022 0.7019043E-01  0.9871807 
1 1 1 6  11 3  o 9.1460 0.5828 84.830   10.537  70.227    14.938  99.290    14.865  8.3514 0.8943 9.9405 0.7477 -1.589092      1.165691  
1 1 1 6  11 4  o 8.8060 0.5945 77.926   10.388  91.891    15.082  65.324    14.327  9.5588 0.7889 8.0532 0.8895 1.505588       1.188982  
1 1 1 6  11 5  o 25.048 0.5013 630.523  25.099  657.524   35.644  603.970   35.348  25.582 0.6967 24.514 0.7210 1.068003       1.002558  
1 1 1 6  11 6  o 18.540 0.4985 345.488  18.482  338.913   26.196  352.004   26.079  18.363 0.7133 18.716 0.6967 -0.3534584     0.9970679 
1 1 1 6  11 7  f 7.7786 0.6470 61.019   10.049  56.437    14.034  65.840    14.396  7.4773 0.9384 8.0799 0.8908 -0.6026282     1.293922  
1 1 1 6  11 8  o 28.442 0.5170 815.029  29.410  817.457   41.412  812.560   41.773  28.486 0.7269 28.398 0.7355 0.8794022E-01  1.034093  
1 1 1 6  11 9  o 13.070 0.5449 173.132  14.141  199.226   20.199  148.047   19.805  14.047 0.7190 12.092 0.8189 1.955132       1.089732  
1 1 1 6  11 10 o 3.6761 0.8874 12.159   9.5600  22.185    10.620  -30.6715  21.950  4.5607 1.1612 2.7915 1.3423 1.769130       1.774856  
1 1 1 6  11 11 o 15.262 0.5285 236.932  16.116  251.921   23.060  222.621   22.532  15.738 0.7326 14.785 0.7620 0.9536695      1.057048  
1 1 1 6  11 12 o 5.0351 0.8800 27.554   8.8638  23.294    12.588  31.745    12.484  4.6429 1.3026 5.4273 1.1834 -0.7844572     1.759915  
1 1 1 6  11 13 o 8.7724 0.6374 79.524   11.136  70.883    15.664  88.354    15.834  8.2760 0.9463 9.2688 0.8542 -0.9927893     1.274825  
1 1 1 6  11 14 o 4.9957 0.8834 27.881   8.9719  34.711    12.462  20.532    12.927  5.6470 1.1426 4.3443 1.3476 1.302645       1.766799  
1 1 1 6  11 15 o 18.437 0.5225 348.074  19.258  349.194   26.845  346.886   27.642  18.474 0.7265 18.399 0.7512 0.7548714E-01  1.045064  
1 1 1 6  11 16 o 8.4975 0.9986 82.567   12.738  83.858    14.216  77.312    28.688  9.0091 0.7890 7.9858 1.8348 1.023297       1.997212  
1 1 1 6  11 17 o 7.8824 0.8909 53.198   11.880  42.519    13.200  98.723    27.256  6.3402 1.0410 9.4247 1.4460 -3.084542      1.781720  
1 1 1 6  11 18 o 11.935 0.9818 179.265  16.753  194.630   18.955  124.402   35.818  13.759 0.6888 10.111 1.8389 3.648110       1.963691  
1 1 1 6  11 19 o 6.2334 1.1341 38.184   11.766  33.009    13.016  61.310    27.516  5.4346 1.2266 7.0323 1.9079 -1.597770      2.268187  
1 1 1 6  11 20 o 14.601 0.8120 238.629  18.763  246.659   21.195  209.534   40.343  15.510 0.6833 13.691 1.4733 1.819026       1.624044  
1 1 1 6  11 21 o 3.8852 1.1102 11.833   9.9738  12.591    10.596  5.9409    29.547  3.5237 1.2264 4.2467 1.8511 -0.7230351     2.220483  
1 1 1 6  11 22 o 11.533 0.9351 143.392  16.877  142.386   18.801  147.567   38.294  11.737 0.8009 11.330 1.6900 0.4073048      1.870167  
1 1 1 6  11 23 o 3.7299 1.0870 10.623   10.512  13.564    11.112  -14.4479  32.443  3.6355 1.2565 3.8243 1.7742 -0.1887968     2.174050  
1 1 1 6  11 24 o 7.5342 1.2323 57.359   14.090  52.423    15.259  85.937    36.715  7.0102 1.0883 8.0581 2.2113 -1.047895      2.464582  
1 1 1 6  11 25 o 5.9716 1.3358 27.821   12.755  20.549    13.556  83.949    37.661  4.2572 1.3871 7.6861 2.2833 -3.428893      2.671651  
1 1 1 6  11 26 o 3.9562 1.2170 7.4459   11.234  5.4648    11.806  26.393    36.511  2.9853 1.2283 4.9270 2.1014 -1.941709      2.434066  
1 1 1 6  11 27 o 7.0613 1.2795 66.554   18.068  93.733    29.265  49.812    22.969  8.2052 1.8299 5.9174 1.7889 2.287712       2.559078  
1 1 1 6  11 28 o 4.3530 1.2826 26.605   18.189  30.233    29.311  24.334    23.195  4.4821 1.8961 4.2239 1.7279 0.2581620      2.565295  
1 1 1 6  11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  12 0  o 15.797 0.7325 254.546  22.838  276.688   32.283  232.366   32.311  16.508 0.9858 15.086 1.0837 -0.000000      0.000000  
1 1 1 6  12 1  o 8.3573 0.6152 70.379   10.279  72.184    14.498  68.554    14.577  8.4661 0.8562 8.2486 0.8836 0.2175426      1.230412  
1 1 1 6  12 2  o 2.0164 0.6716 -13.8888 7.2569  -22.8006  10.224  -4.8422   10.302  1.6863 0.8329 2.3466 1.0539 -0.6603595     1.343273  
1 1 1 6  12 3  o 10.211 0.5712 104.951  11.664  104.757   16.601  105.140   16.392  10.202 0.8136 10.221 0.8019 -0.1959991E-01 1.142375  
1 1 1 6  12 4  o 8.1466 0.6392 67.074   10.337  77.638    14.787  56.981    14.455  8.7798 0.8421 7.5134 0.9619 1.266373       1.278458  
1 1 1 6  12 5  o 6.4795 0.7514 43.170   9.4935  47.310    13.478  39.094    13.375  6.8428 0.9848 6.1162 1.1352 0.7265291      1.502817  
1 1 1 6  12 6  o 22.416 0.5095 505.974  22.827  484.853   32.215  527.271   32.349  21.943 0.7341 22.888 0.7067 -0.9455357     1.018938  
1 1 1 6  12 7  o 6.4345 0.7682 42.803   9.6119  49.336    13.901  36.819    13.305  6.9660 0.9978 5.9030 1.1683 1.062985       1.536412  
1 1 1 6  12 8  o 15.592 0.5257 245.731  16.393  241.671   23.166  249.803   23.202  15.462 0.7491 15.723 0.7379 -0.2605019     1.051471  
1 1 1 6  12 9  o 14.393 0.5385 210.004  15.470  227.636   22.044  192.896   21.714  14.995 0.7350 13.791 0.7872 1.203964       1.077044  
1 1 1 6  12 10 o 5.3235 0.8780 31.176   9.2963  38.908    13.019  23.133    13.279  6.0283 1.1211 4.6186 1.3515 1.409738       1.755952  
1 1 1 6  12 11 o 6.7391 0.7481 47.641   9.8106  42.922    13.961  52.243    13.789  6.3461 1.1420 7.1322 0.9667 -0.7860432     1.496173  
1 1 1 6  12 12 o 15.645 0.5389 250.083  16.854  241.361   23.452  259.401   24.239  15.363 0.7633 15.928 0.7609 -0.5648813     1.077773  
1 1 1 6  12 13 o 11.717 0.5911 141.158  13.841  139.616   19.162  142.839   20.013  11.655 0.8220 11.778 0.8496 -0.1229067     1.182181  
1 1 1 6  12 14 o 11.141 0.5949 127.979  13.251  130.434   18.633  125.465   18.850  11.254 0.8278 11.027 0.8547 0.2269726      1.189847  
1 1 1 6  12 15 o 13.514 0.5818 190.003  15.625  208.225   21.731  170.499   22.482  14.220 0.7641 12.808 0.8776 1.411464       1.163649  
1 1 1 6  12 16 o 10.651 0.8536 122.510  14.605  122.777   16.437  121.510   31.831  10.915 0.7529 10.387 1.5322 0.5283270      1.707239  
1 1 1 6  12 17 o 5.1577 1.1343 30.476   11.040  30.776    12.065  28.937    27.366  5.2389 1.1799 5.0765 1.9377 0.1623878      2.268677  
1 1 1 6  12 18 f 11.987 0.8063 146.893  15.876  141.146   17.824  168.956   34.925  11.683 0.7628 12.292 1.4207 -0.6087437     1.612513  
1 1 1 6  12 19 o 5.2759 1.1670 31.382   11.726  31.687    12.864  29.887    28.512  5.3244 1.2324 5.2273 1.9820 0.9710026E-01  2.333925  
1 1 1 6  12 20 o 7.5229 1.1250 79.838   13.711  88.973    15.276  41.991    31.093  9.2486 0.8259 5.7971 2.0929 3.451454       2.249918  
1 1 1 6  12 21 o 13.471 0.7511 186.470  20.235  186.470   20.235  0.0000    0.0000  13.471 0.7511 ?      ?      ?              ?         
1 1 1 6  12 22 o 8.9581 1.2036 98.942   15.139  101.785   16.528  84.134    37.720  9.9121 0.8337 8.0040 2.2582 1.908101       2.407156  
1 1 1 6  12 23 o 8.8981 1.1317 85.697   14.423  83.129    15.713  99.438    36.352  8.9341 0.8794 8.8621 2.0857 0.7204247E-01  2.263489  
1 1 1 6  12 24 o 11.890 0.9922 143.440  17.903  135.101   19.561  186.462   44.431  11.353 0.8615 12.427 1.7877 -1.073989      1.984409  
1 1 1 6  12 25 o 5.0433 1.3480 20.370   12.887  15.813    13.684  56.093    38.313  3.8616 1.3891 6.2249 2.3106 -2.363274      2.696024  
1 1 1 6  12 26 f 8.0986 1.3449 73.574   16.025  66.387    17.217  120.157   43.831  7.6965 1.1185 8.5008 2.4463 -0.8043756     2.689830  
1 1 1 6  12 27 o 5.3754 1.0456 47.698   14.816  58.181    15.837  -25.8750  41.955  7.1205 1.1121 3.6303 1.7711 3.490219       2.091272  
1 1 1 6  12 28 o 4.8683 1.4759 38.571   24.856  16.096    30.705  81.294    42.334  3.9284 1.7864 5.8082 2.3498 -1.879835      2.951740  
1 1 1 6  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  13 0  o 5.1605 1.2402 35.169   14.150  58.432    20.204  12.771    19.824  7.1126 1.6308 3.2084 1.8690 -0.000000      0.000000  
1 1 1 6  13 1  o 14.224 0.5227 203.565  14.867  198.852   21.037  208.267   21.013  14.059 0.7482 14.390 0.7301 -0.3310337     1.045423  
1 1 1 6  13 2  o 10.419 0.5948 109.664  12.363  105.174   17.897  113.763   17.098  10.211 0.8763 10.627 0.8045 -0.4160004     1.189603  
1 1 1 6  13 3  o 21.866 0.6307 483.789  26.018  480.151   44.878  485.630   31.933  21.768 1.0308 21.965 0.7269 -0.1964340     1.261353  
1 1 1 6  13 4  o 2.0562 0.6871 -13.7710 7.6263  -21.1965  10.950  -6.7758   10.628  1.8223 0.8924 2.2900 1.0451 -0.4676719     1.374244  
1 1 1 6  13 5  o 12.022 0.5718 146.255  13.727  156.175   19.473  136.454   19.355  12.432 0.7832 11.613 0.8334 0.8193579      1.143610  
1 1 1 6  13 6  o 11.303 0.5944 129.563  13.401  117.891   18.807  141.603   19.100  10.780 0.8723 11.826 0.8075 -1.046592      1.188742  
1 1 1 6  13 7  o 6.3244 0.8020 41.761   9.8623  48.789    14.161  35.143    13.743  6.9119 1.0244 5.7370 1.2344 1.174899       1.604087  
1 1 1 6  13 8  o 12.653 0.5768 163.708  14.526  178.020   20.268  148.591   20.829  13.237 0.7656 12.068 0.8630 1.169157       1.153607  
1 1 1 6  13 9  o 6.8414 0.7573 48.631   10.350  51.397    14.658  45.880    14.616  7.0427 1.0406 6.6402 1.1006 0.4024639      1.514671  
1 1 1 6  13 10 o 3.2517 0.8887 7.6595   8.1928  7.8026    12.050  7.5366    11.172  3.2988 1.2788 3.2047 1.2345 0.9408522E-01  1.777456  
1 1 1 6  13 11 o 5.7457 0.9151 36.417   10.326  44.209    14.783  28.991    14.431  6.3827 1.2022 5.1087 1.3799 1.274045       1.830102  
1 1 1 6  13 12 o 4.0726 0.9265 16.800   9.2301  6.8392    13.350  25.921    12.775  3.3055 1.3258 4.8396 1.2946 -1.534078      1.853017  
1 1 1 6  13 13 o 5.1703 0.9744 29.971   10.260  29.061    14.754  30.824    14.278  5.0904 1.4037 5.2502 1.3517 -0.1597438     1.948730  
1 1 1 6  13 14 o 3.8913 0.9559 15.555   9.0997  15.385    12.983  15.720    12.758  3.8818 1.3572 3.9007 1.3464 -0.1889110E-01 1.911753  
1 1 1 6  13 15 o 10.909 0.5987 124.693  12.878  131.103   17.148  116.401   19.502  11.273 0.7606 10.545 0.9247 0.7280340      1.197342  
1 1 1 6  13 16 o 15.390 0.7499 262.491  18.919  271.221   21.625  234.018   39.054  16.253 0.6653 14.526 1.3443 1.726876       1.499860  
1 1 1 6  13 17 o 14.595 0.8123 244.197  18.742  256.140   21.273  202.786   39.613  15.793 0.6735 13.397 1.4784 2.396040       1.624610  
1 1 1 6  13 18 o 17.711 0.7081 330.253  21.115  330.467   24.149  329.557   43.515  17.967 0.6720 17.455 1.2465 0.5118313      1.416115  
1 1 1 6  13 19 o 6.0498 1.1555 45.443   13.204  48.448    14.683  32.737    30.192  6.7383 1.0895 5.3614 2.0380 1.376901       2.310927  
1 1 1 6  13 20 o 10.370 0.8993 111.746  15.586  107.729   17.639  126.049   33.289  10.181 0.8663 10.559 1.5763 -0.3787022     1.798656  
1 1 1 6  13 21 o 9.4268 1.1657 123.171  15.645  136.363   17.494  70.468    34.965  11.505 0.7603 7.3490 2.2040 4.155496       2.331430  
1 1 1 6  13 22 o 4.1480 1.1456 16.004   11.433  18.121    12.267  2.0050    31.543  4.0741 1.3190 4.2220 1.8735 -0.1478977     2.291196  
1 1 1 6  13 23 o 6.5909 1.2737 41.793   13.173  36.349    14.205  75.218    35.197  5.6700 1.2827 7.5117 2.2010 -1.841758      2.547482  
1 1 1 6  13 24 o 7.5875 1.2973 58.806   14.864  52.742    16.014  96.526    39.938  6.9544 1.1514 8.2206 2.3251 -1.266241      2.594587  
1 1 1 6  13 25 o 5.5010 1.2298 42.198   14.641  46.277    15.759  16.474    39.573  6.3004 1.2939 4.7015 2.0917 1.598936       2.459613  
1 1 1 6  13 26 f 7.5911 1.3007 93.864   16.974  98.076    18.208  65.924    46.897  9.4223 0.9662 5.7598 2.4154 3.662480       2.601478  
1 1 1 6  13 27 o 6.0952 1.4118 52.186   15.921  47.034    17.097  85.821    43.682  5.9889 1.4442 6.2015 2.4263 -0.2125854     2.823609  
1 1 1 6  13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  13 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  14 0  o 10.417 0.9276 115.463  18.377  108.825   26.575  121.547   25.440  10.078 1.3946 10.756 1.2235 -0.000000      0.000000  
1 1 1 6  14 1  o 7.6074 0.7351 58.798   11.134  51.448    15.308  67.052    16.224  7.0989 1.0782 8.1159 0.9995 -1.017031      1.470235  
1 1 1 6  14 2  o 11.909 0.5697 143.633  13.542  154.974   19.249  132.519   19.055  12.380 0.7775 11.438 0.8329 0.9413223      1.139399  
1 1 1 6  14 3  o 5.7420 0.9319 35.510   10.478  38.243    14.421  32.453    15.251  5.9920 1.2441 5.4921 1.3879 0.4998775      1.863837  
1 1 1 6  14 4  o 10.745 0.6234 117.789  13.323  128.526   18.559  106.370   19.139  11.263 0.8239 10.227 0.9357 1.035985       1.246759  
1 1 1 6  14 5  o 7.8144 0.8973 59.666   13.299  74.430    23.712  52.889    16.064  8.4516 1.4028 7.1771 1.1191 1.274443       1.794512  
1 1 1 6  14 6  o 10.629 0.6234 115.946  13.158  130.621   18.515  100.973   18.702  11.328 0.8172 9.9310 0.9416 1.396847       1.246783  
1 1 1 6  14 7  o 4.3747 1.1214 18.412   11.757  20.005    13.552  13.565    23.642  4.3471 1.3841 4.4024 1.7648 -0.5524445E-01 2.242845  
1 1 1 6  14 8  o 10.453 0.6344 113.377  13.038  134.130   18.214  91.569    18.671  11.474 0.7937 9.4316 0.9898 2.041935       1.268736  
1 1 1 6  14 9  o 4.7046 1.1536 23.085   12.291  25.477    13.903  14.528    26.299  4.8246 1.3744 4.5847 1.8530 0.2399039      2.307100  
1 1 1 6  14 10 o 7.6228 0.7582 62.066   10.953  78.343    15.581  46.161    15.402  8.7224 0.8932 6.5231 1.2255 2.199361       1.516473  
1 1 1 6  14 11 o 4.5979 0.9533 23.201   9.5177  17.394    13.408  29.099    13.512  4.0847 1.3810 5.1112 1.3144 -1.026490      1.906526  
1 1 1 6  14 12 o 16.165 0.5495 268.115  17.760  266.015   24.779  270.334   25.467  16.104 0.7693 16.226 0.7848 -0.1219635     1.098974  
1 1 1 6  14 13 o 2.8678 0.8590 0.0436   8.9220  7.8304    12.623  -7.7302   12.612  3.2906 1.2991 2.4451 1.1242 0.8454714      1.717999  
1 1 1 6  14 14 o 2.9995 0.8919 3.1085   9.0894  1.8769    12.680  4.4103    13.036  2.9089 1.2395 3.0900 1.2828 -0.1811259     1.783780  
1 1 1 6  14 15 o 7.4591 1.1483 59.458   13.776  55.630    15.276  76.125    31.876  7.2262 1.0570 7.6921 2.0390 -0.4659400     2.296685  
1 1 1 6  14 16 o 9.4334 0.8764 81.197   14.321  67.359    16.120  133.045   31.202  7.9709 1.0112 10.896 1.4318 -2.925007      1.752854  
1 1 1 6  14 17 o 5.3285 1.2687 28.361   12.825  25.666    13.995  42.494    32.046  4.7596 1.3860 5.8974 2.1254 -1.137761      2.537333  
1 1 1 6  14 18 o 2.5762 0.8785 -10.6623 9.5121  -7.2310   10.210  -33.2135  26.175  2.1647 1.0011 2.9878 1.4439 -0.8230877     1.756956  
1 1 1 6  14 19 o 9.1497 1.1396 103.391  15.332  107.689   17.080  85.557    34.790  10.176 0.8392 8.1230 2.1192 2.053342       2.279283  
1 1 1 6  14 20 o 10.676 1.0709 140.938  16.529  150.296   18.610  105.969   35.975  12.077 0.7705 9.2743 1.9984 2.802403       2.141832  
1 1 1 6  14 21 o 4.7937 1.0482 29.633   12.622  38.912    13.735  -20.7586  32.009  5.9270 1.1999 3.6604 1.7190 2.266644       2.096336  
1 1 1 6  14 22 f 5.3587 1.2409 33.043   13.088  34.327    14.151  25.453    34.414  5.5219 1.3024 5.1956 2.1126 0.3262992      2.481858  
1 1 1 6  14 23 o 7.3102 1.2843 59.459   15.110  55.763    16.501  78.654    37.604  7.1621 1.1520 7.4583 2.2958 -0.2961617     2.568645  
1 1 1 6  14 24 o 5.2981 1.2961 33.383   14.041  33.377    15.170  33.418    37.094  5.3050 1.4068 5.2913 2.1772 0.1378727E-01  2.592147  
1 1 1 6  14 25 o 5.2529 1.3495 33.303   14.342  30.975    15.336  49.529    40.484  4.9726 1.4517 5.5333 2.2753 -0.5606503     2.698995  
1 1 1 6  14 26 o 4.8892 1.1228 36.452   12.922  40.750    13.499  -10.5804  44.658  5.8364 1.1967 3.9421 1.9003 1.894332       2.245653  
1 1 1 6  14 27 o 4.3423 1.3214 12.082   13.738  3.6239    14.609  76.805    40.411  2.9221 1.2868 5.7625 2.3082 -2.840395      2.642724  
1 1 1 6  14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  15 0  o 12.136 0.9011 155.038  21.209  163.768   29.689  145.939   30.309  12.524 1.2113 11.747 1.3345 -0.000000      0.000000  
1 1 1 6  15 1  o 5.6825 0.9318 35.233   10.479  42.687    14.600  27.312    15.051  6.3314 1.1968 5.0336 1.4286 1.297795       1.863688  
1 1 1 6  15 2  o 13.991 0.5677 198.917  15.885  197.000   22.361  200.871   22.570  13.923 0.8030 14.059 0.8027 -0.1362190     1.135432  
1 1 1 6  15 3  o 11.628 0.6117 137.562  14.194  125.994   19.484  150.645   20.720  11.106 0.8772 12.151 0.8526 -1.045036      1.223328  
1 1 1 6  15 4  o 15.169 0.5498 234.303  16.668  223.195   23.176  246.205   23.990  14.795 0.7832 15.543 0.7717 -0.7483101     1.099548  
1 1 1 6  15 5  o 9.7412 0.6409 97.318   12.474  93.008    17.201  102.099   18.117  9.5149 0.9039 9.9676 0.9088 -0.4527550     1.281753  
1 1 1 6  15 6  o 3.9197 0.8814 10.964   9.6570  30.045    13.681  -7.9867   13.634  5.2512 1.3076 2.5882 1.1821 2.662957       1.762742  
1 1 1 6  15 7  o 14.658 0.5624 219.132  16.488  221.335   23.339  216.936   23.295  14.733 0.7921 14.583 0.7987 0.1495123      1.124859  
1 1 1 6  15 8  o 12.262 0.6113 156.689  14.758  183.264   20.562  128.456   21.193  13.384 0.7681 11.139 0.9513 2.245392       1.222694  
1 1 1 6  15 9  o 14.659 0.5683 220.660  16.616  236.913   23.366  204.035   23.632  15.222 0.7675 14.097 0.8382 1.125482       1.136524  
1 1 1 6  15 10 o 8.4082 0.7245 74.166   12.137  81.421    17.181  66.938    17.147  8.8384 0.9719 7.9780 1.0747 0.8604698      1.448996  
1 1 1 6  15 11 o 12.482 0.6029 160.773  15.050  158.542   21.141  163.066   21.431  12.395 0.8528 12.570 0.8524 -0.1757650     1.205807  
1 1 1 6  15 12 o 6.1341 0.8819 42.003   10.438  38.011    15.067  45.686    14.473  5.8092 1.3260 6.4589 1.1632 -0.6497569     1.763875  
1 1 1 6  15 13 o 4.4410 0.8888 20.417   9.8607  38.121    13.710  1.4438    14.193  5.8542 1.2109 3.0278 1.3012 2.826414       1.777505  
1 1 1 6  15 14 o 3.2704 0.8497 1.4038   9.0744  22.328    13.371  -16.4628  12.355  4.4472 1.3690 2.0936 1.0067 2.353635       1.699341  
1 1 1 6  15 15 o 9.4878 0.9326 82.314   15.005  69.199    16.743  135.805   33.815  8.0671 1.0378 10.909 1.5499 -2.841475      1.865264  
1 1 1 6  15 16 o 3.7047 1.1068 5.9599   11.374  4.4370    12.610  12.608    26.346  3.0566 1.2647 4.3528 1.8167 -1.296215      2.213568  
1 1 1 6  15 17 o 2.9486 1.0000 -10.4608 10.890  -9.3933   11.650  -17.8487  30.649  2.2580 1.0528 3.6392 1.7004 -1.381197      1.999911  
1 1 1 6  15 18 o 3.9858 1.1697 6.1366   12.098  1.7768    13.333  26.455    28.783  2.9570 1.2657 5.0147 1.9674 -2.057672      2.339410  
1 1 1 6  15 19 o 5.7123 1.2541 37.696   13.264  38.582    14.323  32.367    35.136  5.8940 1.2536 5.5307 2.1725 0.3632708      2.508246  
1 1 1 6  15 20 o 8.1497 1.1761 79.191   15.112  80.829    16.884  72.597    33.878  8.7836 0.9611 7.5157 2.1470 1.267928       2.352294  
1 1 1 6  15 21 o 5.4037 1.2067 36.753   13.970  41.132    15.339  15.447    33.836  6.0381 1.3080 4.7694 2.0283 1.268701       2.413477  
1 1 1 6  15 22 o 14.362 0.7826 214.221  22.480  214.221   22.480  0.0000    0.0000  14.362 0.7826 ?      ?      ?              ?         
1 1 1 6  15 23 o 3.4002 1.0587 4.2165   11.951  9.7242    12.690  -38.9500  35.527  3.3727 1.3110 3.4278 1.6626 -0.5503058E-01 2.117311  
1 1 1 6  15 24 o 7.4730 1.2861 74.425   15.986  75.339    17.543  69.950    38.813  8.2994 1.0569 6.6466 2.3449 1.652799       2.572104  
1 1 1 6  15 25 o 4.5887 1.2093 27.334   12.901  28.867    13.654  14.577    39.384  4.8087 1.3593 4.3687 2.0005 0.4400783      2.418653  
1 1 1 6  15 26 o 5.4779 1.1997 51.088   15.918  56.358    17.101  16.899    43.557  6.6983 1.3234 4.2575 2.0013 2.440768       2.399318  
1 1 1 6  15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  15 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  16 0  o 2.9866 1.3023 8.0955   15.234  4.9551    20.915  11.645    22.234  2.7956 1.7632 3.1776 1.9170 -0.000000      0.000000  
1 1 1 6  16 1  o 10.656 0.6355 116.371  13.514  106.280   18.829  127.093   19.408  10.171 0.9256 11.140 0.8711 -0.9683475     1.271036  
1 1 1 6  16 2  o 4.3626 1.0035 19.843   10.039  20.487    14.020  19.165    14.383  4.4117 1.4082 4.3134 1.4300 0.9829521E-01  2.006919  
1 1 1 6  16 3  o 22.080 0.5330 495.355  23.526  472.773   32.948  518.844   33.603  21.562 0.7640 22.598 0.7435 -1.036150      1.066072  
1 1 1 6  16 4  o 8.2417 0.7280 70.092   11.988  65.923    16.816  74.400    17.093  7.9868 1.0528 8.4967 1.0059 -0.5099425     1.456052  
1 1 1 6  16 5  o 14.193 0.5837 206.457  16.561  199.490   23.457  213.380   23.383  13.948 0.8409 14.438 0.8098 -0.4904137     1.167399  
1 1 1 6  16 6  o 22.066 0.5359 497.733  23.647  504.917   33.332  490.452   33.553  22.231 0.7497 21.900 0.7660 0.3309898      1.071833  
1 1 1 6  16 7  o 2.9945 0.8806 1.8315   8.8431  8.3422    13.312  -3.3112   11.831  3.4136 1.3384 2.5753 1.1448 0.8383298      1.761216  
1 1 1 6  16 8  o 6.9059 0.8371 51.367   11.247  57.968    16.059  45.013    15.756  7.4239 1.0816 6.3879 1.2779 1.036078       1.674199  
1 1 1 6  16 9  o 2.3161 0.7604 -9.9488  8.5686  -15.1988  12.476  -5.2615   11.789  2.1657 1.0334 2.4664 1.1157 -0.3007209     1.520781  
1 1 1 6  16 10 o 9.3025 0.9817 88.253   16.367  108.478   32.191  81.201    19.008  9.8272 1.6379 8.7779 1.0827 1.049321       1.963375  
1 1 1 6  16 11 o 15.224 0.5769 240.055  17.564  238.622   24.932  241.466   24.746  15.175 0.8215 15.273 0.8101 -0.9745884E-01 1.153746  
1 1 1 6  16 12 o 6.2516 0.9577 43.782   11.940  32.352    16.605  56.019    17.181  5.2879 1.5005 7.2152 1.1906 -1.927312      1.915453  
1 1 1 6  16 13 o 10.302 0.7040 114.465  14.076  143.042   19.774  85.108    20.042  11.712 0.8442 8.8919 1.1270 2.819633       1.408082  
1 1 1 6  16 14 o 7.2414 0.8134 57.370   11.429  63.638    16.029  50.888    16.301  7.7368 1.0359 6.7459 1.2544 0.9909391      1.626810  
1 1 1 6  16 15 o 11.844 0.8961 146.572  17.348  142.248   19.496  163.016   38.019  11.709 0.8325 11.978 1.5870 -0.2687445     1.792104  
1 1 1 6  16 16 f 8.0615 1.0706 66.631   14.311  60.484    16.150  89.113    30.884  7.5497 1.0696 8.5734 1.8550 -1.023714      2.141292  
1 1 1 6  16 17 o 6.4857 1.2006 52.367   13.888  54.485    15.306  42.504    33.037  7.1440 1.0713 5.8275 2.1491 1.316499       2.401258  
1 1 1 6  16 18 o 5.1393 1.1893 32.415   13.665  37.686    14.804  2.0785    35.516  5.8013 1.3073 4.4772 1.9873 1.324121       2.378690  
1 1 1 6  16 19 o 14.780 0.8306 232.585  20.093  231.638   22.719  235.986   43.057  14.999 0.7573 14.562 1.4784 0.4374027      1.661135  
1 1 1 6  16 20 o 5.8971 1.2146 44.955   14.056  48.829    15.366  25.114    34.778  6.6458 1.2003 5.1485 2.1121 1.497250       2.429287  
1 1 1 6  16 21 o 3.9448 1.1683 10.804   13.699  15.281    14.913  -13.3832  34.664  3.9282 1.4446 3.9614 1.8364 -0.3321719E-01 2.336520  
1 1 1 6  16 22 o 12.338 0.9716 166.270  19.002  162.897   21.223  179.901   42.667  12.462 0.8515 12.214 1.7467 0.2479830      1.943183  
1 1 1 6  16 23 o 5.2023 1.0825 39.394   14.069  49.457    15.276  -16.8630  36.117  6.5952 1.2024 3.8094 1.8004 2.785742       2.164959  
1 1 1 6  16 24 o 6.0985 1.2297 58.267   16.133  62.749    17.451  31.907    42.316  7.3657 1.1846 4.8313 2.1553 2.534407       2.459374  
1 1 1 6  16 25 o 4.2559 1.1959 23.838   14.504  27.594    15.545  -1.4201   40.309  4.5690 1.4852 3.9429 1.8747 0.6260610      2.391731  
1 1 1 6  16 26 o 3.8723 1.1655 18.662   14.361  22.089    15.116  -13.0613  45.991  4.0385 1.4591 3.7061 1.8178 0.3323753      2.330925  
1 1 1 6  16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  17 0  o 9.4336 1.0888 99.258   18.894  97.240    26.469  101.355   26.978  9.3251 1.5473 9.5420 1.5321 -0.000000      0.000000  
1 1 1 6  17 1  o 9.6886 0.7375 98.748   14.106  82.209    20.130  114.707   19.774  8.8464 1.1377 10.531 0.9389 -1.684308      1.475096  
1 1 1 6  17 2  o 5.4612 0.9981 33.045   11.100  26.233    15.348  40.513    16.071  4.8748 1.4598 6.0475 1.3616 -1.172644      1.996215  
1 1 1 6  17 3  o 4.2583 1.0169 18.594   10.373  14.895    14.631  22.332    14.709  3.9655 1.4350 4.5510 1.4413 -0.5854990     2.033877  
1 1 1 6  17 4  o 9.9379 0.6781 102.178  13.471  103.900   18.891  100.396   19.216  10.029 0.9418 9.8468 0.9758 0.1820669      1.356134  
1 1 1 6  17 5  o 11.261 0.6521 131.292  14.673  138.528   20.860  124.205   20.644  11.577 0.9009 10.945 0.9430 0.6318359      1.304214  
1 1 1 6  17 6  o 13.667 0.6044 193.503  16.439  172.763   23.306  214.038   23.191  12.911 0.9026 14.423 0.8040 -1.512271      1.208731  
1 1 1 6  17 7  o 8.1706 0.7712 70.402   12.560  66.727    18.174  73.762    17.377  7.9460 1.1436 8.3953 1.0349 -0.4493742     1.542366  
1 1 1 6  17 8  o 7.6107 1.1517 63.925   14.575  62.409    16.445  69.480    31.477  7.7050 1.0671 7.5164 2.0412 0.1886401      2.303312  
1 1 1 6  17 9  o 3.8664 0.9483 13.616   9.5549  24.049    13.938  4.3670    13.124  4.6278 1.3924 3.1051 1.2879 1.522738       1.896677  
1 1 1 6  17 10 o 7.8367 0.8399 67.853   12.565  79.675    17.410  54.999    18.153  8.6887 1.0018 6.9847 1.3483 1.704016       1.679780  
1 1 1 6  17 11 o 4.5737 1.0417 23.396   10.821  23.910    15.703  22.930    14.934  4.6170 1.4921 4.5305 1.4541 0.8649635E-01  2.083453  
1 1 1 6  17 12 o 4.2972 1.0366 19.125   11.384  8.2821    16.082  30.016    16.117  3.5297 1.4407 5.0648 1.4909 -1.535108      2.073295  
1 1 1 6  17 13 o 2.9571 0.9075 0.4316   9.9634  1.7470    14.195  -0.8457   13.988  3.0320 1.3022 2.8822 1.2645 0.1498182      1.815083  
1 1 1 6  17 14 o 11.314 0.9564 141.287  17.432  142.150   19.682  138.150   37.540  11.704 0.8408 10.925 1.7182 0.7793474      1.912881  
1 1 1 6  17 15 o 13.802 0.8108 196.525  18.950  190.076   21.565  218.382   39.701  13.559 0.7952 14.046 1.4133 -0.4864302     1.621668  
1 1 1 6  17 16 o 5.1487 1.2571 29.134   13.360  28.628    14.687  31.561    32.164  4.9825 1.4103 5.3149 2.0813 -0.3323665     2.514101  
1 1 1 6  17 17 o 7.3172 1.2030 59.946   14.931  58.226    16.782  66.479    32.700  7.3979 1.1343 7.2364 2.1218 0.1614876      2.405967  
1 1 1 6  17 18 o 17.514 0.7964 334.311  22.976  340.910   26.204  312.368   47.782  18.219 0.7191 16.810 1.4213 1.409775       1.592842  
1 1 1 6  17 19 o 4.4642 1.2266 7.7113   13.123  -0.5293   14.524  44.337    30.620  2.9593 1.2936 5.9690 2.0844 -3.009650      2.453246  
1 1 1 6  17 20 o 7.4190 1.2864 72.917   16.091  77.289    17.561  50.038    40.176  8.5570 1.0261 6.2811 2.3592 2.275859       2.572733  
1 1 1 6  17 21 o 15.049 0.8043 228.046  20.684  212.374   23.467  282.611   43.788  14.257 0.8230 15.840 1.3822 -1.583043      1.608617  
1 1 1 6  17 22 o 3.3306 1.1211 -6.4092  13.322  -4.8178   14.136  -19.0531  39.844  2.6850 1.2175 3.9762 1.8827 -1.291196      2.242113  
1 1 1 6  17 23 o 6.5759 1.4116 50.129   16.234  42.436    17.758  89.262    40.050  5.8157 1.5125 7.3362 2.3839 -1.520486      2.823256  
1 1 1 6  17 24 o 5.5623 1.2739 47.501   15.919  50.382    17.225  30.634    41.673  6.3537 1.3938 4.7709 2.1328 1.582794       2.547864  
1 1 1 6  17 25 o 6.1141 1.4089 58.090   16.849  53.760    18.164  84.800    45.112  6.3425 1.4619 5.8858 2.4089 0.4567661      2.817808  
1 1 1 6  17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  17 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  18 0  o 16.181 0.8106 273.422  25.899  286.624   36.578  260.149   36.675  16.597 1.1134 15.764 1.1784 -0.000000      0.000000  
1 1 1 6  18 1  o 11.617 0.6618 140.256  15.370  140.625   21.426  139.866   22.060  11.640 0.9203 11.594 0.9513 0.4592705E-01  1.323654  
1 1 1 6  18 2  o 7.7768 0.8675 65.549   13.057  56.095    18.443  75.051    18.490  7.1140 1.3455 8.4396 1.0954 -1.325592      1.735017  
1 1 1 6  18 3  o 13.171 0.6192 179.181  16.296  189.750   23.378  169.191   22.729  13.555 0.8623 12.787 0.8887 0.7679691      1.238349  
1 1 1 6  18 4  o 10.697 0.6878 119.120  14.692  119.037   20.228  119.213   21.374  10.705 0.9448 10.689 0.9998 0.1598549E-01  1.375620  
1 1 1 6  18 5  o 4.3811 0.9500 16.564   10.819  -1.7371   14.738  37.950    15.932  2.9496 1.2959 5.8126 1.3894 -2.863002      1.899926  
1 1 1 6  18 6  o 4.4772 1.0740 21.241   11.510  25.535    16.867  17.499    15.745  4.7897 1.5462 4.1647 1.4909 0.6249681      2.147950  
1 1 1 6  18 7  o 5.2928 1.0515 32.320   12.014  21.930    17.249  42.108    16.742  4.5042 1.5649 6.0814 1.4048 -1.577152      2.102970  
1 1 1 6  18 8  o 7.9471 0.8187 67.966   12.953  75.004    18.323  60.937    18.313  8.3894 1.0920 7.5047 1.2201 0.8847194      1.637423  
1 1 1 6  18 9  o 6.3990 0.9518 45.938   12.036  56.171    17.097  35.885    16.947  7.2304 1.1823 5.5677 1.4918 1.662763       1.903518  
1 1 1 6  18 10 o 8.4858 0.7825 77.206   13.250  83.578    18.884  71.026    18.597  8.8510 1.0668 8.1207 1.1450 0.7302923      1.564940  
1 1 1 6  18 11 o 7.1163 0.9385 57.412   12.910  69.045    18.070  45.283    18.451  8.0131 1.1275 6.2194 1.5006 1.793689       1.877015  
1 1 1 6  18 12 o 3.5438 0.9865 8.7919   10.757  -0.0161   15.705  16.576    14.764  3.0795 1.3457 4.0081 1.4428 -0.9286704     1.972986  
1 1 1 6  18 13 o 5.3865 1.0478 33.491   11.868  41.273    16.724  25.598    16.844  6.0108 1.4147 4.7623 1.5459 1.248448       2.095552  
1 1 1 6  18 14 o 5.0582 0.9257 31.784   13.935  53.652    15.806  -44.5637  29.532  7.0907 1.1145 3.0258 1.4783 4.064896       1.851369  
1 1 1 6  18 15 o 4.6432 1.2624 13.792   20.511  42.666    25.612  -37.8337  34.247  5.8590 1.9065 3.4274 1.6552 2.431527       2.524755  
1 1 1 6  18 16 f 3.2101 1.0744 -15.4469 11.632  -18.7287  12.525  5.1524    31.379  2.0578 0.9955 4.3625 1.9044 -2.304663      2.148868  
1 1 1 6  18 17 o 8.4837 1.2098 91.120   16.317  96.469    18.375  71.180    35.479  9.5943 0.9576 7.3732 2.2221 2.221096       2.419689  
1 1 1 6  18 18 o 13.536 0.9275 200.805  21.390  201.640   24.676  198.282   42.895  13.906 0.8872 13.165 1.6291 0.7407398      1.855023  
1 1 1 6  18 19 o 9.2734 1.1130 90.967   16.582  85.535    18.630  111.675   36.376  9.0016 1.0348 9.5453 1.9707 -0.5436077     2.225906  
1 1 1 6  18 20 o 4.0918 1.2256 11.602   15.932  16.132    17.825  -6.3950   35.529  4.0708 1.5615 4.1127 1.8895 -0.4196596E-01 2.451192  
1 1 1 6  18 21 o 6.5302 1.1706 63.443   16.131  74.303    17.938  17.555    36.873  8.2815 1.0830 4.7790 2.0756 3.502504       2.341140  
1 1 1 6  18 22 o 3.7527 1.0971 11.732   13.149  18.725    14.111  -34.3661  36.233  4.0491 1.4150 3.4563 1.6770 0.5927210      2.194240  
1 1 1 6  18 23 o 6.8765 1.3824 59.503   16.394  52.172    18.031  94.466    39.376  6.4453 1.4356 7.3076 2.3629 -0.8623261     2.764766  
1 1 1 6  18 24 o 4.3714 1.2319 26.367   14.764  28.455    15.766  11.497    42.076  4.5872 1.4960 4.1557 1.9576 0.4315410      2.463788  
1 1 1 6  18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 0  o 24.188 0.7880 605.611  37.849  657.921   54.038  555.235   53.029  25.248 1.0745 23.128 1.1530 -0.000000      0.000000  
1 1 1 6  19 1  o 11.443 0.6731 136.501  15.389  144.779   21.949  128.497   21.584  11.795 0.9304 11.092 0.9730 0.7032461      1.346226  
1 1 1 6  19 2  o 9.8620 0.7259 102.239  14.286  103.328   19.641  101.016   20.819  9.9351 0.9885 9.7890 1.0634 0.1461239      1.451838  
1 1 1 6  19 3  o 3.6121 1.0071 6.7548   11.478  19.430    16.605  -4.8417   15.883  4.3166 1.5326 2.9076 1.3070 1.408914       2.014273  
1 1 1 6  19 4  o 5.9467 1.0352 41.243   12.706  26.143    18.113  55.871    17.828  4.8163 1.6051 7.0771 1.3077 -2.260746      2.070369  
1 1 1 6  19 5  o 8.4849 0.8136 77.266   13.788  81.551    19.471  72.958    19.526  8.7389 1.1140 8.2308 1.1861 0.5081015      1.627283  
1 1 1 6  19 6  o 8.5355 0.8446 78.466   13.600  55.489    18.303  106.785   20.320  7.0151 1.3536 10.056 1.0104 -3.040720      1.689111  
1 1 1 6  19 7  o 9.2072 0.7630 90.023   14.024  83.318    19.680  96.941    19.989  8.8417 1.1129 9.5727 1.0441 -0.7309799     1.525985  
1 1 1 6  19 8  o 4.5228 0.9544 20.765   11.177  -0.1773   16.117  40.168    15.513  3.1093 1.3609 5.9364 1.3386 -2.827045      1.908866  
1 1 1 6  19 9  o 8.0818 0.8504 71.067   13.726  68.331    19.631  73.683    19.200  7.9085 1.2411 8.2551 1.1629 -0.3466525     1.700782  
1 1 1 6  19 10 o 9.8571 0.7723 104.451  15.149  111.628   20.988  96.645    21.888  10.252 1.0236 9.4626 1.1566 0.7890558      1.544515  
1 1 1 6  19 11 o 7.9968 0.8642 69.158   13.813  72.197    19.644  66.185    19.429  8.1812 1.2005 7.8124 1.2434 0.3687334      1.728419  
1 1 1 6  19 12 o 19.533 0.5911 396.150  23.047  421.493   32.498  370.507   32.689  20.188 0.8049 18.878 0.8658 1.309355       1.182132  
1 1 1 6  19 13 o 8.5282 1.1752 78.615   16.386  73.559    18.441  97.578    35.713  8.2964 1.1114 8.7599 2.0711 -0.4635296     2.350425  
1 1 1 6  19 14 f 11.350 0.8954 126.894  17.750  113.503   20.222  171.824   37.041  10.372 0.9748 12.328 1.5023 -1.955558      1.790877  
1 1 1 6  19 15 o 14.519 0.8635 222.697  20.940  219.918   23.814  232.167   43.966  14.595 0.8159 14.443 1.5221 0.1519480      1.726967  
1 1 1 6  19 16 o 16.416 0.7770 284.923  22.211  283.484   25.783  289.064   43.738  16.578 0.7776 16.253 1.3455 0.3247070      1.554041  
1 1 1 6  19 17 o 4.1684 1.2473 10.556   14.971  10.993    16.592  8.6438    34.730  3.7469 1.4862 4.5898 2.0036 -0.8429232     2.494587  
1 1 1 6  19 18 o 8.8737 1.1680 84.717   17.111  79.354    19.379  103.681   36.444  8.6302 1.1228 9.1172 2.0486 -0.4870529     2.336087  
1 1 1 6  19 19 o 6.0554 1.0768 55.546   16.057  71.724    17.690  -20.1213  38.259  8.1646 1.0833 3.9461 1.8613 4.218480       2.153608  
1 1 1 6  19 20 o 4.5535 1.2972 17.649   15.192  14.191    16.992  31.428    33.917  3.8944 1.5162 5.2126 2.1052 -1.318175      2.594366  
1 1 1 6  19 21 o 7.1599 1.3288 69.252   17.008  70.046    18.719  65.496    40.712  7.9207 1.1817 6.3990 2.3805 1.521774       2.657667  
1 1 1 6  19 22 o 4.7375 1.3246 14.421   14.549  3.5500    15.845  72.848    36.734  3.0971 1.3526 6.3780 2.2779 -3.280845      2.649242  
1 1 1 6  19 23 o 4.1855 1.2994 16.057   15.166  12.905    16.211  38.170    42.937  3.5560 1.4484 4.8150 2.1578 -1.258986      2.598862  
1 1 1 6  19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  19 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  20 0  o 3.3118 1.4030 14.856   16.617  16.167    23.542  13.555    23.458  3.3797 2.0050 3.2439 1.9630 -0.000000      0.000000  
1 1 1 6  20 1  o 10.330 0.7694 117.096  15.275  143.886   20.892  86.327    22.389  11.744 0.8894 8.9152 1.2557 2.828995       1.538791  
1 1 1 6  20 2  o 12.545 0.6714 166.177  16.689  188.427   23.385  143.081   23.825  13.455 0.8690 11.636 1.0238 1.818468       1.342873  
1 1 1 6  20 3  o 2.9205 0.9266 -5.7786  11.456  1.4544    16.175  -13.0603  16.229  3.2070 1.3837 2.6340 1.2328 0.5729947      1.853276  
1 1 1 6  20 4  o 5.7722 1.0894 38.095   12.932  29.465    17.347  48.890    19.402  5.0536 1.5600 6.4907 1.5212 -1.437183      2.178857  
1 1 1 6  20 5  o 7.1932 0.9656 59.744   13.340  73.907    18.302  43.689    19.486  8.3129 1.1008 6.0736 1.5867 2.239301       1.931171  
1 1 1 6  20 6  o 12.349 0.6847 161.255  16.910  164.226   24.015  158.332   23.816  12.466 0.9633 12.233 0.9734 0.2327337      1.369474  
1 1 1 6  20 7  o 7.8348 1.2140 76.412   17.432  81.368    20.781  64.641    32.025  8.6592 1.1999 7.0105 2.1108 1.648699       2.428044  
1 1 1 6  20 8  o 6.3503 1.0580 46.746   13.205  53.457    19.616  41.185    17.857  6.7771 1.4880 5.9235 1.5044 0.8536620      2.115973  
1 1 1 6  20 9  o 5.6280 1.0934 37.084   12.678  38.487    18.331  35.797    17.554  5.7235 1.5591 5.5325 1.5333 0.1910009      2.186761  
1 1 1 6  20 10 o 8.4922 0.8363 77.176   14.148  87.059    20.570  68.304    19.489  9.0276 1.1393 7.9568 1.2247 1.070750       1.672675  
1 1 1 6  20 11 o 5.8547 1.0173 38.862   13.736  12.435    19.595  64.392    19.260  4.0019 1.6058 7.7075 1.2494 -3.705585      2.034645  
1 1 1 6  20 12 o 12.515 0.6631 165.181  16.506  170.448   22.453  158.987   24.348  12.770 0.8791 12.260 0.9930 0.5096989      1.326202  
1 1 1 6  20 13 o 10.149 0.9744 98.427   17.754  81.176    20.383  152.660   36.140  8.6887 1.1730 11.610 1.5564 -2.921502      1.948899  
1 1 1 6  20 14 o 4.2535 1.2792 8.1833   15.273  5.8005    16.907  18.752    35.606  3.4959 1.4569 5.0111 2.1032 -1.515183      2.558498  
1 1 1 6  20 15 o 4.2567 1.2432 11.342   14.641  9.0825    16.540  19.524    31.472  3.6432 1.4706 4.8702 2.0048 -1.226995      2.486338  
1 1 1 6  20 16 o 6.2521 1.1504 55.966   16.503  69.704    18.413  -0.1383   37.209  8.0647 1.1416 4.4395 1.9976 3.625189       2.300786  
1 1 1 6  20 17 o 3.9192 1.1770 7.7109   15.431  14.934    17.348  -19.6491  33.765  4.0393 1.5426 3.7991 1.7782 0.2402430      2.354028  
1 1 1 6  20 18 o 5.8895 1.3549 44.259   16.912  46.041    18.850  36.905    38.291  6.2241 1.5260 5.5549 2.2392 0.6692252      2.709730  
1 1 1 6  20 19 o 17.207 0.8314 323.328  24.522  322.517   28.324  325.754   49.005  17.565 0.8063 16.849 1.4543 0.7164021      1.662830  
1 1 1 6  20 20 o 7.9723 1.3713 69.409   18.182  56.968    20.224  121.868   41.527  6.8323 1.5193 9.1123 2.2833 -2.280007      2.742577  
1 1 1 6  20 21 o 8.6347 1.3065 109.401  18.869  113.265   21.396  95.875    40.028  10.011 1.0686 7.2580 2.3845 2.753459       2.612980  
1 1 1 6  20 22 o 6.2890 1.4757 48.400   16.941  37.610    18.425  107.388   43.081  5.2213 1.6070 7.3567 2.4754 -2.135351      2.951332  
1 1 1 6  20 23 o 3.3248 1.1427 -12.4973 14.741  -19.8006  15.926  31.206    38.957  2.2471 1.0952 4.4025 2.0059 -2.155364      2.285390  
1 1 1 6  20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  20 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  21 0  o 17.376 0.8776 320.186  30.113  326.343   43.698  314.617   41.556  17.520 1.2621 17.232 1.2198 -0.000000      0.000000  
1 1 1 6  21 1  o 11.361 0.7417 138.087  16.789  126.063   23.871  149.856   23.617  10.833 1.1018 11.888 0.9933 -1.055264      1.483397  
1 1 1 6  21 2  o 9.1881 0.8362 93.090   15.011  109.708   20.710  74.696    21.788  10.160 1.0192 8.2166 1.3259 1.943067       1.672359  
1 1 1 6  21 3  o 3.6928 1.0648 8.7258   12.470  4.0632    16.987  14.175    18.363  3.3782 1.4369 4.0073 1.5717 -0.6291127     2.129541  
1 1 1 6  21 4  o 5.7669 1.0658 39.509   13.866  61.004    19.197  16.064    20.049  7.3389 1.3579 4.1950 1.6431 3.143931       2.131585  
1 1 1 6  21 5  f 13.094 0.6907 182.612  17.915  202.412   24.776  160.918   25.934  13.903 0.8910 12.285 1.0555 1.617782       1.381333  
1 1 1 6  21 6  o 7.0681 1.0076 57.183   13.744  59.833    19.851  54.744    19.049  7.2298 1.4236 6.9063 1.4263 0.3234816      2.015155  
1 1 1 6  21 7  o 3.5069 0.9860 5.1920   11.431  18.824    15.902  -9.3821   16.442  4.2346 1.5002 2.7792 1.2800 1.455472       1.972044  
1 1 1 6  21 8  f 8.8797 0.8454 85.229   14.873  89.043    20.055  80.567    22.169  9.1514 1.0957 8.6080 1.2877 0.5434465      1.690819  
1 1 1 6  21 9  o 16.647 0.6127 288.751  20.360  301.936   28.443  274.896   29.157  17.061 0.8336 16.232 0.8981 0.8287411      1.225316  
1 1 1 6  21 10 o 6.0068 1.1462 42.991   14.202  36.533    20.036  49.513    20.135  5.5324 1.6705 6.4813 1.5699 -0.9489231     2.292396  
1 1 1 6  21 11 o 6.8746 1.0987 55.560   14.815  46.778    20.851  64.514    21.054  6.2532 1.6450 7.4960 1.4568 -1.242797      2.197378  
1 1 1 6  21 12 o 19.335 0.7606 397.749  25.630  400.800   29.856  389.204   49.972  19.742 0.7562 18.928 1.3201 0.8144760      1.521298  
1 1 1 6  21 13 o 5.0895 1.3343 26.892   15.859  26.238    17.826  29.375    34.733  4.8223 1.5916 5.3568 2.1420 -0.5345168     2.668595  
1 1 1 6  21 14 o 6.5005 1.2976 54.299   16.961  59.130    19.396  38.600    34.965  7.2437 1.3894 5.7572 2.1920 1.486450       2.595254  
1 1 1 6  21 15 o 15.491 0.8997 261.566  22.906  261.831   26.005  260.649   48.384  15.886 0.8185 15.096 1.6025 0.7899971      1.799440  
1 1 1 6  21 16 o 5.1785 1.3151 30.414   16.153  32.770    18.276  22.005    34.531  5.3033 1.5941 5.0537 2.0920 0.2496052      2.630160  
1 1 1 6  21 17 o 4.2143 1.2865 9.9514   16.501  9.1417    18.399  13.281    37.309  3.7057 1.5300 4.7229 2.0687 -1.017283      2.573046  
1 1 1 6  21 18 o 6.8614 1.1781 71.320   18.294  89.961    21.000  12.645    37.257  9.0688 1.1578 4.6541 2.0520 4.414700       2.356139  
1 1 1 6  21 19 o 4.6435 1.3733 17.278   16.874  12.184    18.563  41.502    40.483  3.7976 1.5487 5.4895 2.2682 -1.691905      2.746535  
1 1 1 6  21 20 o 5.5012 1.3489 45.591   17.309  46.514    19.303  41.804    39.104  5.9035 1.5965 5.0989 2.1747 0.8045540      2.697805  
1 1 1 6  21 21 o 4.2618 1.3369 17.266   19.895  12.805    22.777  31.621    40.859  3.8074 1.6424 4.7162 2.1099 -0.9088316     2.673774  
1 1 1 6  21 22 o 3.8045 1.2519 8.2368   23.452  17.251    29.697  -6.6983   38.226  3.9704 1.7858 3.6387 1.7550 0.3316987      2.503825  
1 1 1 6  21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  22 0  o 3.2712 1.4416 8.1546   19.384  23.393    29.460  -3.4786   25.740  3.8649 2.2662 2.6776 1.7826 -0.000000      0.000000  
1 1 1 6  22 1  o 5.9771 1.1310 42.963   14.250  54.246    19.515  30.074    20.857  6.8626 1.4663 5.0916 1.7224 1.770962       2.261995  
1 1 1 6  22 2  o 10.880 0.7370 125.561  16.004  134.585   22.649  116.562   22.618  11.294 1.0027 10.467 1.0805 0.8273401      1.474053  
1 1 1 6  22 3  o 12.136 0.7372 155.845  17.828  139.533   24.910  172.976   25.528  11.455 1.0873 12.816 0.9959 -1.360703      1.474473  
1 1 1 6  22 4  o 11.143 0.7601 130.903  16.881  118.002   22.930  146.170   24.943  10.539 1.0878 11.746 1.0617 -1.207010      1.520102  
1 1 1 6  22 5  o 10.607 0.7456 119.022  15.811  115.328   22.024  122.950   22.713  10.437 1.0551 10.777 1.0537 -0.3401442     1.491160  
1 1 1 6  22 6  o 7.4556 0.9772 62.330   14.192  57.042    20.551  67.150    19.622  7.0360 1.5059 7.8752 1.2458 -0.8391852     1.954443  
1 1 1 6  22 7  o 3.2348 1.0112 -4.5937  13.232  -14.9326  18.131  7.1887    19.355  2.7554 1.2939 3.7143 1.5543 -0.9588997     2.022368  
1 1 1 6  22 8  o 10.939 0.7786 128.539  16.807  104.470   23.473  153.854   24.074  9.8198 1.1952 12.058 0.9983 -2.238217      1.557259  
1 1 1 6  22 9  o 3.9875 1.1251 12.698   13.664  17.093    18.845  7.8254    19.842  4.2109 1.6078 3.7641 1.5743 0.4468024      2.250207  
1 1 1 6  22 10 o 8.9028 0.8810 85.459   15.670  84.713    21.640  86.282    22.722  8.8758 1.2190 8.9297 1.2723 -0.5395031E-01 1.762018  
1 1 1 6  22 11 o 4.1500 1.0268 12.247   12.540  -9.1410   17.754  33.539    17.715  2.9188 1.3390 5.3812 1.5571 -2.462369      2.053672  
1 1 1 6  22 12 o 5.8388 1.4085 35.644   16.952  30.390    19.085  55.283    36.901  5.1353 1.6434 6.5423 2.2880 -1.407035      2.817076  
1 1 1 6  22 13 o 3.1912 1.0597 -12.3756 15.137  -7.7619   17.301  -27.4384  31.260  2.9187 1.3325 3.4637 1.6480 -0.5449057     2.119331  
1 1 1 6  22 14 o 11.232 1.0695 130.517  19.969  121.689   22.433  164.216   43.829  10.716 1.0467 11.749 1.8653 -1.032681      2.138900  
1 1 1 6  22 15 o 3.6155 1.1544 -1.5845  15.901  1.9837    18.178  -13.2127  32.815  3.3757 1.4617 3.8553 1.7871 -0.4796143     2.308720  
1 1 1 6  22 16 o 5.0384 1.1022 31.258   17.291  53.405    19.259  -60.7986  39.264  6.7442 1.4693 3.3327 1.6434 3.411544       2.204485  
1 1 1 6  22 17 o 6.8693 1.4262 52.038   18.416  39.724    20.958  93.756    38.577  5.6390 1.7098 8.0996 2.2831 -2.460598      2.852386  
1 1 1 6  22 18 o 7.4282 1.2632 88.093   19.539  102.596   21.986  33.588    42.622  9.6191 1.1428 5.2374 2.2530 4.381664       2.526306  
1 1 1 6  22 19 o 4.2426 1.2761 19.952   17.339  21.376    19.513  14.606    37.807  4.1770 1.6251 4.3083 1.9680 -0.1313319     2.552299  
1 1 1 6  22 20 o 5.0327 1.3367 39.131   17.973  42.166    19.639  23.488    44.588  5.5081 1.6518 4.5572 2.1021 0.9509168      2.673401  
1 1 1 6  22 21 o 4.2399 1.2736 25.149   17.510  26.409    19.449  19.758    40.226  4.2934 1.6348 4.1863 1.9533 0.1070895      2.547171  
1 1 1 6  22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 0  o 3.6276 1.5131 19.470   18.773  20.249    26.406  18.674    26.694  3.6638 2.1468 3.5913 2.1329 -0.000000      0.000000  
1 1 1 6  23 1  o 3.2522 1.0342 -5.9796  14.125  -12.1831  19.159  1.4074    20.906  2.9362 1.3626 3.5682 1.5561 -0.6320302     2.068391  
1 1 1 6  23 2  o 4.3033 1.1392 16.278   13.953  4.2301    19.507  28.897    19.964  3.5890 1.5335 5.0177 1.6851 -1.428743      2.278457  
1 1 1 6  23 3  o 10.169 0.8056 109.591  16.292  97.374    21.776  125.125   24.555  9.5303 1.1424 10.807 1.1360 -1.277075      1.611125  
1 1 1 6  23 4  o 4.8286 1.1468 26.198   13.289  19.598    18.574  33.118    19.020  4.3586 1.6106 5.2987 1.6331 -0.9400887     2.293671  
1 1 1 6  23 5  o 9.3906 0.9034 98.006   15.848  67.680    21.876  131.504   22.992  7.6575 1.4820 11.124 1.0335 -3.466249      1.806738  
1 1 1 6  23 6  o 9.4755 1.1095 89.426   19.229  60.765    22.925  157.458   35.319  7.1467 1.6388 11.804 1.4960 -4.657585      2.218978  
1 1 1 6  23 7  o 3.7741 1.1019 7.5460   13.784  -0.0550   19.484  15.163    19.504  3.4027 1.4926 4.1454 1.6215 -0.7427487     2.203868  
1 1 1 6  23 8  o 9.6407 0.8794 100.232  16.899  104.627   23.367  95.413    24.469  9.8964 1.1806 9.3850 1.3036 0.5113382      1.758729  
1 1 1 6  23 9  o 13.975 0.6799 204.600  19.001  209.516   26.928  199.726   26.815  14.149 0.9516 13.801 0.9715 0.3474464      1.359897  
1 1 1 6  23 10 o 5.6213 1.0602 34.161   14.231  7.2684    19.721  63.384    20.558  3.7566 1.5702 7.4859 1.4252 -3.729280      2.120497  
1 1 1 6  23 11 o 3.0277 1.0032 -14.2667 14.729  -3.3199   16.822  -50.2416  30.495  3.0505 1.3600 3.0050 1.4752 0.4552770E-01  2.006417  
1 1 1 6  23 12 o 2.9819 1.0036 -16.5519 14.745  -7.7529   16.568  -50.0681  32.336  2.8447 1.3008 3.1190 1.5287 -0.2743170     2.007234  
1 1 1 6  23 13 o 4.9834 1.3234 27.140   17.706  33.834    19.966  2.4942    38.309  5.3775 1.6758 4.5894 2.0488 0.7880387      2.646874  
1 1 1 6  23 14 o 3.2930 1.0765 -9.1755  16.056  1.4464    18.208  -46.3159  34.047  3.3337 1.4531 3.2524 1.5886 0.8132172E-01  2.152973  
1 1 1 6  23 15 o 4.3989 1.2575 17.234   18.147  28.585    20.464  -24.5536  39.263  4.9098 1.7046 3.8880 1.8490 1.021784       2.514907  
1 1 1 6  23 16 o 4.2794 1.2906 13.792   18.452  18.084    21.312  0.9405    36.879  4.2694 1.6872 4.2894 1.9533 -0.2000380E-01 2.581119  
1 1 1 6  23 17 o 9.1558 1.4042 99.901   21.106  89.679    23.581  141.080   47.331  8.8227 1.3364 9.4890 2.4700 -0.6663570     2.808319  
1 1 1 6  23 18 o 11.089 1.1845 153.715  21.325  147.039   24.392  175.369   43.930  11.403 1.0696 10.776 2.1139 0.6270580      2.369076  
1 1 1 6  23 19 o 4.5695 1.2463 30.297   18.409  40.943    20.250  -20.4074  44.191  5.3746 1.6898 3.7643 1.8323 1.610319       2.492546  
1 1 1 6  23 20 o 5.8104 1.2140 62.741   18.752  74.060    20.877  15.491    42.656  7.4966 1.4448 4.1243 1.9514 3.372310       2.428082  
1 1 1 6  23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  23 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 0  o 12.175 1.1424 166.023  26.294  172.865   36.345  158.509   38.086  12.527 1.5087 11.824 1.7158 -0.000000      0.000000  
1 1 1 6  24 1  o 10.664 0.8153 122.067  17.381  124.496   24.998  119.793   24.184  10.761 1.1615 10.567 1.1444 0.1944084      1.630532  
1 1 1 6  24 2  o 13.839 0.7038 201.684  19.442  185.146   27.075  219.288   27.934  13.233 1.0230 14.444 0.9670 -1.210239      1.407694  
1 1 1 6  24 3  o 3.6211 1.0983 3.4878   14.108  0.8429    18.602  7.0681    21.644  3.3773 1.4705 3.8649 1.6318 -0.4875543     2.196679  
1 1 1 6  24 4  o 12.895 0.7055 174.582  18.180  182.836   25.820  166.465   25.603  13.210 0.9773 12.580 1.0176 0.6293821      1.410907  
1 1 1 6  24 5  o 6.2801 1.1888 46.503   15.731  32.244    22.212  60.850    22.281  5.2986 1.7775 7.2615 1.5792 -1.962910      2.377680  
1 1 1 6  24 6  o 6.9668 1.1646 57.059   15.961  57.789    22.067  56.257    23.113  7.0403 1.6031 6.8933 1.6896 0.1470056      2.329116  
1 1 1 6  24 7  o 5.4633 1.1392 34.310   14.953  12.065    21.886  53.785    20.478  4.1132 1.6800 6.8135 1.5391 -2.700314      2.278424  
1 1 1 6  24 8  o 3.8957 1.0243 1.9133   13.405  32.457    19.372  -26.1520  18.569  5.2847 1.6513 2.5067 1.2125 2.777968       2.048678  
1 1 1 6  24 9  o 5.4843 1.2345 34.946   15.249  28.970    20.399  42.515    22.958  5.0327 1.7034 5.9359 1.7872 -0.9032269     2.468910  
1 1 1 6  24 10 o 8.2220 0.9707 75.141   15.381  59.622    21.016  93.041    22.570  7.1752 1.5122 9.2689 1.2175 -2.093680      1.941420  
1 1 1 6  24 11 o 3.4606 1.1250 -8.6105  16.957  0.6010    19.486  -37.3589  34.424  3.4386 1.5009 3.4826 1.6761 -0.4400849E-01 2.249928  
1 1 1 6  24 12 o 8.5361 1.3012 76.943   19.730  59.592    22.894  127.034   38.899  7.0462 1.6531 10.026 2.0099 -2.979835      2.602355  
1 1 1 6  24 13 o 4.2816 1.2608 13.790   18.242  23.025    21.368  -11.0249  35.028  4.5922 1.7214 3.9711 1.8427 0.6210687      2.521680  
1 1 1 6  24 14 o 5.1498 1.4262 30.617   19.753  31.455    22.593  27.897    40.699  5.0855 1.7896 5.2140 2.2211 -0.1285248     2.852388  
1 1 1 6  24 15 o 4.8144 1.3965 24.882   20.076  24.540    23.536  25.793    38.462  4.6355 1.7900 4.9933 2.1439 -0.3578176     2.792945  
1 1 1 6  24 16 o 4.7112 1.3907 25.056   19.905  25.484    22.595  23.575    42.059  4.5791 1.7577 4.8433 2.1555 -0.2641621     2.781316  
1 1 1 6  24 17 o 8.7775 1.4069 95.787   21.016  79.416    23.802  153.699   44.767  7.8423 1.5723 9.7128 2.3336 -1.870502      2.813881  
1 1 1 6  24 18 o 3.5839 1.1910 0.2509   19.323  5.7846    21.315  -25.2745  45.778  3.4507 1.5352 3.7171 1.8212 -0.2664785     2.381955  
1 1 1 6  24 19 o 5.0283 1.3280 46.081   19.811  52.752    22.358  21.713    42.734  5.8327 1.7654 4.2239 1.9845 1.608815       2.656072  
1 1 1 6  24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  24 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 0  o 2.7634 1.3157 -14.3380 21.575  -37.3476  30.432  8.9162    30.593  2.2149 1.5767 3.3119 2.1069 -0.000000      0.000000  
1 1 1 6  25 1  o 8.9139 0.9327 86.528   16.611  82.214    22.881  91.334    24.152  8.6801 1.3180 9.1477 1.3201 -0.4676018     1.865447  
1 1 1 6  25 2  o 8.1839 1.0597 77.846   16.507  46.251    23.106  110.784   23.591  6.1952 1.7742 10.173 1.1595 -3.977484      2.119498  
1 1 1 6  25 3  o 8.8223 0.9525 85.348   16.743  88.009    22.993  82.345    24.427  9.0079 1.2763 8.6368 1.4141 0.3710995      1.904910  
1 1 1 6  25 4  o 5.8801 1.2410 40.458   16.246  27.272    22.423  55.026    23.570  4.9704 1.7793 6.7897 1.7306 -1.819302      2.482059  
1 1 1 6  25 5  f 4.2569 1.1618 10.403   15.680  32.412    22.509  -10.3439  21.855  5.2863 1.7893 3.2275 1.4825 2.058851       2.323611  
1 1 1 6  25 6  o 3.7598 1.1033 6.0161   14.054  16.494    20.229  -3.7608   19.540  4.2570 1.6551 3.2626 1.4594 0.9944322      2.206608  
1 1 1 6  25 7  o 11.103 0.8474 133.229  18.761  134.646   25.671  131.604   27.486  11.202 1.1458 11.004 1.2489 0.1974354      1.694862  
1 1 1 6  25 8  o 12.413 0.7745 165.026  19.083  184.924   26.786  144.521   27.193  13.233 1.0121 11.594 1.1727 1.639472       1.549065  
1 1 1 6  25 9  o 8.3581 1.0696 79.968   17.169  101.844   24.495  58.844    24.071  9.6952 1.2633 7.0210 1.7263 2.674135       2.139132  
1 1 1 6  25 10 o 5.1825 1.2879 32.452   18.628  46.122    21.965  -2.5604   35.154  6.1403 1.7200 4.2248 1.9174 1.915565       2.575818  
1 1 1 6  25 11 o 11.392 1.2145 165.531  22.418  179.702   26.456  129.446   42.217  12.970 1.0199 9.8149 2.2045 3.154648       2.429054  
1 1 1 6  25 12 o 8.6778 1.4092 91.808   21.581  84.400    24.991  113.534   42.797  8.4521 1.5349 8.9034 2.3638 -0.4512768     2.818451  
1 1 1 6  25 13 o 7.8579 1.3928 84.269   21.326  88.448    25.210  73.754    39.988  8.7554 1.4397 6.9604 2.3847 1.795057       2.785587  
1 1 1 6  25 14 o 5.4790 1.5035 36.593   20.792  29.782    23.785  58.667    42.817  4.8826 1.8189 6.0753 2.3945 -1.192656      3.006974  
1 1 1 6  25 15 o 3.4849 1.1711 -8.7420  19.300  -9.3414   22.285  -6.9436   38.601  3.0794 1.4424 3.8904 1.8453 -0.8110843     2.342117  
1 1 1 6  25 16 o 5.8515 1.5506 46.525   20.533  35.246    22.930  92.158    46.122  4.9837 1.7976 6.7193 2.5270 -1.735507      3.101146  
1 1 1 6  25 17 o 7.1272 1.3344 93.408   21.989  102.981   24.559  54.714    49.375  9.1266 1.3454 5.1278 2.3048 3.998787       2.668772  
1 1 1 6  25 18 o 3.8307 1.2343 14.031   19.475  17.289    21.851  1.4516    42.944  3.8108 1.6255 3.8505 1.8580 -0.3973866E-01 2.468679  
1 1 1 6  25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  25 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 0  o 2.4812 1.2058 -15.2327 19.544  -8.5588   27.637  -21.9095  27.643  2.6338 1.7816 2.3286 1.6254 -0.000000      0.000000  
1 1 1 6  26 1  o 4.6668 1.2462 22.460   16.004  26.214    21.802  18.074    23.565  4.8643 1.7531 4.4693 1.7716 0.3949881      2.492372  
1 1 1 6  26 2  o 7.8306 1.1268 71.635   17.047  63.973    23.782  79.732    24.448  7.3428 1.6586 8.3183 1.5257 -0.9755082     2.253615  
1 1 1 6  26 3  o 4.9568 1.2428 26.598   15.879  37.849    22.965  16.292    21.979  5.6045 1.8037 4.3091 1.7101 1.295380       2.485500  
1 1 1 6  26 4  o 10.011 0.9500 110.310  18.971  102.053   26.849  118.541   26.808  9.5986 1.3986 10.424 1.2859 -0.8250217     1.899908  
1 1 1 6  26 5  o 6.5707 1.3989 46.614   18.878  33.117    22.506  78.653    34.675  5.3281 1.7892 7.8133 2.1510 -2.485162      2.797827  
1 1 1 6  26 6  o 4.3653 1.2177 16.561   15.770  12.169    22.320  20.940    22.284  4.1397 1.6944 4.5910 1.7495 -0.4513063     2.435493  
1 1 1 6  26 7  o 4.9021 1.2771 26.770   16.480  25.334    22.703  28.369    23.959  4.8032 1.7795 5.0011 1.8323 -0.1978879     2.554185  
1 1 1 6  26 8  o 6.4340 1.2752 51.515   17.039  57.337    25.300  46.684    23.049  6.7491 1.8288 6.1190 1.7778 0.6301317      2.550492  
1 1 1 6  26 9  o 6.8862 1.3523 67.100   20.453  79.713    24.478  37.928    37.227  8.2165 1.5463 5.5559 2.2190 2.660624       2.704624  
1 1 1 6  26 10 o 6.4146 1.4861 55.555   21.009  55.890    24.520  54.630    40.744  6.6375 1.8012 6.1918 2.3642 0.4457140      2.972101  
1 1 1 6  26 11 o 7.4043 1.3535 79.017   21.901  94.867    26.596  45.631    38.600  9.0446 1.4703 5.7640 2.2729 3.280654       2.707031  
1 1 1 6  26 12 o 6.2463 1.4726 41.522   21.012  19.198    24.649  100.861   40.187  4.3689 1.7835 8.1238 2.3437 -3.754877      2.945168  
1 1 1 6  26 13 o 6.3210 1.4612 64.175   22.036  69.599    25.382  47.573    44.405  7.1903 1.7756 5.4517 2.3211 1.738568       2.922404  
1 1 1 6  26 14 o 6.0675 1.3818 61.584   21.099  71.130    24.554  34.637    41.254  7.2301 1.7225 4.9049 2.1612 2.325168       2.763647  
1 1 1 6  26 15 o 5.2861 1.2970 46.859   21.230  63.419    24.010  -12.4812  45.450  6.6575 1.7720 3.9147 1.8944 2.742835       2.593938  
1 1 1 6  26 16 o 5.0384 1.4599 31.467   20.681  12.966    23.688  90.784    42.415  3.7354 1.6420 6.3414 2.4143 -2.605965      2.919780  
1 1 1 6  26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  26 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 0  o 10.474 1.3888 130.575  26.043  122.149   36.305  139.508   37.378  10.036 2.0444 10.911 1.8804 -0.000000      0.000000  
1 1 1 6  27 1  f 6.6958 1.2846 55.775   17.682  59.320    24.281  51.772    25.801  6.9724 1.7453 6.4192 1.8855 0.5531449      2.569249  
1 1 1 6  27 2  o 4.3762 1.2301 15.584   16.723  28.124    23.792  3.3375    23.512  4.9707 1.8251 3.7818 1.6497 1.188867       2.460243  
1 1 1 6  27 3  o 5.1309 1.3145 30.835   17.420  35.394    25.073  26.581    24.220  5.3846 1.8859 4.8773 1.8318 0.5072966      2.629091  
1 1 1 6  27 4  o 6.3954 1.0846 48.050   16.717  85.749    23.504  9.4531    23.782  8.7665 1.3406 4.0242 1.7055 4.742270       2.169272  
1 1 1 6  27 5  o 6.4343 1.2320 50.451   17.653  25.802    24.280  78.092    25.712  4.8158 1.8283 8.0528 1.6519 -3.237043      2.464020  
1 1 1 6  27 6  o 4.9086 1.3104 27.545   17.582  28.520    25.013  26.592    24.719  4.9624 1.8620 4.8547 1.8444 0.1076608      2.620827  
1 1 1 6  27 7  o 4.4948 1.2566 20.019   17.027  11.994    25.377  26.589    22.963  4.1797 1.7660 4.8099 1.7881 -0.6302409     2.513196  
1 1 1 6  27 8  o 4.3726 1.2503 17.988   16.962  20.270    24.023  15.720    23.952  4.4818 1.7849 4.2635 1.7513 0.2182870      2.500607  
1 1 1 6  27 9  o 5.0805 1.4294 25.458   20.522  13.481    24.661  52.429    37.007  4.1556 1.7475 6.0054 2.2626 -1.849880      2.858884  
1 1 1 6  27 10 o 4.7218 1.3450 24.883   21.010  37.479    24.969  -5.6526   38.879  5.3168 1.8803 4.1268 1.9238 1.189990       2.690071  
1 1 1 6  27 11 o 4.2285 1.3303 12.946   20.210  11.723    23.203  16.791    41.137  3.8911 1.6678 4.5659 2.0730 -0.6748571     2.660587  
1 1 1 6  27 12 o 3.6700 1.1957 1.4702   19.607  8.9317    22.651  -20.8272  39.156  3.6901 1.6142 3.6498 1.7643 0.4023886E-01  2.391345  
1 1 1 6  27 13 o 5.7532 1.2176 56.231   21.014  78.628    23.835  -21.9548  44.532  7.7262 1.5953 3.7801 1.8399 3.946120       2.435196  
1 1 1 6  27 14 o 7.4035 1.3612 96.463   21.823  104.908   25.065  70.003    44.365  9.1738 1.3661 5.6332 2.3548 3.540586       2.722405  
1 1 1 6  27 15 o 3.8763 1.1765 13.383   20.016  34.650    22.750  -59.4858  42.111  4.6656 1.7701 3.0869 1.5501 1.578689       2.352922  
1 1 1 6  27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  27 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 0  o 8.0732 1.8357 93.602   26.249  80.797    35.250  109.539   39.327  7.2583 2.6398 8.8881 2.5515 -0.000000      0.000000  
1 1 1 6  28 1  o 5.7460 1.3056 42.122   17.204  35.601    24.685  48.281    23.990  5.3408 1.8712 6.1513 1.8212 -0.8104711     2.611194  
1 1 1 6  28 2  o 3.3199 1.0869 -10.6779 17.093  -12.8726  24.779  -8.6851   23.611  3.3007 1.5377 3.3390 1.5363 -0.3833461E-01 2.173702  
1 1 1 6  28 3  o 5.7268 1.2851 40.651   17.307  25.382    23.882  57.537    25.115  4.7477 1.8107 6.7060 1.8242 -1.958248      2.570256  
1 1 1 6  28 4  o 3.8294 1.1065 -9.0183  16.464  -45.3530  22.347  34.122    24.350  2.4288 1.2052 5.2301 1.8560 -2.801327      2.213009  
1 1 1 6  28 5  o 9.3460 1.0517 101.846  19.651  101.139   28.087  102.525   27.504  9.2927 1.5113 9.3994 1.4631 -0.1066675     2.103441  
1 1 1 6  28 6  o 4.1054 1.0576 -9.5788  16.913  -74.9278  24.853  46.794    23.083  2.2272 1.1272 5.9836 1.7899 -3.756441      2.115285  
1 1 1 6  28 7  o 6.7130 1.3102 60.221   18.184  63.278    25.857  57.230    25.577  6.9015 1.8398 6.5244 1.8660 0.3770280      2.620480  
1 1 1 6  28 8  o 6.5355 1.5121 55.528   22.317  34.387    27.035  100.748   39.540  5.0711 1.9283 7.9999 2.3297 -2.928760      3.024174  
1 1 1 6  28 9  o 3.4205 1.1668 -16.4079 21.611  -13.5226  25.269  -24.2644  41.698  3.1481 1.4931 3.6929 1.7935 -0.5447974     2.333683  
1 1 1 6  28 10 o 5.0333 1.4200 37.242   20.634  37.463    24.015  36.619    40.333  5.1005 1.8396 4.9661 2.1637 0.1344409      2.840028  
1 1 1 6  28 11 o 4.6902 1.4324 16.637   21.070  -0.2307   24.008  73.172    43.954  3.4073 1.5609 5.9731 2.4021 -2.565792      2.864707  
1 1 1 6  28 12 o 3.8389 1.2442 9.1734   20.142  10.602    23.470  5.1807    39.241  3.6893 1.6276 3.9886 1.8824 -0.2992291     2.488490  
1 1 1 6  28 13 o 4.3741 1.3374 29.365   20.615  30.567    23.608  25.504    42.304  4.4484 1.7701 4.2998 2.0052 0.1485696      2.674735  
1 1 1 6  28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  28 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 0  o 2.7764 1.3406 -9.6198  23.223  -15.2603  32.287  -3.5736   33.429  2.6228 1.8132 2.9300 1.9752 -0.000000      0.000000  
1 1 1 6  29 1  o 4.1333 1.2461 13.119   18.174  10.548    26.253  15.485    25.184  4.0563 1.7565 4.2103 1.7680 -0.1540709     2.492237  
1 1 1 6  29 2  o 8.1908 1.2389 86.350   19.680  84.432    28.059  88.206    27.609  8.0590 1.7876 8.3225 1.7157 -0.2634954     2.477761  
1 1 1 6  29 3  o 4.6988 1.3045 24.895   18.175  13.885    24.365  38.706    27.290  4.0863 1.7287 5.3112 1.9540 -1.224955      2.608955  
1 1 1 6  29 4  o 5.0910 1.4326 35.707   21.531  36.969    26.476  33.244    36.997  5.1644 1.9200 5.0175 2.1268 0.1469102      2.865288  
1 1 1 6  29 5  o 5.3922 1.3386 42.548   17.957  47.828    25.653  37.474    25.146  5.6829 1.9102 5.1015 1.8759 0.5814424      2.677261  
1 1 1 6  29 6  f 4.6883 1.1965 22.875   18.122  -15.3447  26.449  56.699    24.881  3.1628 1.5079 6.2138 1.8582 -3.051051      2.393046  
1 1 1 6  29 7  o 4.2829 1.3313 1.4974   21.358  -22.6321  25.786  54.217    38.115  2.9842 1.4399 5.5816 2.2396 -2.597477      2.662559  
1 1 1 6  29 8  o 3.0108 1.0580 -43.2916 21.030  -55.3369  25.594  -18.2587  36.897  2.4358 1.2211 3.5857 1.7282 -1.149913      2.116058  
1 1 1 6  29 9  o 5.1824 1.4851 42.111   21.691  35.013    25.061  63.309    43.308  4.8192 1.8508 5.5457 2.3231 -0.7264471     2.970225  
1 1 1 6  29 10 o 4.7386 1.3850 36.472   20.809  37.538    24.089  33.336    41.301  4.8903 1.8288 4.5869 2.0804 0.3033671      2.769959  
1 1 1 6  29 11 o 3.6120 1.2162 -0.1647  21.618  -4.7289   25.424  11.750    41.077  3.2203 1.5184 4.0038 1.9004 -0.7835076     2.432491  
1 1 1 6  29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  29 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 0  o 2.2454 1.1342 -35.6891 23.022  -46.5011  32.879  -25.2890  32.247  2.1129 1.5249 2.3779 1.6794 -0.000000      0.000000  
1 1 1 6  30 1  o 5.7484 1.2613 45.277   18.549  77.181    26.753  15.743    25.740  7.4274 1.8161 4.0694 1.7507 3.357928       2.522582  
1 1 1 6  30 2  o 3.3303 1.0944 -6.3153  17.601  -13.1777  24.252  1.3208    25.583  3.0965 1.4670 3.5642 1.6246 -0.4676938     2.188868  
1 1 1 6  30 3  o 5.1717 1.3134 37.984   18.845  17.141    26.725  58.598    26.578  4.1237 1.7790 6.2197 1.9327 -2.095940      2.626806  
1 1 1 6  30 4  o 5.3133 1.3782 44.274   19.182  44.922    26.990  43.612    27.266  5.3526 1.9472 5.2739 1.9509 0.7868481E-01  2.756354  
1 1 1 6  30 5  o 3.0414 1.0277 -17.1904 17.552  -3.3990   25.880  -28.9367  23.884  3.3825 1.5744 2.7003 1.3214 0.6822505      2.055461  
1 1 1 6  30 6  o 5.1596 1.3720 45.908   23.238  63.882    27.381  -0.3738   43.938  6.3143 1.9616 4.0049 1.9186 2.309426       2.743917  
1 1 1 6  30 7  o 5.5112 1.4606 58.707   23.458  64.647    27.108  40.998    46.808  6.2856 1.9517 4.7367 2.1734 1.548917       2.921104  
1 1 1 6  30 8  o 3.3835 1.1225 -4.7150  20.515  12.896    23.856  -54.7114  40.196  3.6952 1.6350 3.0719 1.5386 0.6233416      2.245069  
1 1 1 6  30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  30 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 0  o 3.0251 1.4539 -2.8671  27.534  25.890    38.630  -32.5644  39.256  3.5885 2.3154 2.4617 1.7590 -0.000000      0.000000  
1 1 1 6  31 1  o 4.8053 1.3077 35.290   19.317  58.219    27.549  13.114    27.093  5.8036 1.9794 3.8070 1.7095 1.996587       2.615426  
1 1 1 6  31 2  o 3.2804 1.0808 -4.2251  17.592  11.108    25.406  -18.3473  24.382  3.6872 1.6556 2.8736 1.3898 0.8135953      2.161624  
1 1 1 6  31 3  o 3.2943 1.0931 -2.5817  18.233  -3.2697   25.499  -1.8618   26.083  3.2642 1.5334 3.3245 1.5582 -0.6035256E-01 2.186150  
1 1 1 6  31 4  o 5.6175 1.3038 51.304   19.849  85.089    28.396  19.022    27.757  7.2642 1.9240 3.9708 1.7599 3.293444       2.607502  
1 1 1 6  31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  31 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  32 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  33 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  34 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  35 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  36 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  36 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  36 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  36 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 6  36 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  1  0  o 17.546 0.6941 312.037  24.165  303.372   34.442  320.438   33.915  17.299 1.0032 17.793 0.9594 -0.000000      0.000000  
1 1 1 7  1  1  o 9.8566 0.5104 97.550   10.060  95.865    14.228  99.235    14.226  9.7711 0.7281 9.9421 0.7155 -0.1709309     1.020779  
1 1 1 7  1  2  o 14.504 0.4866 211.178  14.114  212.486   19.875  209.847   20.047  14.550 0.6830 14.458 0.6933 0.9144020E-01  0.9732181 
1 1 1 7  1  3  o 26.281 0.5635 672.717  26.059  739.267   51.995  650.393   30.114  27.094 0.9595 25.469 0.5912 1.625401       1.127033  
1 1 1 7  1  4  o 40.711 0.6536 1664.56  46.325  1673.36   91.945  1661.57   53.630  40.722 1.1289 40.699 0.6589 0.2264786E-01  1.307127  
1 1 1 7  1  5  o 29.598 0.5857 864.194  30.341  914.794   60.510  847.200   35.068  30.130 1.0042 29.066 0.6032 1.063541       1.171421  
1 1 1 7  1  6  o 19.483 0.4914 381.200  19.146  385.992   27.029  376.374   27.126  19.607 0.6893 19.360 0.7006 0.2471066      0.9827910 
1 1 1 7  1  7  o 20.629 0.4945 427.415  20.398  433.495   28.784  421.282   28.911  20.777 0.6927 20.481 0.7058 0.2963924      0.9889337 
1 1 1 7  1  8  o 22.332 0.4981 500.323  22.247  498.257   31.431  502.397   31.492  22.286 0.7052 22.378 0.7036 -0.9255600E-01 0.9961839 
1 1 1 7  1  9  o 23.100 0.4997 535.407  23.087  530.992   32.500  539.905   32.802  23.004 0.7064 23.196 0.7071 -0.1921959     0.9994708 
1 1 1 7  1  10 o 17.437 0.4990 305.315  17.374  322.386   24.451  287.905   24.691  17.931 0.6818 16.942 0.7287 0.9892502      0.9979205 
1 1 1 7  1  11 o 36.620 0.5495 1346.50  40.242  1326.60   56.716  1366.67   57.108  36.347 0.7802 36.893 0.7740 -0.5461617     1.098964  
1 1 1 7  1  12 o 12.795 0.5196 164.179  13.278  152.319   18.392  177.088   19.188  12.313 0.7469 13.278 0.7225 -0.9654226     1.039176  
1 1 1 7  1  13 o 36.353 0.5509 1329.38  40.042  1287.02   56.347  1372.60   56.914  35.765 0.7877 36.940 0.7703 -1.174892      1.101800  
1 1 1 7  1  14 o 3.3430 0.8452 9.6974   7.1248  8.9619    9.6030  10.598    10.626  3.2307 1.1635 3.4554 1.2261 -0.2247517     1.690327  
1 1 1 7  1  15 o 11.343 0.6501 131.067  14.169  129.628   23.474  131.892   17.771  11.268 1.0416 11.418 0.7782 -0.1498814     1.300228  
1 1 1 7  1  16 o 13.851 0.5275 195.088  14.590  180.798   20.421  209.988   20.853  13.327 0.7662 14.376 0.7253 -1.048782      1.054997  
1 1 1 7  1  17 o 12.369 0.5517 156.381  13.591  169.414   18.997  142.717   19.451  12.911 0.7357 11.827 0.8223 1.084513       1.103401  
1 1 1 7  1  18 f 9.3454 0.7702 95.769   13.245  105.272   16.414  78.032    22.425  10.134 0.8099 8.5570 1.3103 1.576889       1.540395  
1 1 1 7  1  19 o 4.7705 0.9486 25.279   9.4250  24.317    13.111  26.307    13.558  4.6820 1.3350 4.8589 1.3479 -0.1768484     1.897104  
1 1 1 7  1  20 o 9.5849 0.5588 95.124   10.696  98.280    14.919  91.786    15.344  9.7588 0.7644 9.4109 0.8152 0.3479214      1.117506  
1 1 1 7  1  21 o 8.9883 0.5319 84.684   9.3547  76.774    14.381  90.487    12.317  8.5840 0.8377 9.3926 0.6557 -0.8086319     1.063753  
1 1 1 7  1  22 o 5.3361 0.6811 31.066   6.9604  26.686    10.516  34.480    9.2851  4.9091 1.0985 5.7630 0.8056 -0.8538704     1.362258  
1 1 1 7  1  23 o 11.289 0.4511 134.122  9.8667  105.341   14.730  157.545   13.288  10.121 0.7277 12.457 0.5334 -2.335997      0.9022101 
1 1 1 7  1  24 o 6.1557 0.6228 41.208   7.1618  34.337    11.173  46.000    9.3307  5.6198 1.0321 6.6917 0.6972 -1.071860      1.245528  
1 1 1 7  1  25 o 5.5778 0.6935 32.974   7.4906  34.274    11.500  32.016    9.8723  5.6115 1.0636 5.5441 0.8903 0.6739664E-01  1.387035  
1 1 1 7  1  26 o 14.622 0.4251 218.052  12.411  219.329   18.114  216.922   17.038  14.654 0.6181 14.590 0.5839 0.6422329E-01  0.8502682 
1 1 1 7  1  27 o 12.059 0.4622 149.300  11.135  150.516   16.140  148.196   15.383  12.099 0.6670 12.018 0.6400 0.8048439E-01  0.9243774 
1 1 1 7  1  28 o 4.1173 0.8798 19.283   7.9984  14.988    11.585  23.196    11.057  3.7292 1.2832 4.5053 1.2040 -0.7760384     1.759668  
1 1 1 7  1  29 f 6.5541 0.7388 48.498   9.3478  41.493    13.324  55.287    13.118  5.9759 1.1567 7.1324 0.9196 -1.156520      1.477666  
1 1 1 7  1  30 o 4.2648 0.8466 21.813   8.8954  37.056    12.299  5.0935    12.881  5.5840 1.1398 2.9456 1.2520 2.638442       1.693179  
1 1 1 7  1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  2  0  o 23.419 0.6984 553.485  32.577  551.432   46.366  555.487   45.780  23.375 0.9959 23.464 0.9794 -0.000000      0.000000  
1 1 1 7  2  1  o 24.235 0.4921 589.492  23.852  585.924   33.721  593.064   33.742  24.161 0.6978 24.309 0.6940 -0.1472492     0.9841964 
1 1 1 7  2  2  o 21.931 0.4869 482.634  21.355  484.415   30.199  480.852   30.202  21.972 0.6872 21.890 0.6898 0.8124352E-01  0.9737388 
1 1 1 7  2  3  o 16.520 0.4817 273.841  15.912  268.281   22.486  279.419   22.521  16.352 0.6876 16.689 0.6747 -0.3370285     0.9633464 
1 1 1 7  2  4  o 39.335 0.5587 1554.59  43.949  1533.07   62.101  1576.18   62.204  39.061 0.7949 39.609 0.7852 -0.5477180     1.117358  
1 1 1 7  2  5  o 22.092 0.4913 490.024  21.707  485.334   30.703  494.711   30.694  21.986 0.6983 22.198 0.6914 -0.2122440     0.9826261 
1 1 1 7  2  6  o 17.596 0.4879 310.980  17.170  307.516   24.293  314.438   24.271  17.498 0.6942 17.694 0.6858 -0.1967697     0.9758545 
1 1 1 7  2  7  o 9.4069 0.6417 89.202   10.293  88.611    21.009  89.389    11.807  9.3722 1.1208 9.4417 0.6253 -0.6944656E-01 1.283432  
1 1 1 7  2  8  o 15.082 0.5677 222.956  14.960  240.019   30.034  217.326   17.252  15.441 0.9726 14.724 0.5859 0.7166605      1.135385  
1 1 1 7  2  9  o 10.546 0.6265 112.947  11.235  109.466   22.880  114.053   12.896  10.424 1.0975 10.667 0.6045 -0.2438259     1.252971  
1 1 1 7  2  10 o 14.639 0.5780 214.351  14.676  216.856   29.357  213.517   16.945  14.681 0.9998 14.597 0.5804 0.8416748E-01  1.156061  
1 1 1 7  2  11 o 38.452 0.6555 1517.35  43.756  1427.40   85.749  1549.01   50.878  37.606 1.1401 39.299 0.6473 -1.692245      1.311048  
1 1 1 7  2  12 f 31.953 0.5323 1026.24  34.019  1024.52   48.063  1027.96   48.157  31.926 0.7527 31.980 0.7529 -0.5351639E-01 1.064654  
1 1 1 7  2  13 o 9.4971 0.5698 90.859   10.794  91.825    14.780  89.756    15.801  9.5536 0.7735 9.4405 0.8369 0.1131115      1.139607  
1 1 1 7  2  14 o 9.9815 0.5668 100.417  11.298  93.020    15.631  108.509   16.349  9.5958 0.8145 10.367 0.7885 -0.7714319     1.133628  
1 1 1 7  2  15 o 10.461 0.5743 110.780  11.915  92.508    16.466  130.867   17.264  9.5474 0.8623 11.374 0.7589 -1.827021      1.148688  
1 1 1 7  2  16 o 18.093 0.6391 340.547  21.693  323.324   37.298  349.351   26.667  17.654 1.0563 18.531 0.7195 -0.8766346     1.278116  
1 1 1 7  2  17 o 17.965 0.5239 329.419  18.784  354.448   26.576  304.435   26.552  18.661 0.7121 17.269 0.7688 1.391661       1.047885  
1 1 1 7  2  18 f 3.7813 0.8183 9.7394   8.4992  -7.0299   11.498  29.937    12.619  2.3528 1.0787 5.2098 1.2307 -2.857028      1.636508  
1 1 1 7  2  19 f 10.321 0.6225 111.656  12.667  126.380   17.412  95.104    18.462  11.089 0.7851 9.5536 0.9662 1.535610       1.244992  
1 1 1 7  2  20 o 10.489 0.6013 117.108  12.214  128.738   15.978  100.757   18.945  11.190 0.7139 9.7884 0.9677 1.401846       1.202589  
1 1 1 7  2  21 o 4.0838 0.8718 18.056   9.1402  30.280    11.903  0.4899    14.268  5.1986 1.1727 2.9691 1.2903 2.229534       1.743636  
1 1 1 7  2  22 o 5.3553 0.9529 33.806   10.285  39.279    13.299  25.662    16.223  5.9649 1.1565 4.7456 1.5148 1.219348       1.905835  
1 1 1 7  2  23 o 12.072 0.5042 151.117  11.991  140.554   18.214  159.195   15.929  11.664 0.7808 12.480 0.6382 -0.8159523     1.008424  
1 1 1 7  2  24 o 6.5893 0.6260 45.354   8.2142  43.500    12.021  46.978    11.250  6.4483 0.9321 6.7303 0.8358 -0.2820411     1.251970  
1 1 1 7  2  25 o 7.8546 0.5461 63.130   8.4673  66.470    13.209  60.800    11.032  8.0133 0.8242 7.6959 0.7167 0.3174548      1.092265  
1 1 1 7  2  26 o 20.796 0.4071 441.369  16.880  424.074   24.520  456.949   23.273  20.391 0.6013 21.201 0.5489 -0.8101997     0.8141090 
1 1 1 7  2  27 o 5.1030 0.8354 29.313   8.2872  29.572    12.733  29.122    10.916  5.0899 1.2580 5.1161 1.0995 -0.2619934E-01 1.670803  
1 1 1 7  2  28 o 4.1225 0.9002 19.474   8.1496  18.145    12.530  20.448    10.729  4.0159 1.3348 4.2291 1.2083 -0.2132025     1.800459  
1 1 1 7  2  29 o 5.5719 0.8589 37.526   9.3026  32.275    13.660  42.067    12.704  5.1081 1.3256 6.0358 1.0926 -0.9276443     1.717849  
1 1 1 7  2  30 o 4.2649 0.9340 23.016   9.1882  15.300    13.192  30.285    12.805  3.6181 1.3533 4.9116 1.2878 -1.293480      1.868073  
1 1 1 7  2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  3  0  o 14.795 0.6893 222.413  20.187  230.357   28.769  214.707   28.334  15.061 0.9641 14.529 0.9855 -0.000000      0.000000  
1 1 1 7  3  1  o 20.505 0.4811 421.918  19.722  435.635   27.961  408.337   27.822  20.838 0.6709 20.173 0.6896 0.6653042      0.9621188 
1 1 1 7  3  2  o 18.854 0.4806 356.737  18.115  345.134   25.575  368.418   25.662  18.545 0.6895 19.162 0.6696 -0.6172714     0.9611555 
1 1 1 7  3  3  o 41.717 0.5669 1748.90  47.298  1753.03   66.936  1744.78   66.843  41.766 0.8013 41.667 0.8021 0.9860229E-01  1.133793  
1 1 1 7  3  4  o 13.693 0.4874 188.268  13.346  186.690   18.915  189.833   18.835  13.636 0.6936 13.751 0.6849 -0.1150131     0.9747173 
1 1 1 7  3  5  o 11.073 0.5067 123.185  11.221  123.333   15.918  123.039   15.820  11.080 0.7183 11.067 0.7148 0.1294613E-01  1.013379  
1 1 1 7  3  6  o 11.417 0.5074 130.875  11.584  133.019   16.308  128.692   16.456  11.512 0.7083 11.322 0.7268 0.1899023      1.014854  
1 1 1 7  3  7  o 22.780 0.4916 520.583  22.399  526.201   31.803  515.053   31.552  22.902 0.6943 22.658 0.6963 0.2440910      0.9832911 
1 1 1 7  3  8  o 3.2598 0.7786 9.9455   6.0429  8.7977    8.5952  11.067    8.4975  3.1461 1.1040 3.3736 1.0982 -0.2274961     1.557213  
1 1 1 7  3  9  o 27.175 0.5112 740.861  27.775  722.504   39.342  759.103   39.218  26.838 0.7329 27.512 0.7128 -0.6736565     1.022361  
1 1 1 7  3  10 o 18.870 0.5708 357.595  18.759  357.704   37.179  357.558   21.727  18.852 0.9861 18.888 0.5751 -0.3656387E-01 1.141552  
1 1 1 7  3  11 o 34.889 0.6328 1243.23  38.297  1187.97   75.437  1262.42   44.451  34.302 1.0996 35.475 0.6265 -1.172966      1.265559  
1 1 1 7  3  12 o 22.652 0.5871 521.515  22.964  506.648   45.747  526.524   26.552  22.396 1.0213 22.909 0.5795 -0.5130138     1.174287  
1 1 1 7  3  13 o 11.556 0.6527 137.530  12.477  129.837   26.218  139.782   14.187  11.313 1.1588 11.800 0.6012 -0.4871931     1.305454  
1 1 1 7  3  14 o 23.126 0.5868 538.122  27.141  0.0000    0.0000  538.122   27.141  ?      ?      23.126 0.5868 ?              ?         
1 1 1 7  3  15 o 6.1491 0.9612 38.018   10.789  49.325    19.806  33.246    12.865  6.7236 1.5098 5.5745 1.1901 1.149066       1.922485  
1 1 1 7  3  16 o 13.648 0.7023 200.094  17.430  171.323   30.715  213.760   21.168  12.799 1.1999 14.498 0.7300 -1.699128      1.404537  
1 1 1 7  3  17 o 10.132 0.7745 111.304  14.353  96.787    25.091  118.365   17.499  9.5215 1.3176 10.742 0.8145 -1.220211      1.549036  
1 1 1 7  3  18 o 8.5689 1.1014 85.957   17.813  107.283   24.062  60.101    26.495  10.040 1.1983 7.0977 1.8482 2.942356       2.202710  
1 1 1 7  3  19 o 5.4065 0.9808 36.092   12.087  10.094    20.800  49.348    14.852  3.9798 1.6331 6.8333 1.0867 -2.853500      1.961605  
1 1 1 7  3  20 o 16.107 0.5803 268.424  18.634  273.173   27.556  264.423   25.293  16.218 0.8496 15.996 0.7906 0.2219419      1.160548  
1 1 1 7  3  21 o 4.6718 1.0034 25.151   11.332  8.9488    17.525  36.794    14.856  3.6678 1.5013 5.6758 1.3316 -2.008000      2.006798  
1 1 1 7  3  22 o 10.134 0.7579 108.432  15.279  114.165   23.038  103.931   20.413  10.349 1.1131 9.9189 1.0290 0.4300671      1.515852  
1 1 1 7  3  23 o 14.109 0.6556 209.992  18.361  193.591   26.914  224.271   25.112  13.542 0.9937 14.676 0.8556 -1.134113      1.311293  
1 1 1 7  3  24 o 7.8714 0.9820 68.938   15.000  66.193    22.292  71.210    20.276  7.6126 1.5174 8.1302 1.2470 -0.5175595     1.964029  
1 1 1 7  3  25 o 12.489 0.7209 164.107  17.995  172.373   26.013  156.521   24.919  12.792 1.0167 12.186 1.0224 0.6058540      1.441895  
1 1 1 7  3  26 o 4.5791 1.1162 21.375   12.309  15.114    15.771  31.135    19.690  3.9741 1.4810 5.1840 1.6703 -1.209886      2.232342  
1 1 1 7  3  27 o 4.2995 1.0082 19.485   10.194  28.784    15.943  13.053    13.259  4.9420 1.4896 3.6570 1.3589 1.285067       2.016351  
1 1 1 7  3  28 o 4.1460 1.0011 19.590   10.531  9.9162    16.448  26.312    13.710  3.5794 1.4586 4.7125 1.3716 -1.133075      2.002193  
1 1 1 7  3  29 o 4.0953 0.9831 15.326   11.119  38.390    17.076  -1.6548   14.652  5.4132 1.5166 2.7775 1.2513 2.635725       1.966173  
1 1 1 7  3  30 o 10.271 0.7023 118.918  14.374  127.072   21.478  112.302   19.345  10.559 1.0170 9.9833 0.9689 0.5758924      1.404654  
1 1 1 7  3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  4  0  o 35.447 0.7568 1265.58  53.542  1276.65   76.070  1254.71   75.376  35.601 1.0706 35.293 1.0701 -0.000000      0.000000  
1 1 1 7  4  1  o 13.120 0.4828 172.744  12.668  175.864   18.039  169.708   17.793  13.237 0.6814 13.003 0.6842 0.2339115      0.9656429 
1 1 1 7  4  2  o 14.289 0.4843 205.055  13.835  210.524   19.515  199.527   19.618  14.482 0.6738 14.097 0.6958 0.3850965      0.9685779 
1 1 1 7  4  3  o 46.582 0.5944 2183.40  55.373  2179.90   78.314  2186.90   78.304  46.545 0.8413 46.620 0.8398 -0.7511139E-01 1.188717  
1 1 1 7  4  4  o 30.808 0.5139 953.754  31.660  941.016   44.742  966.530   44.807  30.601 0.7310 31.015 0.7223 -0.4138718     1.027712  
1 1 1 7  4  5  o 8.4657 0.5482 72.109   9.2548  65.758    13.069  78.497    13.108  8.0895 0.8078 8.8418 0.7412 -0.7522745     1.096319  
1 1 1 7  4  6  f 20.011 0.4862 401.709  19.452  413.892   27.573  389.636   27.447  20.314 0.6787 19.708 0.6964 0.6058102      0.9723706 
1 1 1 7  4  7  o 32.661 0.5242 1070.83  34.235  1100.20   48.618  1041.94   48.216  33.107 0.7343 32.216 0.7483 0.8907051      1.048398  
1 1 1 7  4  8  o 13.788 0.4985 190.807  13.711  208.695   19.537  173.446   19.247  14.427 0.6771 13.149 0.7319 1.277637       0.9970347 
1 1 1 7  4  9  o 32.372 0.6474 1062.13  39.445  1027.41   67.936  1079.79   48.447  31.940 1.0635 32.804 0.7384 -0.8640327     1.294730  
1 1 1 7  4  10 o 9.2625 0.5483 86.419   10.118  78.070    14.359  94.653    14.260  8.8147 0.8145 9.7102 0.7343 -0.8954906     1.096635  
1 1 1 7  4  11 o 10.480 0.5343 110.377  11.198  111.583   15.991  109.216   15.687  10.536 0.7589 10.424 0.7524 0.1118879      1.068635  
1 1 1 7  4  12 o 19.789 0.6514 410.873  23.862  350.113   40.865  442.308   29.393  18.599 1.0986 20.980 0.7005 -2.380341      1.302897  
1 1 1 7  4  13 o 27.070 0.6107 756.725  28.267  707.814   56.516  773.042   32.643  26.401 1.0703 27.739 0.5884 -1.337521      1.221390  
1 1 1 7  4  14 o 13.711 0.6907 209.300  16.491  151.872   29.618  235.105   19.854  12.150 1.2188 15.271 0.6500 -3.120593      1.381345  
1 1 1 7  4  15 o 5.3494 0.8831 34.295   7.8910  21.852    18.279  37.145    8.7482  4.6511 1.6113 6.0477 0.7233 -1.396531      1.766152  
1 1 1 7  4  16 o 14.430 0.7718 211.820  22.274  0.0000    0.0000  211.820   22.274  ?      ?      14.430 0.7718 ?              ?         
1 1 1 7  4  17 o 11.145 0.7560 134.156  15.655  114.996   26.505  144.421   19.400  10.417 1.2722 11.872 0.8170 -1.455068      1.511935  
1 1 1 7  4  18 o 5.2663 1.0637 32.324   11.396  25.330    21.327  35.119    13.483  4.8849 1.7367 5.6477 1.2286 -0.7627811     2.127301  
1 1 1 7  4  19 o 3.7201 1.0416 8.5700   10.307  18.844    20.339  5.0202    11.955  4.4014 1.6728 3.0388 1.2415 1.362592       2.083166  
1 1 1 7  4  20 o 8.1607 0.7772 69.715   12.537  79.172    19.645  63.217    16.284  8.5994 1.1422 7.7220 1.0544 0.8774190      1.554488  
1 1 1 7  4  21 o 4.2167 1.0822 17.788   11.562  23.239    18.577  14.342    14.772  4.5856 1.6218 3.8479 1.4335 0.7377536      2.164499  
1 1 1 7  4  22 f 6.1629 1.0314 45.098   13.232  26.998    19.986  59.224    17.656  4.9013 1.6856 7.4244 1.1891 -2.523081      2.062790  
1 1 1 7  4  23 o 14.652 0.6552 225.030  19.147  232.214   28.300  218.966   26.002  14.847 0.9530 14.458 0.8993 0.3894663      1.310318  
1 1 1 7  4  24 o 7.6394 1.0126 64.280   15.139  113.179   23.092  27.419    20.049  10.326 1.1182 4.9532 1.6886 5.372300       2.025248  
1 1 1 7  4  25 o 5.1850 1.1941 30.458   14.390  39.381    21.229  22.873    19.573  5.7502 1.7157 4.6199 1.6614 1.130254       2.388294  
1 1 1 7  4  26 o 7.6924 1.0960 68.068   16.256  73.228    23.834  63.580    22.228  7.9701 1.5510 7.4147 1.5489 0.5554385      2.191958  
1 1 1 7  4  27 o 8.9722 1.0599 96.865   17.686  65.522    25.736  124.914   24.346  7.2266 1.7899 10.718 1.1358 -3.491218      2.119868  
1 1 1 7  4  28 o 7.9880 1.0192 74.427   15.440  67.371    19.847  85.241    24.571  7.5786 1.3594 8.3975 1.5189 -0.8188572     2.038393  
1 1 1 7  4  29 o 3.8783 1.0432 16.691   10.875  20.670    17.939  14.379    13.675  4.1324 1.5709 3.6242 1.3730 0.5081441      2.086357  
1 1 1 7  4  30 o 2.1674 0.7547 -22.0118 10.439  -17.5761  17.925  -24.2881  12.841  2.4725 1.1948 1.8623 0.9223 0.6101824      1.509388  
1 1 1 7  4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  5  0  o 53.204 0.9005 2856.19  95.688  2889.11   135.868 2823.78   134.785 53.510 1.2712 52.898 1.2757 -0.000000      0.000000  
1 1 1 7  5  1  o 20.377 0.4821 416.990  19.643  405.828   27.703  428.274   27.856  20.102 0.6891 20.652 0.6744 -0.5502892     0.9641882 
1 1 1 7  5  2  o 27.790 0.5017 775.777  27.882  774.049   39.430  777.506   39.432  27.759 0.7102 27.821 0.7087 -0.6218719E-01 1.003316  
1 1 1 7  5  3  o 14.069 0.4870 198.902  13.684  212.008   19.379  185.869   19.324  14.534 0.6667 13.605 0.7102 0.9287624      0.9740834 
1 1 1 7  5  4  o 20.945 0.4833 440.144  20.238  427.940   28.609  452.368   28.633  20.654 0.6926 21.237 0.6741 -0.5830784     0.9665046 
1 1 1 7  5  5  o 23.132 0.4890 536.803  22.622  542.625   32.047  531.021   31.939  23.257 0.6890 23.006 0.6941 0.2505913      0.9780092 
1 1 1 7  5  6  o 17.074 0.4810 292.488  16.425  296.796   23.228  288.180   23.230  17.200 0.6752 16.948 0.6853 0.2522945      0.9620726 
1 1 1 7  5  7  o 11.813 0.5028 140.002  11.878  138.168   16.862  141.808   16.734  11.736 0.7184 11.890 0.7037 -0.1543312     1.005602  
1 1 1 7  5  8  o 17.355 0.4844 302.068  16.809  292.782   23.729  311.422   23.816  17.086 0.6944 17.623 0.6757 -0.5368710     0.9688795 
1 1 1 7  5  9  o 20.149 0.4886 407.324  19.690  404.179   27.894  410.448   27.798  20.071 0.6949 20.227 0.6872 -0.1557827     0.9772778 
1 1 1 7  5  10 o 12.040 0.5135 145.556  12.329  160.979   17.688  130.983   17.194  12.662 0.6985 11.418 0.7529 1.244202       1.027017  
1 1 1 7  5  11 o 11.295 0.5266 129.074  11.818  114.570   16.968  142.736   16.469  10.671 0.7951 11.919 0.6908 -1.248635      1.053281  
1 1 1 7  5  12 o 22.267 0.5933 500.205  25.403  501.874   31.854  497.289   42.105  22.341 0.7129 22.193 0.9486 0.1488667      1.186642  
1 1 1 7  5  13 o 8.8546 0.5762 80.030   10.104  72.057    14.865  86.877    13.776  8.4324 0.8814 9.2768 0.7425 -0.8444071     1.152458  
1 1 1 7  5  14 o 14.741 0.5123 220.457  15.052  205.753   21.674  234.155   20.920  14.256 0.7602 15.225 0.6870 -0.9692154     1.024614  
1 1 1 7  5  15 o 19.905 0.6506 423.658  23.738  363.177   41.301  453.492   29.008  18.679 1.1055 21.130 0.6864 -2.450172      1.301283  
1 1 1 7  5  16 o 9.8473 0.7118 101.879  11.189  98.162    24.634  102.846   12.560  9.6244 1.2798 10.070 0.6236 -0.4457130     1.423628  
1 1 1 7  5  17 o 6.3073 1.0107 47.530   12.064  33.523    21.612  53.870    14.540  5.4293 1.7500 7.1853 1.0118 -1.755963      2.021457  
1 1 1 7  5  18 o 6.2899 1.0405 40.762   12.141  58.477    22.112  33.116    14.526  7.1410 1.5892 5.4388 1.3433 1.702109       2.080904  
1 1 1 7  5  19 o 7.8318 0.8065 65.682   12.461  66.036    19.237  65.426    16.357  7.8062 1.2322 7.8574 1.0409 -0.5119896E-01 1.612964  
1 1 1 7  5  20 o 3.8033 0.8031 11.177   9.6510  -24.7695  15.977  31.831    12.110  2.2685 1.1037 5.3380 1.1669 -3.069488      1.606153  
1 1 1 7  5  21 o 7.1710 0.9840 61.401   13.213  45.269    21.145  71.736    16.925  6.1249 1.6770 8.2171 1.0299 -2.092200      1.967972  
1 1 1 7  5  22 o 5.2903 1.1431 32.474   13.056  33.293    20.604  31.924    16.878  5.3287 1.7078 5.2518 1.5199 0.7690430E-01  2.286203  
1 1 1 7  5  23 o 13.086 0.6946 182.043  17.984  169.036   26.801  192.696   24.256  12.598 1.0637 13.573 0.8935 -0.9754677     1.389180  
1 1 1 7  5  24 o 14.692 0.6842 226.820  20.024  220.770   29.406  232.050   27.342  14.474 1.0158 14.910 0.9169 -0.4358711     1.368460  
1 1 1 7  5  25 o 4.3832 1.1851 18.513   14.313  20.245    22.322  17.305    18.652  4.5377 1.7458 4.2287 1.6032 0.3090568      2.370212  
1 1 1 7  5  26 o 3.7977 1.1311 7.5890   14.561  8.5390    21.922  6.8390    19.479  3.9108 1.6463 3.6846 1.5515 0.2261908      2.262182  
1 1 1 7  5  27 o 9.4427 0.9570 101.158  17.864  94.227    26.619  106.837   24.095  9.0499 1.4707 9.8355 1.2249 -0.7856226     1.913962  
1 1 1 7  5  28 o 8.2698 1.1341 84.860   18.061  89.815    26.318  80.448    24.832  8.4997 1.6070 8.0400 1.6006 0.4596891      2.268126  
1 1 1 7  5  29 o 3.3231 1.0762 -4.1793  16.246  9.9308    24.249  -15.6722  21.884  3.7746 1.6602 2.8716 1.3698 0.9029200      2.152347  
1 1 1 7  5  30 o 3.8487 1.0559 19.454   11.755  13.434    20.214  22.531    14.450  3.6107 1.5524 4.0868 1.4317 -0.4761033     2.111768  
1 1 1 7  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  6  0  o 17.785 0.6936 320.120  24.494  329.577   34.933  310.974   34.354  18.047 0.9743 17.523 0.9875 -0.000000      0.000000  
1 1 1 7  6  1  o 15.442 0.4870 239.226  15.040  238.998   21.257  239.454   21.283  15.435 0.6886 15.450 0.6888 -0.1470852E-01 0.9739388 
1 1 1 7  6  2  o 27.024 0.4987 732.659  26.950  724.296   38.052  741.075   38.175  26.869 0.7081 27.179 0.7023 -0.3101654     0.9973049 
1 1 1 7  6  3  o 9.2492 0.5387 85.874   9.9651  86.291    14.176  85.468    14.011  9.2713 0.7645 9.2272 0.7592 0.4405022E-01  1.077454  
1 1 1 7  6  4  o 24.214 0.4897 588.324  23.712  582.452   33.491  594.227   33.577  24.092 0.6950 24.335 0.6899 -0.2429237     0.9793010 
1 1 1 7  6  5  o 16.369 0.4831 268.798  15.810  260.637   22.290  277.061   22.429  16.119 0.6915 16.620 0.6748 -0.5013466     0.9661320 
1 1 1 7  6  6  o 22.958 0.4891 528.537  22.455  531.841   31.840  525.269   31.673  23.029 0.6913 22.886 0.6920 0.1427898      0.9781129 
1 1 1 7  6  7  o 19.503 0.4863 381.438  18.970  375.761   26.746  387.183   26.909  19.357 0.6909 19.650 0.6847 -0.2924938     0.9726998 
1 1 1 7  6  8  o 14.236 0.4944 203.359  14.074  204.730   19.817  201.964   19.993  14.285 0.6936 14.187 0.7046 0.9757519E-01  0.9887233 
1 1 1 7  6  9  o 14.210 0.4994 202.716  14.189  208.793   20.165  196.756   19.970  14.422 0.6991 13.999 0.7133 0.4229956      0.9987650 
1 1 1 7  6  10 o 5.6080 0.7861 31.605   8.6060  22.805    11.366  43.431    13.175  4.6572 1.2095 6.5589 1.0044 -1.901652      1.572121  
1 1 1 7  6  11 o 31.791 0.5246 1016.22  33.350  1035.07   47.455  997.824   46.877  32.083 0.7396 31.499 0.7441 0.5836277      1.049119  
1 1 1 7  6  12 o 10.633 0.5329 113.749  11.308  124.970   16.363  103.492   15.645  11.136 0.7347 10.130 0.7722 1.006079       1.065874  
1 1 1 7  6  13 o 20.601 0.5030 428.411  20.718  443.583   29.580  413.803   29.026  20.960 0.7056 20.242 0.7170 0.7189713      1.005973  
1 1 1 7  6  14 o 16.337 0.5143 271.156  16.795  266.540   23.996  275.588   23.514  16.196 0.7408 16.478 0.7135 -0.2820587     1.028513  
1 1 1 7  6  15 o 6.0065 0.6609 37.009   7.8881  36.780    11.821  37.192    10.591  5.9811 0.9882 6.0319 0.8779 -0.5087042E-01 1.321848  
1 1 1 7  6  16 o 16.226 0.5164 268.809  16.735  261.087   24.090  276.011   23.265  15.990 0.7533 16.461 0.7067 -0.4710960     1.032860  
1 1 1 7  6  17 o 4.1061 1.0170 12.171   7.1630  27.893    21.536  10.215    7.5955  5.0457 1.7489 3.1664 1.0386 1.879282       2.034055  
1 1 1 7  6  18 o 12.621 0.7300 180.144  14.254  146.580   31.010  189.135   16.050  11.605 1.3361 13.636 0.5885 -2.031046      1.459935  
1 1 1 7  6  19 o 4.7442 0.9942 26.543   11.199  8.8497    18.386  36.978    14.120  3.7425 1.5355 5.7458 1.2632 -2.003305      1.988317  
1 1 1 7  6  20 o 9.8406 0.7502 100.232  14.462  133.691   22.503  76.689    18.876  11.232 1.0017 8.4492 1.1170 2.782798       1.500432  
1 1 1 7  6  21 o 10.497 0.7600 117.267  15.678  115.620   24.382  118.428   20.471  10.373 1.1752 10.620 0.9638 -0.2464104     1.519912  
1 1 1 7  6  22 o 5.9590 1.0628 43.614   13.871  21.288    22.112  58.099    17.811  4.5881 1.7441 7.3299 1.2150 -2.741760      2.125538  
1 1 1 7  6  23 f 3.4510 1.0409 3.1977   12.859  -7.1545   21.088  9.3260    16.225  3.2689 1.4841 3.6330 1.4600 -0.3641675     2.081888  
1 1 1 7  6  24 o 10.863 0.8006 124.982  17.185  131.264   26.656  120.513   22.481  11.049 1.2063 10.676 1.0529 0.3727760      1.601123  
1 1 1 7  6  25 o 10.153 0.9043 116.029  17.557  94.004    27.205  131.749   22.984  9.1514 1.4864 11.155 1.0302 -2.003372      1.808516  
1 1 1 7  6  26 o 10.414 0.9037 121.030  18.564  106.923   27.293  133.174   25.323  9.7434 1.4006 11.084 1.1423 -1.340491      1.807380  
1 1 1 7  6  27 o 6.2917 1.1104 50.480   16.586  15.224    25.084  77.868    22.109  4.2777 1.7779 8.3058 1.3309 -4.028116      2.220891  
1 1 1 7  6  28 o 4.7936 1.2951 30.950   17.248  32.365    25.550  29.765    23.380  4.8594 1.8681 4.7279 1.7943 0.1314859      2.590262  
1 1 1 7  6  29 o 8.1131 1.1847 90.280   18.861  78.771    27.413  100.627   25.991  7.3039 1.8689 8.9223 1.4565 -1.618396      2.369417  
1 1 1 7  6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  6  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  7  0  o 30.995 0.7281 967.569  45.022  962.989   63.961  972.067   63.384  30.921 1.0369 31.070 1.0225 -0.000000      0.000000  
1 1 1 7  7  1  o 19.490 0.4817 381.120  18.777  384.265   26.624  378.007   26.486  19.570 0.6802 19.410 0.6823 0.1602097      0.9634193 
1 1 1 7  7  2  o 24.528 0.4903 603.653  24.048  592.246   33.909  615.195   34.109  24.294 0.6979 24.762 0.6887 -0.4673328     0.9805123 
1 1 1 7  7  3  o 6.2046 0.6706 39.474   8.0673  44.694    11.369  34.181    11.449  6.6693 0.8523 5.7398 1.0354 0.9295115      1.341116  
1 1 1 7  7  4  o 47.477 0.5978 2264.02  56.763  2264.66   80.314  2263.39   80.236  47.484 0.8457 47.470 0.8451 0.1318741E-01  1.195591  
1 1 1 7  7  5  o 11.236 0.5151 126.675  11.555  117.285   16.217  136.359   16.470  10.812 0.7499 11.661 0.7062 -0.8482399     1.030105  
1 1 1 7  7  6  o 9.1925 0.5439 84.812   9.9994  84.540    14.051  85.091    14.233  9.1778 0.7655 9.2073 0.7729 -0.2952003E-01 1.087848  
1 1 1 7  7  7  o 35.408 0.5357 1258.72  37.935  1247.19   53.666  1270.24   53.630  35.246 0.7613 35.571 0.7538 -0.3256531     1.071386  
1 1 1 7  7  8  o 10.113 0.6426 105.555  12.485  113.996   15.998  92.402    19.970  10.653 0.7508 9.5717 1.0432 1.081599       1.285272  
1 1 1 7  7  9  o 11.597 0.5132 135.165  11.900  139.999   16.888  130.399   16.771  11.804 0.7154 11.391 0.7362 0.4135141      1.026492  
1 1 1 7  7  10 o 8.5807 0.5885 74.094   10.090  75.184    14.620  73.103    13.944  8.6399 0.8460 8.5215 0.8182 0.1184587      1.176961  
1 1 1 7  7  11 o 19.379 0.6479 388.933  23.054  404.873   27.919  354.770   40.872  20.061 0.6959 18.697 1.0930 1.364218       1.295723  
1 1 1 7  7  12 o 21.073 0.5022 447.982  21.140  479.658   30.293  417.912   29.515  21.803 0.6947 20.343 0.7254 1.459877       1.004433  
1 1 1 7  7  13 f 17.655 0.5067 315.600  17.885  307.342   25.382  323.746   25.207  17.422 0.7284 17.888 0.7046 -0.4660568     1.013420  
1 1 1 7  7  14 o 18.813 0.5117 360.213  19.245  349.663   27.337  370.579   27.098  18.533 0.7375 19.092 0.7097 -0.5587578     1.023481  
1 1 1 7  7  15 o 13.367 0.5337 183.622  14.165  163.283   20.410  202.521   19.675  12.628 0.8081 14.106 0.6974 -1.477846      1.067459  
1 1 1 7  7  16 o 7.4333 0.6442 57.306   9.5232  55.419    14.086  58.894    12.924  7.3056 0.9641 7.5611 0.8547 -0.2554903     1.288371  
1 1 1 7  7  17 o 5.4308 0.8306 32.101   8.4862  30.895    14.656  32.709    10.409  5.2475 1.3786 5.6142 0.9270 -0.3666830     1.661267  
1 1 1 7  7  18 o 11.083 0.5784 128.278  12.710  113.207   18.357  142.156   17.616  10.422 0.8807 11.745 0.7500 -1.322326      1.156740  
1 1 1 7  7  19 o 5.0294 1.2140 29.682   15.522  38.648    19.255  13.040    26.232  5.7099 1.6142 4.3490 1.8137 1.360929       2.428055  
1 1 1 7  7  20 f 3.3809 0.9859 0.6694   11.089  18.371    18.279  -9.6384   13.948  4.2583 1.5929 2.5035 1.1621 1.754784       1.971774  
1 1 1 7  7  21 o 17.169 0.6202 305.233  21.191  321.417   31.897  292.445   28.353  17.550 0.9087 16.789 0.8444 0.7617950      1.240494  
1 1 1 7  7  22 o 10.388 0.7895 114.922  16.290  123.476   24.827  108.455   21.587  10.697 1.1605 10.080 1.0708 0.6165543      1.579050  
1 1 1 7  7  23 o 6.6806 1.1243 49.419   14.646  66.522    23.606  38.717    18.674  7.5836 1.6064 5.7776 1.5735 1.806030       2.248633  
1 1 1 7  7  24 o 7.3204 1.1084 64.010   15.908  46.939    24.329  76.760    21.025  6.2160 1.8324 8.4248 1.2478 -2.208770      2.216871  
1 1 1 7  7  25 o 16.819 0.6760 297.164  22.557  288.506   33.786  304.126   30.299  16.544 1.0211 17.094 0.8862 -0.5505886     1.352084  
1 1 1 7  7  26 o 11.401 0.8762 145.192  19.595  127.509   29.313  159.479   26.347  10.640 1.3775 12.162 1.0832 -1.522584      1.752362  
1 1 1 7  7  27 o 10.013 0.9832 119.580  18.264  93.884    27.672  139.414   24.312  8.7263 1.6459 11.299 1.0758 -2.572816      1.966356  
1 1 1 7  7  28 o 4.6167 1.2145 26.882   17.368  -0.3109   26.893  46.339    22.748  3.5640 1.6398 5.6694 1.7921 -2.105435      2.429085  
1 1 1 7  7  29 o 5.5884 1.2503 44.819   18.106  78.252    26.621  16.044    24.697  7.2572 1.8335 3.9196 1.7005 3.337631       2.500666  
1 1 1 7  7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  8  0  o 32.766 0.7424 1080.64  48.519  1046.50   68.499  1115.02   68.733  32.242 1.0649 33.290 1.0346 -0.000000      0.000000  
1 1 1 7  8  1  o 9.0145 0.5650 81.788   10.158  86.133    14.119  77.127    14.625  9.2648 0.7619 8.7641 0.8344 0.5007257      1.129915  
1 1 1 7  8  2  o 19.201 0.4859 369.708  18.658  371.781   26.309  367.610   26.465  19.256 0.6832 19.147 0.6911 0.1089382      0.9717702 
1 1 1 7  8  3  o 21.422 0.4886 460.488  20.911  484.548   29.571  436.421   29.575  21.984 0.6726 20.861 0.7089 1.123299       0.9771622 
1 1 1 7  8  4  o 31.552 0.5167 998.809  32.599  1022.67   46.192  975.127   46.013  31.928 0.7234 31.175 0.7380 0.7530937      1.033375  
1 1 1 7  8  5  f 20.059 0.4873 403.642  19.550  408.122   27.664  399.172   27.633  20.170 0.6857 19.947 0.6927 0.2230320      0.9746928 
1 1 1 7  8  6  o 6.3279 0.7941 42.951   9.3499  48.474    11.979  34.343    14.956  6.9440 0.8626 5.7119 1.3335 1.232111       1.588131  
1 1 1 7  8  7  o 12.795 0.5055 164.589  12.919  173.154   18.195  155.880   18.346  13.133 0.6927 12.458 0.7363 0.6754360      1.010968  
1 1 1 7  8  8  o 13.582 0.5056 185.357  13.735  186.459   19.477  184.266   19.374  13.622 0.7149 13.542 0.7153 0.8039665E-01  1.011295  
1 1 1 7  8  9  f 40.212 0.5632 1626.90  45.285  1680.34   64.517  1575.00   63.577  40.865 0.7894 39.559 0.8036 1.306133       1.126450  
1 1 1 7  8  10 o 5.9741 0.7194 36.728   8.3279  36.305    12.581  37.058    11.110  5.8904 1.1086 6.0578 0.9170 -0.1673851     1.438747  
1 1 1 7  8  11 o 9.6983 0.5848 95.186   11.300  106.546   16.219  84.471    15.752  10.266 0.7900 9.1309 0.8625 1.134697       1.169634  
1 1 1 7  8  12 o 17.392 0.5115 306.087  17.752  330.325   25.154  282.037   25.057  18.086 0.6954 16.698 0.7503 1.387518       1.023010  
1 1 1 7  8  13 o 2.6329 0.7706 1.8405   6.7671  -1.9727   9.6939  5.4650    9.4510  2.3904 1.0506 2.8754 1.1276 -0.4849620     1.541177  
1 1 1 7  8  14 o 14.954 0.5249 227.309  15.697  225.675   22.262  228.924   22.136  14.899 0.7471 15.009 0.7374 -0.1100245     1.049710  
1 1 1 7  8  15 o 4.2246 0.7989 19.740   7.1209  12.823    10.680  25.276    9.5546  3.5969 1.2324 4.8524 1.0171 -1.255505      1.597895  
1 1 1 7  8  16 o 17.403 0.5219 310.293  18.151  296.465   25.704  324.049   25.635  17.006 0.7557 17.800 0.7201 -0.7936192     1.043878  
1 1 1 7  8  17 o 9.9476 0.6002 102.794  11.894  97.720    17.326  107.316   16.356  9.6963 0.8934 10.199 0.8019 -0.5025949     1.200490  
1 1 1 7  8  18 o 5.0433 0.8011 27.763   7.8074  30.773    12.089  25.609    10.226  5.2629 1.1779 4.8237 1.0861 0.4391985      1.602231  
1 1 1 7  8  19 o 4.6810 1.0129 28.570   11.045  35.096    12.027  -6.5686   27.906  5.6377 1.1061 3.7242 1.6972 1.913486       2.025836  
1 1 1 7  8  20 o 3.6549 0.9257 14.324   8.2917  18.379    8.8004  -17.7429  24.746  4.0845 1.0660 3.2254 1.5137 0.8590739      1.851351  
1 1 1 7  8  21 o 8.1648 1.2548 75.032   19.003  64.166    23.102  97.762    33.414  7.4056 1.6060 8.9240 1.9284 -1.518336      2.509622  
1 1 1 7  8  22 o 3.3568 1.0455 -1.6269  13.227  5.7108    21.672  -5.9826   16.697  3.7900 1.6178 2.9236 1.3247 0.8664718      2.090964  
1 1 1 7  8  23 o 8.3466 1.0417 81.118   16.277  65.951    25.431  91.643    21.184  7.4324 1.7413 9.2608 1.1437 -1.828423      2.083345  
1 1 1 7  8  24 o 9.7336 0.8984 102.843  17.341  105.769   26.404  100.623   22.995  9.8062 1.3463 9.6611 1.1901 0.1450806      1.796896  
1 1 1 7  8  25 o 19.609 0.6698 407.354  26.038  379.520   38.550  430.705   35.309  18.912 1.0192 20.307 0.8694 -1.394911      1.339626  
1 1 1 7  8  26 o 9.3263 0.9919 98.327   18.389  103.095   27.781  94.609    24.533  9.4751 1.4660 9.1774 1.3366 0.2977791      1.983820  
1 1 1 7  8  27 o 9.2552 1.1117 106.896  19.157  89.368    29.961  119.017   24.915  8.2223 1.8648 10.288 1.2109 -2.065756      2.223479  
1 1 1 7  8  28 o 8.6141 1.1620 99.340   18.862  84.363    29.745  109.413   24.393  7.5900 1.9493 9.6381 1.2655 -2.048148      2.324026  
1 1 1 7  8  29 o 6.1165 1.3367 64.026   19.097  48.775    29.913  74.520    24.812  5.1629 2.0112 7.0701 1.7613 -1.907232      2.673370  
1 1 1 7  8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  9  0  o 3.5217 1.1022 16.368   9.9603  3.2099    14.252  28.931    13.926  2.3554 1.4728 4.6881 1.6403 -0.000000      0.000000  
1 1 1 7  9  1  o 24.650 0.4933 609.550  24.316  618.244   34.387  600.855   34.388  24.826 0.6926 24.473 0.7026 0.3527241      0.9865302 
1 1 1 7  9  2  o 24.921 0.4975 623.072  24.793  631.224   35.108  614.963   35.017  25.084 0.6998 24.758 0.7072 0.3260517      0.9949279 
1 1 1 7  9  3  o 8.1759 0.5995 67.407   9.7601  60.461    13.862  74.235    13.744  7.7546 0.8938 8.5973 0.7993 -0.8426557     1.199097  
1 1 1 7  9  4  o 19.830 0.5905 392.718  22.294  387.235   27.501  403.229   38.077  19.644 0.7000 20.016 0.9511 -0.3722649     1.180944  
1 1 1 7  9  5  o 22.300 0.4936 499.183  22.010  493.063   31.176  505.265   31.079  22.163 0.7033 22.436 0.6926 -0.2738400     0.9871104 
1 1 1 7  9  6  o 30.053 0.5152 907.360  30.967  904.743   43.884  909.956   43.703  30.009 0.7312 30.096 0.7261 -0.8731651E-01 1.030433  
1 1 1 7  9  7  o 13.898 0.5170 194.110  14.369  197.940   20.515  190.422   20.131  14.033 0.7310 13.764 0.7313 0.2690983      1.033971  
1 1 1 7  9  8  o 13.331 0.5257 178.723  13.991  192.659   19.956  165.251   19.621  13.844 0.7208 12.817 0.7654 1.026762       1.051353  
1 1 1 7  9  9  o 18.549 0.5034 346.040  18.671  357.380   26.619  335.058   26.196  18.849 0.7061 18.249 0.7177 0.5999203      1.006859  
1 1 1 7  9  10 o 10.111 0.5806 103.426  11.741  101.824   16.551  105.048   16.659  10.032 0.8249 10.190 0.8174 -0.1586618     1.161282  
1 1 1 7  9  11 o 8.5872 0.6314 74.956   10.825  80.543    15.389  69.485    15.229  8.9084 0.8637 8.2660 0.9212 0.6424141      1.262780  
1 1 1 7  9  12 o 7.5557 0.6634 58.661   10.020  60.268    14.094  57.019    14.249  7.6643 0.9194 7.4471 0.9567 0.2172318      1.326886  
1 1 1 7  9  13 o 6.9648 0.7104 51.155   9.4881  60.394    13.272  41.497    13.569  7.6886 0.8631 6.2411 1.1287 1.447528       1.420841  
1 1 1 7  9  14 o 4.4348 0.8485 20.950   8.1099  30.758    11.737  11.988    11.219  5.3229 1.1370 3.5467 1.2597 1.776149       1.696968  
1 1 1 7  9  15 o 4.3600 0.8589 20.901   8.3674  10.185    12.239  30.304    11.465  3.4490 1.3008 5.2710 1.1220 -1.821990      1.717850  
1 1 1 7  9  16 o 4.2283 0.8623 19.689   7.9141  13.844    11.623  24.742    10.806  3.7105 1.2849 4.7461 1.1504 -1.035605      1.724633  
1 1 1 7  9  17 f 8.5014 0.6460 76.768   10.787  64.003    15.770  87.992    14.788  7.7839 1.0130 9.2190 0.8020 -1.435126      1.292078  
1 1 1 7  9  18 f 18.526 0.5393 354.658  19.957  376.613   28.363  333.130   28.086  19.110 0.7421 17.942 0.7827 1.167574       1.078588  
1 1 1 7  9  19 o 13.190 0.8022 195.397  17.238  202.846   19.699  171.047   35.615  14.040 0.7015 12.341 1.4430 1.698622       1.604459  
1 1 1 7  9  20 o 7.7307 1.0963 67.760   12.965  67.506    14.333  68.904    30.410  8.0501 0.8903 7.4113 2.0036 0.6388707      2.192510  
1 1 1 7  9  21 o 4.6830 1.1511 10.016   10.720  2.3129    11.614  54.337    27.858  2.8239 1.1940 6.5421 1.9685 -3.718239      2.302284  
1 1 1 7  9  22 o 9.0067 1.2133 117.622  16.217  131.914   18.050  57.803    36.928  11.309 0.7980 6.7040 2.2917 4.605498       2.426628  
1 1 1 7  9  23 o 18.236 0.8700 366.057  29.341  381.515   35.919  335.056   50.866  19.102 0.9402 17.370 1.4642 1.731880       1.740020  
1 1 1 7  9  24 o 2.6921 0.9176 -24.2454 14.048  -28.6253  23.540  -21.8227  17.507  2.8788 1.3857 2.5054 1.2031 0.3734021      1.835116  
1 1 1 7  9  25 o 7.6183 1.1974 70.494   17.534  71.071    27.521  70.100    22.748  7.5171 1.8444 7.7195 1.5275 -0.2023506     2.394783  
1 1 1 7  9  26 o 11.387 0.9330 150.961  20.194  120.837   31.362  172.295   26.394  10.142 1.5461 12.632 1.0447 -2.489761      1.866011  
1 1 1 7  9  27 o 6.7976 1.2851 63.328   17.615  70.059    27.413  58.595    22.989  7.0079 1.9056 6.5872 1.7247 0.4206729      2.570195  
1 1 1 7  9  28 o 5.0497 1.2653 29.991   17.701  68.434    28.309  5.3146    22.681  6.5925 1.9845 3.5069 1.5702 3.085586       2.530555  
1 1 1 7  9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  9  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  10 0  o 3.8988 1.2956 22.515   11.380  23.566    15.495  21.286    16.768  4.0167 1.8046 3.7810 1.8594 -0.000000      0.000000  
1 1 1 7  10 1  o 32.559 0.5238 1064.50  34.108  1068.35   48.223  1060.65   48.250  32.619 0.7392 32.500 0.7423 0.1184158      1.047581  
1 1 1 7  10 2  o 13.580 0.6214 186.120  15.869  187.304   19.422  183.744   27.525  13.659 0.7109 13.501 1.0194 0.1583948      1.242818  
1 1 1 7  10 3  o 30.243 0.5144 918.594  31.115  905.966   43.836  931.416   44.172  30.033 0.7298 30.453 0.7253 -0.4197350     1.028895  
1 1 1 7  10 4  o 14.389 0.5097 207.916  14.663  215.986   20.959  200.180   20.520  14.663 0.7147 14.115 0.7269 0.5478344      1.019367  
1 1 1 7  10 5  o 16.575 0.5013 276.062  16.616  275.523   23.730  276.580   23.272  16.558 0.7166 16.592 0.7013 -0.3341675E-01 1.002663  
1 1 1 7  10 6  o 12.285 0.5433 151.886  13.281  172.324   19.053  132.567   18.524  13.093 0.7276 11.477 0.8070 1.616150       1.086589  
1 1 1 7  10 7  f 12.537 0.5461 158.578  13.578  185.197   19.444  133.244   18.969  13.572 0.7163 11.502 0.8246 2.070027       1.092236  
1 1 1 7  10 8  o 11.162 0.5607 125.747  12.505  121.878   17.877  129.454   17.499  10.992 0.8132 11.333 0.7720 -0.3413305     1.121305  
1 1 1 7  10 9  o 7.3409 0.6894 54.726   10.113  57.817    14.609  51.881    14.015  7.5404 0.9687 7.1413 0.9812 0.3990717      1.378845  
1 1 1 7  10 10 o 4.2253 1.1167 14.322   11.049  13.904    12.485  15.830    23.726  3.8356 1.3315 4.6151 1.7930 -0.7794855     2.233325  
1 1 1 7  10 11 o 16.153 0.5271 265.164  17.013  281.157   24.289  249.761   23.836  16.636 0.7300 15.669 0.7606 0.9668207      1.054263  
1 1 1 7  10 12 o 7.6352 0.6758 59.901   10.313  62.513    14.641  57.330    14.529  7.8041 0.9380 7.4663 0.9730 0.3378339      1.351503  
1 1 1 7  10 13 o 16.832 0.5288 289.499  17.793  293.795   24.963  285.062   25.369  16.964 0.7357 16.699 0.7596 0.2652664      1.057505  
1 1 1 7  10 14 o 12.166 0.5823 152.437  14.098  134.614   19.837  170.626   20.039  11.427 0.8679 12.904 0.7765 -1.476665      1.164580  
1 1 1 7  10 15 o 9.1273 0.6528 86.381   11.887  78.631    16.610  94.517    17.018  8.6963 0.9550 9.5584 0.8902 -0.8620501     1.305589  
1 1 1 7  10 16 o 4.3606 0.8741 21.352   8.0504  17.637    12.045  24.351    10.823  4.0365 1.3070 4.6847 1.1610 -0.6481681     1.748213  
1 1 1 7  10 17 o 11.987 0.5838 148.894  13.995  149.653   19.749  148.129   19.834  12.020 0.8215 11.954 0.8296 0.6545544E-01  1.167507  
1 1 1 7  10 18 o 5.0826 0.8650 29.330   8.8091  36.152    12.385  22.345    12.532  5.7206 1.1226 4.4446 1.3164 1.276058       1.730082  
1 1 1 7  10 19 o 13.314 0.8164 192.607  17.742  194.752   20.125  185.126   37.582  13.754 0.7316 12.873 1.4598 0.8817549      1.632847  
1 1 1 7  10 20 o 3.3488 1.0322 3.7860   10.689  6.4406    11.634  -10.5848  27.069  3.1042 1.2403 3.5933 1.6503 -0.4890816     2.064366  
1 1 1 7  10 21 o 17.087 0.7511 302.599  21.583  295.784   24.541  325.870   45.350  16.948 0.7240 17.226 1.3163 -0.2774200     1.502280  
1 1 1 7  10 22 f 3.8819 1.1363 8.7104   10.608  7.6855    11.415  15.201    28.726  3.1809 1.2415 4.5828 1.9035 -1.401891      2.272610  
1 1 1 7  10 23 o 7.5300 1.2420 68.473   14.958  69.345    16.422  64.226    36.240  8.1052 1.0131 6.9548 2.2681 1.150397       2.484055  
1 1 1 7  10 24 o 7.3381 1.2207 42.021   13.975  29.894    15.115  113.486   36.692  5.1031 1.4258 9.5731 1.9817 -4.469961      2.441326  
1 1 1 7  10 25 o 9.3986 1.1002 111.398  18.536  69.593    28.652  141.490   24.309  7.3308 1.9283 11.466 1.0600 -4.135608      2.200470  
1 1 1 7  10 26 o 7.6502 1.1457 79.815   17.989  37.025    27.528  111.707   23.765  5.2929 1.9598 10.007 1.1874 -4.714475      2.291401  
1 1 1 7  10 27 o 6.0179 1.3271 53.889   17.737  50.800    28.170  55.918    22.831  5.7033 1.9989 6.3324 1.7462 -0.6291127     2.654227  
1 1 1 7  10 28 o 7.0730 1.3466 78.807   19.601  72.303    30.940  83.167    25.333  6.4498 2.0953 7.6961 1.6919 -1.246310      2.693132  
1 1 1 7  10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  11 0  o 13.390 1.0466 183.467  27.634  0.0000    0.0000  183.467   27.634  13.390 1.0466 13.390 1.0466 -0.000000      0.000000  
1 1 1 7  11 1  o 19.325 0.4994 375.240  19.299  371.528   27.358  378.916   27.228  19.229 0.7114 19.420 0.7010 -0.1915970     0.9987478 
1 1 1 7  11 2  o 16.310 0.5111 267.268  16.667  259.542   23.357  275.284   23.789  16.069 0.7268 16.550 0.7187 -0.4810886     1.022105  
1 1 1 7  11 3  o 22.829 0.5009 523.714  22.868  525.137   32.455  522.311   32.226  22.859 0.7099 22.798 0.7068 0.6108856E-01  1.001734  
1 1 1 7  11 4  o 14.738 0.5187 217.971  15.275  230.848   22.139  206.271   21.104  15.153 0.7305 14.323 0.7367 0.8300047      1.037451  
1 1 1 7  11 5  o 23.248 0.5071 543.366  23.579  543.460   33.406  543.272   33.287  23.250 0.7184 23.247 0.7159 0.3591537E-02  1.014232  
1 1 1 7  11 6  o 3.3101 0.8927 7.2153   8.3787  11.808    11.972  2.8061    11.731  3.6550 1.3009 2.9652 1.2227 0.6897371      1.785342  
1 1 1 7  11 7  o 26.799 0.5166 724.434  27.681  706.363   39.239  742.336   39.055  26.463 0.7414 27.136 0.7196 -0.6721878     1.033207  
1 1 1 7  11 8  o 21.432 0.5130 463.959  21.985  472.847   31.110  455.092   31.072  21.639 0.7188 21.225 0.7320 0.4139519      1.025913  
1 1 1 7  11 9  o 12.902 0.5574 168.490  14.377  173.495   20.698  163.824   19.986  13.086 0.7908 12.717 0.7858 0.3689251      1.114856  
1 1 1 7  11 10 f 3.2051 0.8719 5.6361   8.1651  13.906    12.441  -0.6215   10.822  3.7974 1.3285 2.6128 1.1296 1.184623       1.743825  
1 1 1 7  11 11 o 4.7344 0.8752 22.533   9.3515  40.524    13.821  7.3419    12.700  6.1508 1.1662 3.3181 1.3052 2.832718       1.750341  
1 1 1 7  11 12 o 15.065 0.5413 231.978  16.306  230.418   23.199  233.501   22.923  15.012 0.7727 15.118 0.7581 -0.1062937     1.082523  
1 1 1 7  11 13 o 16.333 0.5352 272.680  17.481  277.655   24.809  267.773   24.636  16.483 0.7526 16.183 0.7612 0.2999611      1.070427  
1 1 1 7  11 14 o 7.1486 0.7439 53.734   10.583  48.043    15.015  59.351    14.918  6.7521 1.1119 7.5452 0.9886 -0.7931199     1.487829  
1 1 1 7  11 15 o 15.250 0.5550 240.335  16.874  255.972   23.551  223.842   24.187  15.783 0.7461 14.717 0.8217 1.065753       1.109905  
1 1 1 7  11 16 o 2.0670 0.6782 -9.4321  7.0176  -17.9743  10.333  -2.1189   9.5608  1.7978 0.8775 2.3362 1.0343 -0.5383558     1.356384  
1 1 1 7  11 17 o 6.0352 0.8317 40.589   9.7737  33.039    14.043  47.681    13.611  5.3732 1.3170 6.6972 1.0162 -1.323985      1.663461  
1 1 1 7  11 18 o 8.5106 0.6314 75.689   10.689  74.297    14.338  77.431    16.035  8.4409 0.8493 8.5802 0.9344 -0.1392555     1.262765  
1 1 1 7  11 19 o 7.0495 1.1184 63.190   12.953  67.423    14.414  45.424    29.530  8.0424 0.8961 6.0566 2.0494 1.985804       2.236749  
1 1 1 7  11 20 o 6.1648 1.1256 51.234   12.856  56.405    14.045  24.523    31.919  7.3154 0.9600 5.0141 2.0362 2.301376       2.251173  
1 1 1 7  11 21 o 12.495 0.7877 160.852  19.684  160.852   19.684  0.0000    0.0000  12.495 0.7877 ?      ?      ?              ?         
1 1 1 7  11 22 o 6.5975 1.2261 49.991   13.296  49.895    14.398  50.546    34.663  6.8721 1.0476 6.3229 2.2172 0.5492320      2.452245  
1 1 1 7  11 23 o 6.4738 1.0603 65.322   14.465  79.623    15.875  -4.5979   35.103  8.7273 0.9095 4.2203 1.9156 4.506992       2.120561  
1 1 1 7  11 24 o 6.7181 1.2360 63.104   14.933  67.901    16.081  33.075    40.234  7.9843 1.0071 5.4519 2.2577 2.532379       2.472074  
1 1 1 7  11 25 o 6.0454 1.3306 44.645   14.857  43.843    16.093  49.277    38.666  6.1429 1.3470 5.9479 2.2950 0.1949930      2.661101  
1 1 1 7  11 26 o 5.6685 1.2186 48.316   15.404  53.858    16.482  10.048    43.313  6.7942 1.2593 4.5428 2.0868 2.251408       2.437300  
1 1 1 7  11 27 o 8.4836 1.2016 96.102   19.317  103.168   30.744  91.493    24.831  8.5259 1.8557 8.4413 1.5270 0.8460045E-01  2.403168  
1 1 1 7  11 28 o 3.7063 1.1833 10.459   18.284  20.055    28.742  3.9368    23.697  4.0259 1.7873 3.3867 1.5512 0.6391466      2.366590  
1 1 1 7  11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  12 0  o 1.7921 0.8663 -10.8565 9.6575  -1.1061   14.492  -18.6458  12.953  2.1479 1.3979 1.4363 1.0235 -0.000000      0.000000  
1 1 1 7  12 1  o 13.216 0.5443 175.358  14.354  192.781   20.793  159.497   19.840  13.844 0.7510 12.589 0.7880 1.255409       1.088554  
1 1 1 7  12 2  o 15.204 0.5314 232.596  16.156  236.702   22.758  228.424   22.940  15.340 0.7418 15.067 0.7613 0.2729673      1.062892  
1 1 1 7  12 3  o 4.3314 0.9329 18.370   9.2257  10.142    12.796  27.277    13.313  3.5842 1.3344 5.0786 1.3040 -1.494420      1.865732  
1 1 1 7  12 4  o 17.407 0.6565 300.027  21.283  289.343   25.569  324.125   38.402  16.947 0.7544 17.868 1.0746 -0.9211597     1.313007  
1 1 1 7  12 5  o 26.937 0.5192 732.005  27.939  687.861   39.301  777.108   39.725  26.110 0.7526 27.764 0.7154 -1.654140      1.038377  
1 1 1 7  12 6  o 10.928 0.6032 121.009  13.182  119.728   18.490  122.333   18.798  10.869 0.8505 10.986 0.8555 -0.1167364     1.206384  
1 1 1 7  12 7  o 11.200 0.5882 127.460  13.142  135.835   18.400  118.738   18.776  11.584 0.7942 10.817 0.8679 0.7662621      1.176416  
1 1 1 7  12 8  o 12.941 0.5555 170.220  14.361  177.790   20.177  162.449   20.443  13.239 0.7620 12.644 0.8084 0.5953217      1.110973  
1 1 1 7  12 9  o 4.8159 0.9417 25.438   9.4754  29.619    13.129  20.891    13.690  5.2056 1.2718 4.4262 1.3890 0.7794209      1.883326  
1 1 1 7  12 10 o 9.3695 0.6356 89.794   11.882  98.253    17.048  81.801    16.571  9.8054 0.8693 8.9336 0.9274 0.8717470      1.271135  
1 1 1 7  12 11 o 10.253 0.6250 108.545  12.768  98.004    18.070  119.053   18.042  9.7395 0.9277 10.766 0.8379 -1.026937      1.250057  
1 1 1 7  12 12 o 3.4279 0.9281 9.2638   8.9471  6.8454    12.869  11.526    12.447  3.2738 1.3056 3.5820 1.3194 -0.3082385     1.856187  
1 1 1 7  12 13 o 8.8207 0.6584 80.501   11.597  85.706    16.975  75.946    15.880  9.0862 0.9341 8.5553 0.9281 0.5309448      1.316762  
1 1 1 7  12 14 o 12.100 0.5990 151.416  14.495  148.295   20.404  154.595   20.596  11.972 0.8522 12.229 0.8421 -0.2564363     1.198065  
1 1 1 7  12 15 o 4.2650 0.9403 19.326   9.5212  29.499    13.496  9.2455    13.434  5.0994 1.3148 3.4305 1.3446 1.668866       1.880654  
1 1 1 7  12 16 f 15.684 0.5587 254.430  17.509  239.573   24.240  270.637   25.318  15.201 0.7973 16.167 0.7830 -0.9656849     1.117496  
1 1 1 7  12 17 o 9.2963 0.6594 90.827   12.258  89.169    17.184  92.544    17.492  9.2098 0.9329 9.3829 0.9321 -0.1730862     1.318758  
1 1 1 7  12 18 o 8.1007 1.1537 86.037   13.922  91.837    15.359  59.332    32.958  9.4192 0.8153 6.7822 2.1585 2.637013       2.307337  
1 1 1 7  12 19 f 10.690 0.9142 120.859  15.639  118.188   17.480  131.569   35.004  10.675 0.8187 10.705 1.6349 -0.3031540E-01 1.828409  
1 1 1 7  12 20 o 7.1185 1.1936 51.629   13.486  46.546    14.799  76.519    32.749  6.4994 1.1820 7.7376 2.0740 -1.238210      2.387173  
1 1 1 7  12 21 o 8.3099 1.2163 82.273   15.529  83.208    17.167  78.060    36.437  8.9075 0.9636 7.7123 2.2336 1.195143       2.432626  
1 1 1 7  12 22 o 8.2862 1.2324 94.782   15.710  102.494   17.310  58.760    37.410  9.9193 0.8725 6.6530 2.3051 3.266297       2.464701  
1 1 1 7  12 23 f 8.1634 1.2664 80.051   15.867  80.394    17.394  78.352    38.730  8.7303 0.9962 7.5964 2.3286 1.133862       2.532702  
1 1 1 7  12 24 o 9.9302 1.2019 114.604  17.642  112.505   19.501  124.066   41.405  10.300 0.9467 9.5610 2.2096 0.7385025      2.403891  
1 1 1 7  12 25 o 9.0688 1.2546 84.704   17.174  74.284    18.705  140.667   43.348  8.1987 1.1407 9.9389 2.2350 -1.740130      2.509243  
1 1 1 7  12 26 o 8.2759 1.3670 80.997   17.591  70.801    19.158  135.762   44.401  7.7661 1.2335 8.7857 2.4399 -1.019617      2.733990  
1 1 1 7  12 27 o 5.2539 1.3045 43.043   15.985  43.950    17.212  37.359    43.101  5.7504 1.4859 4.7573 2.1444 0.9931083      2.608927  
1 1 1 7  12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  12 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  13 0  o 2.4817 1.1379 -0.4880  13.413  0.2729    19.047  -1.2364   18.891  2.5180 1.6251 2.4455 1.5931 -0.000000      0.000000  
1 1 1 7  13 1  o 12.077 0.5772 147.526  13.915  136.570   19.564  158.744   19.797  11.618 0.8419 12.535 0.7897 -0.9164982     1.154321  
1 1 1 7  13 2  o 4.6319 0.9538 22.489   9.6625  29.316    13.428  15.157    13.915  5.2385 1.2902 4.0252 1.4052 1.213394       1.907635  
1 1 1 7  13 3  o 11.146 0.5936 125.822  13.231  123.848   18.584  127.850   18.841  11.057 0.8404 11.235 0.8385 -0.1775599     1.187151  
1 1 1 7  13 4  o 18.332 0.5254 339.515  19.261  331.071   26.988  348.280   27.496  18.099 0.7456 18.564 0.7406 -0.4657307     1.050868  
1 1 1 7  13 5  o 6.6966 0.8170 47.249   10.551  55.868    14.834  38.425    15.010  7.4007 1.0022 5.9924 1.2906 1.408309       1.633993  
1 1 1 7  13 6  o 11.574 0.5897 136.175  13.648  132.873   19.181  139.561   19.423  11.431 0.8390 11.717 0.8288 -0.2864609     1.179341  
1 1 1 7  13 7  o 4.7351 0.9740 24.390   9.8566  27.728    13.600  20.696    14.305  5.0375 1.3302 4.4328 1.4232 0.6046596      1.948097  
1 1 1 7  13 8  o 17.319 0.5342 305.980  18.462  327.730   26.048  284.023   26.171  17.950 0.7256 16.687 0.7842 1.263361       1.068362  
1 1 1 7  13 9  o 3.9948 1.0166 14.628   11.347  23.198    13.059  -11.7917  22.929  4.6334 1.3358 3.3562 1.5329 1.277205       2.033283  
1 1 1 7  13 10 o 3.6877 0.9540 12.461   9.1430  12.513    13.703  12.420    12.275  3.7329 1.3826 3.6426 1.3150 0.9035468E-01  1.908060  
1 1 1 7  13 11 o 7.3463 0.7614 56.757   11.126  51.171    15.932  62.076    15.545  6.9710 1.1427 7.7216 1.0066 -0.7506213     1.522836  
1 1 1 7  13 12 o 13.450 0.5899 186.608  15.809  206.656   22.518  167.120   22.201  14.182 0.7939 12.718 0.8728 1.463983       1.179840  
1 1 1 7  13 13 o 11.652 0.6104 140.438  14.219  146.087   20.444  135.146   19.788  11.880 0.8605 11.424 0.8661 0.4560986      1.220877  
1 1 1 7  13 14 o 8.9392 0.6963 84.203   12.378  95.707    17.758  73.330    17.263  9.5583 0.9289 8.3200 1.0375 1.238269       1.392561  
1 1 1 7  13 15 o 9.3858 0.6846 92.599   12.804  82.571    17.830  103.277   18.399  8.8418 1.0083 9.9297 0.9265 -1.087866      1.369281  
1 1 1 7  13 16 o 11.446 0.6154 136.975  14.074  143.259   19.828  130.594   19.980  11.725 0.8455 11.168 0.8945 0.5571327      1.230888  
1 1 1 7  13 17 o 15.646 0.5737 253.010  17.928  236.812   24.778  270.809   25.973  15.115 0.8196 16.176 0.8029 -1.060136      1.147335  
1 1 1 7  13 18 o 12.071 0.8320 152.866  16.719  149.898   18.956  163.262   35.479  12.045 0.7869 12.098 1.4663 -0.5345821E-01 1.664097  
1 1 1 7  13 19 o 5.7767 1.2794 34.840   13.129  31.747    14.291  51.579    33.245  5.2651 1.3506 6.2882 2.1733 -1.023034      2.558775  
1 1 1 7  13 20 f 6.6161 1.1590 54.954   13.249  58.374    14.608  39.102    31.452  7.4647 0.9785 5.7674 2.1014 1.697250       2.318046  
1 1 1 7  13 21 o 3.6777 1.1432 5.2274   11.463  6.5192    12.148  -5.2591   34.613  3.1566 1.2652 4.1987 1.9044 -1.042072      2.286364  
1 1 1 7  13 22 o 7.6465 1.2232 74.500   14.945  78.010    16.458  58.002    35.680  8.6269 0.9539 6.6661 2.2527 1.960790       2.446377  
1 1 1 7  13 23 o 7.1810 1.3104 65.339   15.356  66.113    16.549  60.541    41.181  7.8530 1.0537 6.5091 2.3995 1.343885       2.620705  
1 1 1 7  13 24 o 8.6075 1.1912 75.275   16.063  65.982    17.674  119.384   38.505  7.7698 1.1374 9.4452 2.0933 -1.675443      2.382362  
1 1 1 7  13 25 o 6.1181 1.4029 49.219   16.032  47.641    17.117  60.499    45.767  6.2741 1.3997 5.9621 2.4317 0.3119779      2.805732  
1 1 1 7  13 26 o 3.5283 1.1979 -7.3457  13.898  -11.3357  14.712  25.748    42.370  2.4231 1.1464 4.6335 2.1037 -2.210407      2.395781  
1 1 1 7  13 27 o 4.9458 1.2782 40.625   16.089  42.295    17.096  27.687    47.581  5.5220 1.5063 4.3696 2.0655 1.152324       2.556398  
1 1 1 7  13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  14 0  o 4.6233 1.5303 32.466   15.836  30.597    21.970  34.489    22.848  4.4732 2.1386 4.7735 2.1893 -0.000000      0.000000  
1 1 1 7  14 1  o 2.6802 0.8259 -5.1168  9.0076  4.8871    12.035  -17.8605  13.583  3.1139 1.2553 2.2466 1.0737 0.8673570      1.651841  
1 1 1 7  14 2  o 7.8068 0.7399 62.849   11.415  73.784    16.152  51.938    16.134  8.5063 0.9494 7.1073 1.1350 1.398980       1.479724  
1 1 1 7  14 3  o 2.9655 0.8876 0.7576   9.2520  -4.3053   13.612  5.1049    12.614  2.7567 1.2266 3.1742 1.2832 -0.4174862     1.775157  
1 1 1 7  14 4  o 13.179 0.5775 176.980  15.201  177.282   20.981  176.647   22.055  13.197 0.7949 13.160 0.8379 0.3653431E-01  1.154983  
1 1 1 7  14 5  o 8.2535 0.7229 70.336   11.858  60.304    16.388  81.362    17.180  7.6223 1.0750 8.8847 0.9668 -1.262430      1.445790  
1 1 1 7  14 6  o 20.325 0.5291 420.519  21.507  428.147   30.719  413.185   30.120  20.505 0.7490 20.145 0.7476 0.3607960      1.058275  
1 1 1 7  14 7  o 12.131 0.7989 146.154  17.566  168.162   33.620  137.889   20.602  12.649 1.3289 11.612 0.8872 1.037950       1.597827  
1 1 1 7  14 8  o 14.622 0.5734 219.091  16.756  220.962   23.310  217.091   24.103  14.694 0.7932 14.550 0.8283 0.1443272      1.146825  
1 1 1 7  14 9  o 12.180 0.6082 154.066  14.615  178.850   20.404  127.951   20.945  13.229 0.7712 11.131 0.9408 2.097839       1.216489  
1 1 1 7  14 10 o 6.6042 0.8377 47.316   10.734  53.056    14.943  41.196    15.430  7.1135 1.0503 6.0949 1.3052 1.018592       1.675305  
1 1 1 7  14 11 o 5.5847 0.9521 34.636   10.517  39.311    15.427  30.576    14.376  5.9427 1.3310 5.2266 1.3616 0.7160821      1.904127  
1 1 1 7  14 12 o 10.849 0.6409 122.545  13.886  127.018   19.392  117.837   19.894  11.066 0.8762 10.632 0.9356 0.4341850      1.281850  
1 1 1 7  14 13 o 13.161 0.5970 179.900  15.692  167.348   21.910  193.118   22.484  12.678 0.8641 13.644 0.8240 -0.9657354     1.194007  
1 1 1 7  14 14 o 7.0525 0.8350 54.164   11.529  55.093    16.108  53.188    16.509  7.1780 1.1220 6.9269 1.2370 0.2510924      1.670082  
1 1 1 7  14 15 f 11.674 0.6436 142.811  15.017  138.726   20.788  147.269   21.717  11.504 0.9035 11.845 0.9167 -0.3409100     1.287139  
1 1 1 7  14 16 o 6.5769 0.9095 48.936   11.614  36.226    16.662  60.946    16.196  5.5863 1.4710 7.5675 1.0701 -1.981202      1.819088  
1 1 1 7  14 17 o 3.6235 0.9564 10.625   9.8965  19.275    13.797  1.4588    14.204  4.2133 1.4007 3.0337 1.3027 1.179604       1.912845  
1 1 1 7  14 18 o 5.4295 1.1225 39.243   13.153  45.654    14.542  10.421    30.831  6.4216 1.1756 4.4373 1.9125 1.984288       2.244949  
1 1 1 7  14 19 o 6.0726 1.1138 50.597   13.656  58.761    15.032  12.011    32.679  7.4827 1.0044 4.6624 1.9883 2.820359       2.227609  
1 1 1 7  14 20 o 10.009 1.1020 120.010  16.371  124.763   18.382  101.781   35.996  10.973 0.8376 9.0450 2.0386 1.928164       2.203992  
1 1 1 7  14 21 o 3.3416 1.0702 -0.6333  12.276  2.2525    13.365  -16.2178  31.058  2.9922 1.2737 3.6911 1.7203 -0.6988826     2.140457  
1 1 1 7  14 22 o 9.8143 0.9631 101.691  18.905  101.691   18.905  0.0000    0.0000  9.8143 0.9631 ?      ?      ?              ?         
1 1 1 7  14 23 o 3.1790 1.0839 -7.6559  11.658  -6.3328   12.221  -21.0417  38.871  2.4288 1.1130 3.9292 1.8602 -1.500435      2.167749  
1 1 1 7  14 24 o 5.0300 1.3633 17.953   14.830  9.1102    16.114  66.901    37.912  3.5008 1.4371 6.5591 2.3172 -3.058300      2.726629  
1 1 1 7  14 25 o 3.3759 1.0561 6.9360   11.991  12.262    12.463  -59.4008  43.985  3.4209 1.3072 3.3309 1.6591 0.8992314E-01  2.112243  
1 1 1 7  14 26 o 4.5061 1.2565 28.476   15.088  29.847    16.214  19.615    41.214  4.6873 1.5163 4.3249 2.0040 0.3623986      2.513022  
1 1 1 7  14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  14 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  15 0  o 10.392 1.0104 117.692  19.709  110.156   28.505  124.596   27.281  9.9973 1.5327 10.787 1.3170 -0.000000      0.000000  
1 1 1 7  15 1  o 3.4588 0.9680 6.3177   10.216  -0.4402   13.869  14.334    15.105  2.9533 1.2778 3.9643 1.4545 -1.011058      1.936044  
1 1 1 7  15 2  f 8.2130 0.7351 69.919   12.066  67.526    17.178  72.249    16.952  8.0673 1.0646 8.3587 1.0140 -0.2914124     1.470291  
1 1 1 7  15 3  o 9.0527 0.7262 85.011   12.966  68.238    18.078  102.778   18.606  8.1030 1.1155 10.002 0.9301 -1.899271      1.452385  
1 1 1 7  15 4  o 8.3823 0.7339 72.446   12.303  73.454    17.513  71.465    17.286  8.4399 1.0375 8.3247 1.0383 0.1152430      1.467814  
1 1 1 7  15 5  o 17.602 0.5443 315.405  19.156  311.987   26.714  319.022   27.483  17.506 0.7630 17.697 0.7765 -0.1906948     1.088608  
1 1 1 7  15 6  o 28.510 0.5417 831.092  30.873  795.014   43.435  867.932   43.892  27.874 0.7791 29.146 0.7529 -1.272112      1.083492  
1 1 1 7  15 7  o 4.6698 0.9950 22.881   10.608  12.600    14.716  34.000    15.304  3.8057 1.4282 5.5338 1.3858 -1.728088      1.990032  
1 1 1 7  15 8  o 5.5909 1.0142 35.060   11.464  40.540    16.378  29.797    16.052  6.0271 1.3875 5.1547 1.4795 0.8724141      2.028310  
1 1 1 7  15 9  o 4.2305 1.1274 17.211   12.419  1.2998    27.107  21.438    13.972  4.0275 1.7638 4.4334 1.4048 -0.4059472     2.254846  
1 1 1 7  15 10 o 5.1148 0.8293 25.515   10.530  55.961    15.320  -1.7470   14.497  7.3048 1.0486 2.9248 1.2851 4.380023       1.658665  
1 1 1 7  15 11 o 5.2537 1.1512 33.694   13.356  38.799    15.453  18.626    26.550  5.8612 1.3466 4.6462 1.8675 1.215044       2.302333  
1 1 1 7  15 12 o 6.3338 0.9492 45.421   11.658  50.107    16.569  40.826    16.407  6.6943 1.2843 5.9733 1.3981 0.7210202      1.898425  
1 1 1 7  15 13 o 13.989 0.6024 203.592  16.849  197.824   23.671  209.515   23.989  13.784 0.8587 14.194 0.8450 -0.4103098     1.204735  
1 1 1 7  15 14 o 3.0680 0.9163 2.5367   9.7002  7.4112    14.451  -1.4612   13.087  3.3727 1.3699 2.7634 1.2174 0.6093638      1.832698  
1 1 1 7  15 15 o 8.7866 0.7905 83.514   13.620  65.937    19.290  100.986   19.233  7.7885 1.2384 9.7847 0.9828 -1.996212      1.580993  
1 1 1 7  15 16 o 6.5018 0.9152 47.336   11.478  52.115    16.280  42.612    16.186  6.8675 1.2305 6.1361 1.3551 0.7313991      1.830379  
1 1 1 7  15 17 o 4.9189 1.2224 28.432   14.094  32.298    15.527  10.342    33.587  5.2797 1.4335 4.5582 1.9803 0.7214837      2.444700  
1 1 1 7  15 18 o 8.6274 1.1698 90.620   15.641  94.075    17.548  77.260    34.506  9.4937 0.9242 7.7610 2.1494 1.732752       2.339643  
1 1 1 7  15 19 o 6.7194 1.1842 61.518   14.440  67.910    15.852  30.352    35.002  8.0384 0.9860 5.4005 2.1533 2.637897       2.368348  
1 1 1 7  15 20 o 9.5452 1.0994 100.546  16.502  98.003    18.550  110.190   36.123  9.6587 0.9603 9.4317 1.9781 0.2270126      2.198892  
1 1 1 7  15 21 o 6.8092 1.2859 54.478   15.192  53.726    16.813  57.824    35.455  6.9623 1.2535 6.6562 2.2457 0.3061428      2.571827  
1 1 1 7  15 22 o 4.7684 1.1534 28.468   14.051  35.964    15.399  -8.8174   34.343  5.5506 1.3901 3.9862 1.8409 1.564434       2.306776  
1 1 1 7  15 23 o 5.0210 1.2678 32.327   15.922  37.519    17.518  7.6701    38.176  5.5491 1.5293 4.4929 2.0224 1.056237       2.535503  
1 1 1 7  15 24 o 3.7193 1.1970 3.8377   14.007  1.6382    15.113  17.240    37.305  2.9843 1.3117 4.4544 2.0027 -1.470156      2.393971  
1 1 1 7  15 25 o 3.2057 1.0456 0.5663   13.605  8.0049    14.264  -74.4736  45.303  3.2116 1.3383 3.1999 1.6070 0.1171970E-01  2.091232  
1 1 1 7  15 26 o 6.5915 1.4933 63.199   17.922  52.698    19.514  119.777   45.296  6.0860 1.5868 7.0970 2.5301 -1.010962      2.986526  
1 1 1 7  15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  16 0  o 3.9767 1.4984 24.024   16.772  32.859    23.777  15.275    23.661  4.5449 2.2178 3.4084 2.0156 -0.000000      0.000000  
1 1 1 7  16 1  o 8.0668 0.7910 67.669   12.728  63.504    17.249  72.647    18.858  7.7996 1.1057 8.3339 1.1314 -0.5343451     1.581983  
1 1 1 7  16 2  o 4.6007 1.0064 22.396   10.951  33.172    15.118  10.501    15.884  5.4633 1.3824 3.7382 1.4630 1.725132       2.012803  
1 1 1 7  16 3  o 10.039 0.6677 104.334  13.397  108.843   18.951  99.828    18.941  10.264 0.9232 9.8149 0.9649 0.4488068      1.335440  
1 1 1 7  16 4  o 3.0223 0.9314 -0.9905  10.537  -1.0416   14.275  -0.9292   15.619  2.9541 1.2872 3.0906 1.3465 -0.1365466     1.862776  
1 1 1 7  16 5  o 10.431 0.6716 112.652  13.984  105.934   19.895  119.213   19.661  10.110 0.9839 10.751 0.9144 -0.6406717     1.343180  
1 1 1 7  16 6  o 5.1920 0.9935 30.469   10.710  24.377    15.607  35.893    14.725  4.7039 1.4841 5.6801 1.3211 -0.9762425     1.986940  
1 1 1 7  16 7  o 7.9970 0.7851 67.550   12.471  58.300    17.457  77.192    17.823  7.4108 1.1778 8.5831 1.0383 -1.172258      1.570110  
1 1 1 7  16 8  o 9.8504 1.0686 121.194  16.858  137.892   19.973  79.823    31.438  11.556 0.8642 8.1452 1.9547 3.410502       2.137252  
1 1 1 7  16 9  o 11.144 0.6505 129.611  14.386  148.650   20.467  111.021   20.224  11.985 0.8538 10.302 0.9815 1.683084       1.300954  
1 1 1 7  16 10 o 9.5543 0.7266 96.511   13.719  116.061   19.843  78.606    18.989  10.523 0.9429 8.5859 1.1058 1.936636       1.453227  
1 1 1 7  16 11 o 3.3343 0.9682 5.9230   10.274  8.9455    15.685  3.6511    13.598  3.5703 1.4353 3.0983 1.3000 0.4720767      1.936483  
1 1 1 7  16 12 o 6.7991 0.9527 52.494   12.494  54.915    17.905  50.195    17.443  6.9632 1.3342 6.6351 1.3602 0.3281260      1.905329  
1 1 1 7  16 13 o 8.7096 0.7793 81.246   13.571  80.058    18.929  82.501    19.468  8.6482 1.0944 8.7710 1.1098 -0.1228189     1.558622  
1 1 1 7  16 14 o 3.6532 1.0088 10.875   10.722  8.0945    15.236  13.603    15.090  3.4816 1.4093 3.8248 1.4439 -0.3431540     2.017686  
1 1 1 7  16 15 o 4.9546 1.0343 28.055   11.225  34.971    15.638  20.704    16.123  5.5276 1.4100 4.3815 1.5135 1.146103       2.068573  
1 1 1 7  16 16 o 7.9772 0.8218 69.863   12.349  49.947    17.145  91.333    17.802  6.6406 1.3371 9.3137 0.9557 -2.673073      1.643549  
1 1 1 7  16 17 o 4.6800 1.3064 14.168   13.772  9.5019    14.975  39.769    35.074  3.5599 1.4119 5.8002 2.1985 -2.240349      2.612864  
1 1 1 7  16 18 o 12.214 0.9321 167.925  18.403  172.562   20.926  152.100   38.659  12.916 0.8101 11.512 1.6791 1.404257       1.864295  
1 1 1 7  16 19 o 10.811 1.2337 153.336  18.371  163.511   20.379  109.187   42.449  12.568 0.8107 9.0540 2.3304 3.514061       2.467443  
1 1 1 7  16 20 o 4.1534 1.1765 14.847   13.130  18.415    14.317  -4.0310   32.937  4.1620 1.4269 4.1448 1.8709 0.1719332E-01  2.352926  
1 1 1 7  16 21 o 7.1009 1.3389 55.256   15.833  49.567    17.415  82.386    38.026  6.5578 1.3719 7.6439 2.2998 -1.086105      2.677878  
1 1 1 7  16 22 o 4.3933 1.1840 21.086   14.922  28.726    16.527  -12.6013  34.704  4.9043 1.5241 3.8823 1.8124 1.022005       2.368053  
1 1 1 7  16 23 o 5.8386 1.4214 41.855   16.224  38.627    17.539  60.983    42.697  5.5662 1.5287 6.1110 2.3967 -0.5448165     2.842702  
1 1 1 7  16 24 o 6.1907 1.4409 36.613   16.786  21.325    18.310  117.149   42.024  4.1765 1.5872 8.2048 2.4053 -4.028311      2.881747  
1 1 1 7  16 25 o 3.4999 1.1671 3.5706   14.996  4.6845    15.810  -6.4156   47.338  3.0782 1.3475 3.9216 1.9060 -0.8434312     2.334263  
1 1 1 7  16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  16 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  17 0  o 10.205 1.1422 116.455  21.537  121.530   30.652  111.507   30.267  10.467 1.5679 9.9437 1.6613 -0.000000      0.000000  
1 1 1 7  17 1  o 4.1825 1.0520 16.036   11.671  6.0114    16.445  26.210    16.567  3.5007 1.4460 4.8644 1.5283 -1.363658      2.103933  
1 1 1 7  17 2  f 8.2222 0.7989 72.132   12.963  80.974    17.822  62.199    18.890  8.8060 1.0119 7.6385 1.2365 1.167470       1.597776  
1 1 1 7  17 3  o 8.4134 0.7999 75.375   13.325  80.338    18.058  69.444    19.743  8.7581 1.0309 8.0686 1.2234 0.6895428      1.599874  
1 1 1 7  17 4  o 3.9390 1.0509 13.926   11.339  16.270    15.119  10.912    17.144  4.0600 1.4602 3.8181 1.5119 0.2418544      2.101877  
1 1 1 7  17 5  o 4.3970 1.0658 20.181   11.447  24.596    15.963  15.507    16.424  4.7231 1.5021 4.0710 1.5125 0.6521230      2.131628  
1 1 1 7  17 6  f 10.029 0.7029 105.285  14.049  96.486    20.020  113.822   19.720  9.5934 1.0434 10.464 0.9422 -0.8708887     1.405892  
1 1 1 7  17 7  o 6.8504 0.9421 52.517   12.540  40.686    17.975  63.735    17.503  5.9517 1.5082 7.7492 1.1293 -1.797461      1.884184  
1 1 1 7  17 8  o 5.6687 1.0105 37.171   11.631  28.791    16.641  45.175    16.262  5.0038 1.5249 6.3337 1.3263 -1.329872      2.021032  
1 1 1 7  17 9  o 6.4860 0.9435 47.496   12.028  36.518    17.123  58.188    16.898  5.6049 1.4986 7.3671 1.1468 -1.762200      1.887062  
1 1 1 7  17 10 o 4.2149 1.0298 17.903   10.903  26.677    15.946  10.199    14.942  4.8336 1.4962 3.5961 1.4154 1.237591       2.059635  
1 1 1 7  17 11 o 6.5113 0.9503 48.727   12.237  66.850    17.419  31.067    17.195  7.8872 1.1042 5.1354 1.5468 2.751789       1.900527  
1 1 1 7  17 12 o 10.538 0.7007 117.755  14.730  123.875   20.530  111.262   21.146  10.846 0.9464 10.229 1.0336 0.6165266      1.401437  
1 1 1 7  17 13 o 11.370 0.6839 136.308  15.475  149.061   21.679  123.058   22.097  11.947 0.9073 10.793 1.0237 1.154293       1.367888  
1 1 1 7  17 14 o 15.080 0.8184 237.189  22.530  259.956   41.983  227.980   26.700  15.378 1.3650 14.781 0.9032 0.5969200      1.636750  
1 1 1 7  17 15 o 8.7511 0.8175 82.586   14.302  80.435    20.304  84.705    20.148  8.6265 1.1769 8.8757 1.1350 -0.2492628     1.635013  
1 1 1 7  17 16 o 7.5312 0.8747 62.364   12.665  64.765    16.800  59.204    19.277  7.8134 1.0751 7.2491 1.3800 0.5642190      1.749336  
1 1 1 7  17 17 o 4.1951 1.2308 12.970   14.078  15.132    15.311  1.1398    35.814  3.9547 1.4621 4.4355 1.9804 -0.4808383     2.461678  
1 1 1 7  17 18 o 8.5416 1.2397 112.590  17.305  128.770   19.188  42.113    40.049  11.131 0.8620 5.9524 2.3248 5.178378       2.479444  
1 1 1 7  17 19 o 7.0008 1.2730 66.208   16.542  72.253    18.203  37.532    39.643  8.2369 1.1050 5.7647 2.2938 2.472191       2.546100  
1 1 1 7  17 20 o 4.4579 1.3177 15.711   16.958  15.925    18.984  14.863    37.730  4.1147 1.6024 4.8012 2.0923 -0.6865182     2.635383  
1 1 1 7  17 21 o 5.0059 1.3401 14.030   14.307  5.0518    15.511  65.236    37.044  3.2844 1.3838 6.7275 2.2953 -3.443139      2.680162  
1 1 1 7  17 22 o 5.3756 1.3408 35.861   15.608  34.696    17.234  41.176    36.801  5.2913 1.5372 5.4598 2.1972 -0.1685166     2.681539  
1 1 1 7  17 23 o 8.0916 1.4044 93.611   18.677  90.923    20.407  107.483   46.358  8.8931 1.1473 7.2900 2.5637 1.603035       2.808732  
1 1 1 7  17 24 o 5.2349 1.4367 24.243   16.112  11.831    17.379  100.171   42.983  3.5366 1.4757 6.9331 2.4654 -3.396488      2.873308  
1 1 1 7  17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  18 0  o 11.999 0.9688 154.953  22.305  136.987   30.975  174.304   32.146  11.204 1.4491 12.794 1.2861 -0.000000      0.000000  
1 1 1 7  18 1  o 5.8167 1.0943 38.723   12.950  39.505    18.561  37.982    18.076  5.8706 1.5558 5.7628 1.5393 0.1078801      2.188568  
1 1 1 7  18 2  o 16.909 0.5912 294.812  19.983  292.141   27.760  297.686   28.789  16.837 0.8244 16.982 0.8477 -0.1446342     1.182426  
1 1 1 7  18 3  o 6.8985 0.9866 52.854   13.115  46.570    17.726  60.455    19.496  6.4277 1.4170 7.3694 1.3733 -0.9416513     1.973288  
1 1 1 7  18 4  o 11.390 0.6567 135.364  14.937  143.182   21.061  127.452   21.187  11.737 0.8972 11.043 0.9593 0.6934052      1.313483  
1 1 1 7  18 5  o 4.0320 1.0554 15.804   11.306  14.291    16.097  17.277    15.885  3.9347 1.4899 4.1292 1.4951 -0.1945193     2.110708  
1 1 1 7  18 6  o 3.6177 1.0280 9.1240   11.461  12.623    16.099  5.5280    16.321  3.8167 1.4786 3.4187 1.4286 0.3979955      2.056020  
1 1 1 7  18 7  o 8.1671 0.8258 71.516   13.462  77.940    19.460  65.620    18.643  8.5313 1.1405 7.8030 1.1946 0.7283220      1.651615  
1 1 1 7  18 8  o 4.5164 1.0956 21.868   12.082  28.031    17.577  16.346    16.636  4.9437 1.5766 4.0891 1.5216 0.8546162      2.191105  
1 1 1 7  18 9  o 10.009 0.7500 107.706  14.839  125.263   20.967  90.090    21.003  10.888 0.9629 9.1299 1.1502 1.758173       1.500035  
1 1 1 7  18 10 o 6.5793 0.9943 49.425   12.981  61.183    18.473  37.954    18.246  7.4943 1.2325 5.6643 1.5607 1.830041       1.988658  
1 1 1 7  18 11 o 3.3595 0.9959 4.6808   11.395  0.1411    16.154  9.1759    16.075  3.1273 1.3658 3.5916 1.4497 -0.4643440     1.991752  
1 1 1 7  18 12 o 7.2135 0.9559 59.464   13.226  85.909    18.930  34.245    18.486  9.0109 1.0504 5.4160 1.5974 3.594863       1.911848  
1 1 1 7  18 13 o 12.543 0.6714 166.246  16.669  189.212   23.312  142.218   23.845  13.487 0.8643 11.600 1.0278 1.886757       1.342883  
1 1 1 7  18 14 o 14.971 0.6235 234.188  18.645  230.098   25.651  238.769   27.149  14.846 0.8639 15.097 0.8992 -0.2506580     1.246922  
1 1 1 7  18 15 o 6.0853 1.0541 42.978   12.818  36.084    18.504  49.338    17.773  5.5646 1.5857 6.6059 1.3893 -1.041284      2.108222  
1 1 1 7  18 16 f 7.1302 1.4597 59.511   21.764  42.620    27.201  89.565    36.283  5.9114 1.9668 8.3490 2.1574 -2.437570      2.919364  
1 1 1 7  18 17 o 3.5868 1.1380 0.1829   13.940  2.0215    15.448  -7.8793   32.348  3.1738 1.3606 3.9997 1.8245 -0.8259337     2.275968  
1 1 1 7  18 18 o 7.7229 1.3163 80.382   18.113  86.937    20.226  53.833    40.706  9.0233 1.1208 6.4224 2.3821 2.600873       2.632584  
1 1 1 7  18 19 o 5.9614 1.3551 43.300   16.351  42.863    18.269  45.061    36.655  6.0189 1.5179 5.9040 2.2452 0.1148963      2.710173  
1 1 1 7  18 20 o 6.2351 1.4070 45.074   16.323  41.412    17.882  63.372    39.969  5.8835 1.5116 6.5868 2.3736 -0.7033362     2.814076  
1 1 1 7  18 21 f 6.2900 1.2461 56.109   16.428  61.721    18.228  31.823    37.918  7.4188 1.2285 5.1612 2.1685 2.257633       2.492298  
1 1 1 7  18 22 o 3.5143 1.1283 4.1940   15.261  9.0702    16.701  -20.4877  37.574  3.4271 1.4395 3.6016 1.7379 -0.1745076     2.256626  
1 1 1 7  18 23 o 8.7392 1.3242 88.603   18.372  74.707    20.223  154.238   43.952  7.8925 1.2811 9.5859 2.3180 -1.693381      2.648465  
1 1 1 7  18 24 o 4.4285 1.3669 13.681   15.862  3.0807    17.036  82.694    43.469  3.0443 1.3621 5.8127 2.3702 -2.768403      2.733700  
1 1 1 7  18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  18 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  19 0  o 8.3251 1.3770 85.677   19.862  95.399    27.881  75.659    28.303  9.0378 1.7247 7.6124 2.1470 -0.000000      0.000000  
1 1 1 7  19 1  o 10.683 0.7457 121.376  15.889  128.962   22.234  113.460   22.714  11.053 1.0058 10.313 1.1012 0.7394428      1.491392  
1 1 1 7  19 2  o 9.0960 0.8108 88.915   14.700  96.354    20.727  81.386    20.851  9.5093 1.0898 8.6827 1.2007 0.8266306      1.621563  
1 1 1 7  19 3  o 6.4329 1.0745 48.153   13.739  58.894    19.716  38.015    19.155  7.1923 1.4210 5.6735 1.6122 1.518806       2.149064  
1 1 1 7  19 4  o 14.323 0.6431 214.274  18.423  214.062   26.129  214.484   25.979  14.314 0.9127 14.333 0.9063 -0.1840210E-01 1.286247  
1 1 1 7  19 5  o 6.2772 1.0107 45.101   12.390  45.372    17.025  44.795    18.065  6.3196 1.3852 6.2347 1.4722 0.8489513E-01  2.021484  
1 1 1 7  19 6  o 12.317 0.6648 160.433  16.237  180.509   22.729  139.510   23.204  13.156 0.8638 11.479 1.0107 1.677001       1.329579  
1 1 1 7  19 7  o 5.2096 1.3149 31.748   16.113  32.903    18.428  28.002    33.202  5.2598 1.6051 5.1594 2.0832 0.1003757      2.629870  
1 1 1 7  19 8  o 4.5084 1.0449 19.084   12.460  39.294    18.104  0.8958    17.175  5.7720 1.5398 3.2449 1.4129 2.527144       2.089840  
1 1 1 7  19 9  o 14.428 0.6344 219.243  18.156  248.616   25.568  189.367   25.786  15.458 0.8270 13.399 0.9622 2.058927       1.268786  
1 1 1 7  19 10 o 7.9630 0.9164 69.785   14.231  63.065    19.895  76.824    20.364  7.4827 1.3802 8.4432 1.2060 -0.9604249     1.832866  
1 1 1 7  19 11 o 5.1141 1.0297 27.426   12.961  51.461    18.551  4.5064    18.116  6.7211 1.4243 3.5071 1.4875 3.214006       2.059458  
1 1 1 7  19 12 o 4.2598 1.0641 16.813   12.255  3.6436    17.068  30.826    17.606  3.3760 1.4383 5.1437 1.5688 -1.767670      2.128286  
1 1 1 7  19 13 o 13.581 0.6597 193.813  17.895  195.391   24.773  192.091   25.878  13.657 0.9070 13.505 0.9581 0.1513042      1.319302  
1 1 1 7  19 14 o 4.4936 1.0989 20.000   13.058  33.019    18.023  5.6178    18.944  5.3503 1.5771 3.6369 1.5307 1.713418       2.197763  
1 1 1 7  19 15 o 3.7079 1.0512 8.9524   12.181  16.162    17.147  1.6072    17.307  4.1057 1.5415 3.3101 1.4298 0.7956035      2.102465  
1 1 1 7  19 16 o 3.8460 1.1980 -4.8231  14.643  -11.8708  16.424  22.491    32.334  2.6923 1.2535 4.9996 2.0420 -2.307285      2.396082  
1 1 1 7  19 17 o 10.820 1.1700 138.084  19.038  140.652   21.372  128.217   41.893  11.599 0.9213 10.041 2.1510 1.558232       2.339957  
1 1 1 7  19 18 o 7.6403 1.3124 80.303   18.034  86.540    20.129  54.939    40.590  8.9572 1.1236 6.3234 2.3721 2.633753       2.624770  
1 1 1 7  19 19 o 6.4379 1.2833 58.702   17.591  65.705    19.305  24.425    42.710  7.7039 1.2529 5.1720 2.2400 2.531878       2.566623  
1 1 1 7  19 20 o 3.8847 1.2431 1.3863   15.465  -1.5659   16.903  16.555    38.315  3.0555 1.3627 4.7139 2.0796 -1.658356      2.486257  
1 1 1 7  19 21 o 3.2881 1.0647 -0.8991  14.775  8.2819    15.879  -60.0933  40.321  3.3654 1.4080 3.2109 1.5976 0.1544681      2.129483  
1 1 1 7  19 22 o 6.6191 1.2362 74.822   18.118  82.779    19.706  31.326    46.074  8.4543 1.1654 4.7840 2.1804 3.670286       2.472308  
1 1 1 7  19 23 o 4.3228 1.2123 28.226   16.682  34.815    18.136  -7.9841   42.519  4.8996 1.6048 3.7461 1.8174 1.153496       2.424559  
1 1 1 7  19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  20 0  o 4.4480 1.6413 33.333   19.042  40.457    28.849  27.833    25.348  4.8358 2.4281 4.0602 2.2090 -0.000000      0.000000  
1 1 1 7  20 1  o 10.488 0.7717 117.576  16.130  131.055   23.269  105.106   22.380  11.092 1.0489 9.8838 1.1322 1.208482       1.543352  
1 1 1 7  20 2  o 3.6243 1.0305 7.2458   12.041  -3.3457   16.777  18.499    17.293  3.0235 1.3523 4.2251 1.5553 -1.201625      2.061032  
1 1 1 7  20 3  o 5.4269 1.1589 34.930   13.583  31.311    18.174  39.508    20.442  5.1436 1.5982 5.7102 1.6786 -0.5666513     2.317732  
1 1 1 7  20 4  o 3.6471 1.0704 6.9371   13.049  0.3692    18.319  13.703    18.593  3.3074 1.4491 3.9869 1.5758 -0.6794839     2.140833  
1 1 1 7  20 5  o 5.6382 1.1129 37.839   13.166  31.738    18.985  43.491    18.274  5.1851 1.6370 6.0912 1.5080 -0.9060488     2.225713  
1 1 1 7  20 6  o 5.4964 1.0870 35.088   13.431  17.833    18.907  52.668    19.084  4.2478 1.6132 6.7449 1.4573 -2.497063      2.173954  
1 1 1 7  20 7  o 8.6913 0.8855 82.574   15.302  92.043    21.648  73.118    21.633  9.2354 1.1720 8.1473 1.3276 1.088166       1.770931  
1 1 1 7  20 8  o 6.3584 1.0493 47.261   14.092  25.404    20.241  67.820    19.631  4.7982 1.6933 7.9185 1.2395 -3.120306      2.098550  
1 1 1 7  20 9  o 9.5942 0.8213 99.236   15.630  109.821   21.733  87.898    22.494  10.177 1.0678 9.0113 1.2481 1.165707       1.642522  
1 1 1 7  20 10 o 2.3096 0.7938 -25.7572 11.665  -31.4419  16.995  -20.6943  16.039  2.2324 1.0970 2.3869 1.1476 -0.1544025     1.587574  
1 1 1 7  20 11 o 12.289 0.7056 160.175  17.266  177.274   24.491  143.280   24.345  12.979 0.9435 11.600 1.0494 1.378820       1.411190  
1 1 1 7  20 12 o 11.045 0.7462 129.137  16.450  118.530   22.888  140.473   23.660  10.559 1.0838 11.531 1.0259 -0.9715080     1.492340  
1 1 1 7  20 13 f 3.9989 1.1017 12.854   12.918  6.5292    18.158  19.336    18.383  3.6234 1.5099 4.3744 1.6046 -0.7509887     2.203306  
1 1 1 7  20 14 o 8.8694 0.8847 85.348   15.616  90.872    21.600  79.299    22.602  9.2117 1.1724 8.5271 1.3253 0.6846495      1.769459  
1 1 1 7  20 15 o 4.1340 1.1945 12.215   16.025  21.408    18.357  -17.2213  32.850  4.4833 1.6094 3.7847 1.7657 0.6985295      2.389074  
1 1 1 7  20 16 o 8.4031 1.3447 83.181   18.634  81.769    20.803  88.914    41.916  8.7247 1.1922 8.0815 2.4107 0.6432114      2.689404  
1 1 1 7  20 17 o 10.282 1.1117 107.766  19.965  93.674    22.699  155.925   41.961  9.2477 1.2273 11.316 1.8540 -2.068638      2.223432  
1 1 1 7  20 18 o 7.4872 1.3619 71.575   18.633  70.730    21.367  74.256    38.077  7.8115 1.4200 7.1629 2.3243 0.6486344      2.723732  
1 1 1 7  20 19 o 7.1736 1.4496 57.616   18.232  47.149    20.245  102.543   41.940  6.1491 1.6226 8.1981 2.4027 -2.048928      2.899290  
1 1 1 7  20 20 f 3.1728 1.0593 -9.0445  15.945  -1.4898   17.840  -39.0517  35.555  3.0659 1.3810 3.2797 1.6065 -0.2138104     2.118513  
1 1 1 7  20 21 o 4.6013 1.4726 6.1328   35.391  -107.2148 61.992  60.937    43.105  3.5306 1.7861 5.6721 2.3419 -2.141495      2.945259  
1 1 1 7  20 22 o 3.6308 1.1264 10.962   15.920  19.265    17.399  -31.7437  39.460  3.9061 1.5305 3.3554 1.6532 0.5507193      2.252890  
1 1 1 7  20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 0  o 8.2287 1.4789 86.176   21.057  94.218    30.139  78.505    29.433  8.7631 1.9704 7.6943 2.2061 -0.000000      0.000000  
1 1 1 7  21 1  o 14.152 0.6694 211.301  18.907  221.060   26.383  200.999   27.108  14.516 0.9087 13.787 0.9831 0.7291088      1.338755  
1 1 1 7  21 2  o 9.8029 0.8019 103.538  15.686  110.521   22.118  96.472    22.250  10.163 1.0881 9.4424 1.1782 0.7209902      1.603774  
1 1 1 7  21 3  o 5.7546 1.1638 39.599   14.069  39.989    19.543  39.180    20.270  5.7925 1.6223 5.7166 1.6689 0.7583141E-01  2.327510  
1 1 1 7  21 4  o 14.939 0.6503 233.527  19.427  235.207   27.650  231.889   27.300  14.990 0.9223 14.888 0.9169 0.1022015      1.300509  
1 1 1 7  21 5  o 3.6949 1.0475 8.0870   12.400  17.848    17.104  -2.7284   18.004  4.2122 1.5474 3.1775 1.4124 1.034625       2.095079  
1 1 1 7  21 6  o 2.8133 0.9068 -11.3889 11.660  -23.0440  15.970  1.9179    17.064  2.3224 1.1236 3.3041 1.4235 -0.9817061     1.813510  
1 1 1 7  21 7  o 2.8005 0.9250 -16.9004 13.202  -4.2613   18.513  -29.9778  18.831  3.1589 1.4162 2.4421 1.1904 0.7167847      1.850006  
1 1 1 7  21 8  o 2.8866 0.9355 -11.2128 12.544  -21.7708  17.606  -0.3288   17.876  2.5138 1.2070 3.2595 1.4298 -0.7457364     1.871094  
1 1 1 7  21 9  o 14.722 0.6696 228.115  19.713  232.362   28.124  224.014   27.639  14.857 0.9465 14.587 0.9474 0.2699919      1.339203  
1 1 1 7  21 10 o 3.9567 1.1130 12.424   13.183  15.680    19.443  9.6542    17.934  4.1653 1.6218 3.7481 1.5247 0.4172037      2.225940  
1 1 1 7  21 11 o 4.7533 1.1787 24.347   13.953  20.115    19.791  28.532    19.676  4.4799 1.6611 5.0267 1.6728 -0.5468917     2.357422  
1 1 1 7  21 12 o 5.8304 1.0966 38.557   14.374  62.564    20.746  16.394    19.934  7.4164 1.4506 4.2444 1.6450 3.172037       2.193270  
1 1 1 7  21 13 o 3.2337 1.0061 -4.6158  13.007  8.1215    19.174  -15.4758  17.704  3.7619 1.5582 2.7055 1.2731 1.056368       2.012165  
1 1 1 7  21 14 o 5.8702 1.1470 40.915   13.918  40.219    19.886  41.583    19.488  5.8145 1.6393 5.9259 1.6048 -0.1114063     2.294034  
1 1 1 7  21 15 o 3.2276 1.0924 -18.0404 16.334  -13.8481  18.283  -34.6163  36.355  2.8088 1.3127 3.6465 1.7465 -0.8376539     2.184793  
1 1 1 7  21 16 o 8.0291 1.3522 91.533   20.057  100.571   22.708  59.470    42.772  9.6047 1.1821 6.4535 2.4323 3.151153       2.704320  
1 1 1 7  21 17 o 6.4034 1.3608 37.356   18.549  15.745    21.485  100.633   36.763  4.1812 1.6802 8.6256 2.1411 -4.444327      2.721596  
1 1 1 7  21 18 o 5.0327 1.4394 22.491   18.357  14.702    20.422  55.266    41.891  4.0269 1.6310 6.0386 2.3721 -2.011680      2.878748  
1 1 1 7  21 19 o 4.8157 1.3631 29.866   18.375  29.815    20.912  30.037    38.486  4.7617 1.7168 4.8698 2.1177 -0.1080499     2.726202  
1 1 1 7  21 20 o 5.3694 1.3605 45.643   19.167  50.448    21.351  25.698    43.501  6.0559 1.6956 4.6829 2.1282 1.373046       2.721086  
1 1 1 7  21 21 o 6.0195 1.3086 63.579   18.768  69.261    21.107  42.119    41.018  7.2198 1.5103 4.8191 2.1375 2.400635       2.617259  
1 1 1 7  21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  21 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 0  o 3.1321 1.4099 7.3537   19.314  7.5197    29.000  7.2214    25.893  3.2005 2.0419 3.0638 1.9446 -0.000000      0.000000  
1 1 1 7  22 1  o 7.0579 1.0594 59.528   15.109  31.486    21.902  84.993    20.871  5.2149 1.7650 8.9008 1.1724 -3.685964      2.118893  
1 1 1 7  22 2  o 13.460 0.6786 192.376  17.972  224.444   25.012  158.148   25.840  14.702 0.8507 12.218 1.0575 2.483506       1.357147  
1 1 1 7  22 3  o 4.3337 1.1126 17.302   13.744  30.985    18.438  0.1929    20.617  5.1669 1.6104 3.5005 1.5354 1.666404       2.225115  
1 1 1 7  22 4  o 6.9953 1.0476 55.921   14.565  73.930    20.995  39.214    20.222  8.2438 1.2734 5.7468 1.6639 2.496982       2.095212  
1 1 1 7  22 5  o 3.6673 1.0801 7.2934   13.138  8.9302    18.794  5.7289    18.374  3.7611 1.5489 3.5735 1.5059 0.1876321      2.160271  
1 1 1 7  22 6  o 11.805 1.0429 160.219  21.631  165.114   25.598  147.994   40.451  12.471 1.0263 11.138 1.8158 1.332838       2.085779  
1 1 1 7  22 7  o 5.6684 1.1535 37.435   15.189  58.346    21.506  16.625    21.454  7.0466 1.5666 4.2901 1.6936 2.756542       2.307078  
1 1 1 7  22 8  o 4.5675 1.1652 22.026   13.912  14.946    20.780  27.778    18.729  4.1992 1.6639 4.9359 1.6315 -0.7366519     2.330360  
1 1 1 7  22 9  o 5.6245 1.1784 36.360   14.600  48.143    21.102  25.541    20.221  6.4136 1.6390 4.8354 1.6936 1.578224       2.356825  
1 1 1 7  22 10 o 12.802 0.7284 172.970  18.649  169.511   26.236  176.503   26.514  12.669 1.0354 12.935 1.0249 -0.2655773     1.456887  
1 1 1 7  22 11 o 7.3480 1.1169 62.609   15.927  60.251    22.427  65.008    22.621  7.1918 1.6004 7.5042 1.5582 -0.3123612     2.233707  
1 1 1 7  22 12 o 4.5525 1.1481 17.645   15.063  38.937    21.241  -3.8950   21.364  5.7084 1.7191 3.3967 1.5222 2.311680       2.296160  
1 1 1 7  22 13 f 3.9414 1.1472 10.046   14.591  12.447    20.861  7.7466    20.415  4.0695 1.6484 3.8133 1.5960 0.2561686      2.294456  
1 1 1 7  22 14 o 8.2559 1.3767 85.193   19.905  85.844    22.588  82.927    42.111  8.8573 1.2751 7.6544 2.4403 1.202900       2.753320  
1 1 1 7  22 15 o 5.4767 1.3997 36.720   18.591  36.890    21.744  36.256    35.844  5.4698 1.7545 5.4837 2.1814 -0.1383877E-01 2.799458  
1 1 1 7  22 16 o 4.6914 1.3308 23.012   18.982  29.698    22.036  3.7868    37.367  4.9721 1.7655 4.4107 1.9916 0.5614119      2.661540  
1 1 1 7  22 17 o 4.4752 1.3167 19.805   19.198  26.790    21.744  -4.8864   40.885  4.7128 1.7424 4.2377 1.9746 0.4750595      2.633443  
1 1 1 7  22 18 o 5.0321 1.4134 21.199   19.498  2.8550    22.448  77.564    39.348  3.4844 1.5610 6.5797 2.3568 -3.095255      2.826844  
1 1 1 7  22 19 o 3.9027 1.2173 10.578   19.112  21.605    21.255  -35.9891  43.678  4.2150 1.6788 3.5904 1.7631 0.6246126      2.434586  
1 1 1 7  22 20 o 4.6598 1.3142 34.852   19.486  41.391    22.031  11.354    41.764  5.2021 1.7701 4.1174 1.9429 1.084684       2.628320  
1 1 1 7  22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  22 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 0  o 4.9723 1.6089 38.680   20.398  62.419    28.981  15.377    28.714  6.4714 2.4076 3.4731 2.1348 -0.000000      0.000000  
1 1 1 7  23 1  o 9.8745 0.8380 105.461  16.541  102.393   22.951  108.777   23.860  9.7287 1.1795 10.020 1.1906 -0.2915678     1.675957  
1 1 1 7  23 2  o 9.0962 0.9342 93.718   15.966  117.178   22.331  69.184    22.836  10.483 1.0652 7.7099 1.5349 2.772690       1.868317  
1 1 1 7  23 3  o 11.541 0.7808 142.447  18.004  134.277   25.156  151.027   25.780  11.188 1.1242 11.894 1.0837 -0.7058229     1.561505  
1 1 1 7  23 4  o 9.8165 0.8640 104.386  16.947  108.990   23.912  99.740    24.021  10.054 1.1892 9.5791 1.2538 0.4748087      1.728089  
1 1 1 7  23 5  o 7.1176 1.1342 58.964   15.803  50.096    21.834  68.722    22.903  6.5031 1.6700 7.7321 1.5352 -1.228988      2.268447  
1 1 1 7  23 6  o 3.9319 1.1338 10.089   14.038  7.7018    19.072  12.911    20.738  3.7488 1.5536 4.1150 1.6517 -0.3661892     2.267510  
1 1 1 7  23 7  o 5.7018 1.1699 38.036   14.312  45.903    20.451  30.485    20.036  6.2538 1.6215 5.1499 1.6868 1.103892       2.339766  
1 1 1 7  23 8  o 5.6762 1.1760 37.133   14.911  52.959    21.584  22.685    20.623  6.7109 1.6254 4.6414 1.7000 2.069510       2.351972  
1 1 1 7  23 9  o 6.7100 1.1903 53.469   15.990  58.216    22.443  48.576    22.788  7.0500 1.6250 6.3701 1.7396 0.6799912      2.380536  
1 1 1 7  23 10 o 3.6250 1.1072 2.5027   14.734  -2.1044   20.349  7.5799    21.362  3.3870 1.5037 3.8630 1.6256 -0.4760685     2.214449  
1 1 1 7  23 11 o 4.8679 1.1213 17.764   16.035  -16.2157  22.465  53.055    22.895  3.0917 1.4482 6.6440 1.7122 -3.552239      2.242519  
1 1 1 7  23 12 o 6.3071 1.2486 48.146   16.669  37.926    23.772  58.032    23.380  5.6290 1.8370 6.9851 1.6916 -1.356108      2.497219  
1 1 1 7  23 13 o 4.9391 1.2620 28.282   16.033  30.600    22.308  25.804    23.058  5.0756 1.7788 4.8026 1.7906 0.2730403      2.523924  
1 1 1 7  23 14 o 6.9860 1.4221 52.481   19.824  33.423    23.183  104.333   38.240  5.2233 1.8143 8.7487 2.1904 -3.525349      2.844228  
1 1 1 7  23 15 f 4.8689 1.4348 18.988   20.060  11.270    22.925  44.212    41.445  4.0097 1.6855 5.7282 2.3223 -1.718550      2.869522  
1 1 1 7  23 16 o 4.9086 1.4338 27.644   21.053  28.282    24.030  25.534    43.667  4.8014 1.8198 5.0158 2.2160 -0.2144394     2.867504  
1 1 1 7  23 17 o 7.8139 1.3263 104.322  22.003  119.861   25.433  58.090    43.871  10.074 1.2623 5.5536 2.3329 4.520625       2.652515  
1 1 1 7  23 18 o 4.1931 1.3362 14.371   19.771  11.583    22.023  25.948    44.881  3.7453 1.6153 4.6409 2.1290 -0.8956563     2.672438  
1 1 1 7  23 19 o 11.082 1.3299 171.028  23.354  163.949   26.568  195.090   48.985  11.806 1.1252 10.357 2.4101 1.449118       2.659770  
1 1 1 7  23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  23 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 0  o 3.1784 1.4180 5.3894   19.743  19.684    28.435  -7.9143   27.432  3.7013 2.1999 2.6554 1.7898 -0.000000      0.000000  
1 1 1 7  24 1  f 5.2738 1.2414 31.128   15.657  41.847    22.848  21.638    21.499  5.9242 1.7827 4.6233 1.7279 1.300881       2.482718  
1 1 1 7  24 2  o 6.8273 1.1990 55.525   16.358  60.993    22.540  49.441    23.777  7.2437 1.5986 6.4110 1.7873 0.8327136      2.397944  
1 1 1 7  24 3  o 8.9291 1.0179 89.050   17.569  73.949    24.328  105.510   25.399  8.0018 1.5763 9.8565 1.2884 -1.854644      2.035835  
1 1 1 7  24 4  o 6.6583 1.1485 51.979   15.261  42.968    21.132  61.801    22.062  6.0114 1.6882 7.3051 1.5576 -1.293609      2.296995  
1 1 1 7  24 5  o 5.8452 1.2102 40.873   15.570  51.571    21.379  28.791    22.720  6.6252 1.6256 5.0652 1.7933 1.560034       2.420484  
1 1 1 7  24 6  o 5.6705 1.2213 36.242   15.760  54.302    23.577  21.655    21.189  6.7387 1.7380 4.6023 1.7163 2.136315       2.442664  
1 1 1 7  24 7  o 8.2720 1.0370 77.278   16.688  74.704    24.585  79.478    22.726  8.0235 1.5883 8.5204 1.3336 -0.4968615     2.073903  
1 1 1 7  24 8  o 5.1647 1.1948 29.422   15.850  8.6961    23.045  48.027    21.834  4.0036 1.6868 6.3259 1.6926 -2.322290      2.389555  
1 1 1 7  24 9  o 2.9881 0.9906 -16.7697 15.014  -10.6479  21.080  -23.0724  21.389  3.1477 1.4496 2.8284 1.3506 0.3193412      1.981222  
1 1 1 7  24 10 o 5.9216 1.2653 42.120   16.480  50.662    23.471  33.815    23.144  6.4768 1.7642 5.3665 1.8143 1.110301       2.530628  
1 1 1 7  24 11 o 7.8344 1.2181 74.831   18.580  80.103    26.165  69.470    26.388  8.1744 1.6572 7.4944 1.7859 0.6800203      2.436275  
1 1 1 7  24 12 o 5.9533 1.1168 38.463   17.125  81.317    24.727  -1.0345   23.739  8.2989 1.5467 3.6077 1.6115 4.691284       2.233628  
1 1 1 7  24 13 o 6.0251 1.4825 47.800   20.794  46.316    24.622  51.492    38.830  5.9934 1.8599 6.0568 2.3091 -0.6340885E-01 2.964942  
1 1 1 7  24 14 o 5.2256 1.4387 34.658   20.348  36.584    23.094  27.974    43.029  5.3217 1.8123 5.1295 2.2349 0.1921697      2.877360  
1 1 1 7  24 15 o 5.9420 1.4542 53.111   21.125  56.796    24.604  42.777    41.204  6.4733 1.8229 5.4107 2.2663 1.062587       2.908424  
1 1 1 7  24 16 o 5.0579 1.3692 39.615   20.535  46.898    22.954  10.422    45.955  5.7156 1.7994 4.4002 2.0643 1.315396       2.738449  
1 1 1 7  24 17 o 4.8577 1.3472 37.406   20.530  45.234    22.875  4.9828    46.553  5.5118 1.8022 4.2035 2.0031 1.308307       2.694481  
1 1 1 7  24 18 o 5.8495 1.3976 65.142   21.256  70.381    24.233  47.664    44.262  6.8732 1.7563 4.8259 2.1744 2.047225       2.795149  
1 1 1 7  24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 0  o 9.8350 1.5158 118.695  26.062  111.531   37.176  125.618   36.547  9.3926 2.2838 10.277 1.9936 -0.000000      0.000000  
1 1 1 7  25 1  o 8.4562 1.0612 81.118   17.312  100.149   24.971  63.508    24.021  9.5851 1.3026 7.3273 1.6756 2.257788       2.122356  
1 1 1 7  25 2  o 6.2490 1.1300 44.011   16.114  14.693    22.046  77.638    23.611  4.2458 1.7034 8.2522 1.4852 -4.006395      2.259958  
1 1 1 7  25 3  o 4.3600 1.1416 12.496   15.534  36.725    21.639  -13.2680  22.314  5.5530 1.7469 3.1671 1.4700 2.385943       2.283133  
1 1 1 7  25 4  o 11.025 0.8743 132.111  19.193  145.178   27.128  119.015   27.158  11.619 1.1674 10.431 1.3018 1.187538       1.748549  
1 1 1 7  25 5  o 8.0967 1.3323 82.375   20.621  87.192    25.020  72.172    36.413  8.8570 1.4124 7.3365 2.2594 1.520504       2.664511  
1 1 1 7  25 6  o 3.7733 1.1170 5.5237   14.852  -8.7062   22.770  16.060    19.593  3.3435 1.5273 4.2030 1.6304 -0.8595493     2.234005  
1 1 1 7  25 7  o 7.3207 1.2064 64.055   17.699  83.694    25.256  45.102    24.811  8.5522 1.5329 6.0892 1.8633 2.463010       2.412793  
1 1 1 7  25 8  o 19.052 0.6563 381.248  25.003  391.569   35.797  371.417   34.937  19.305 0.9272 18.799 0.9292 0.5053024      1.312652  
1 1 1 7  25 9  o 9.2497 1.0434 98.524   18.796  90.764    26.812  106.024   26.356  8.7621 1.5885 9.7373 1.3534 -0.9752254     2.086822  
1 1 1 7  25 10 o 4.6080 1.2452 20.729   16.690  34.851    24.059  7.6278    23.173  5.3155 1.8482 3.9005 1.6691 1.414951       2.490337  
1 1 1 7  25 11 o 3.6280 1.1367 0.7796   16.449  -4.2652   24.019  5.2358    22.574  3.5020 1.5876 3.7540 1.6272 -0.2519507     2.273400  
1 1 1 7  25 12 o 6.0568 1.5398 47.606   21.119  42.858    23.950  64.208    44.781  5.7281 1.8418 6.3856 2.4682 -0.6574736     3.079636  
1 1 1 7  25 13 o 4.8731 1.3447 29.112   21.144  42.971    24.280  -14.3947  43.017  5.6474 1.8572 4.0987 1.9452 1.548718       2.689425  
1 1 1 7  25 14 o 9.1122 1.4163 108.204  22.682  90.967    26.270  158.679   44.955  8.3193 1.6372 9.9051 2.3115 -1.585850      2.832532  
1 1 1 7  25 15 o 3.7151 1.2008 1.6884   20.424  15.300    22.869  -51.9482  45.396  3.9604 1.6751 3.4697 1.7211 0.4906876      2.401677  
1 1 1 7  25 16 o 6.0270 1.4904 63.182   21.403  61.295    24.401  69.477    44.566  6.4038 1.8196 5.6502 2.3609 0.7536426      2.980745  
1 1 1 7  25 17 o 3.3187 1.1658 -21.7598 20.507  -29.7176  22.801  11.938    46.920  2.5547 1.2583 4.0827 1.9629 -1.528037      2.331630  
1 1 1 7  25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 0  o 8.9552 1.7476 108.682  27.817  78.931    38.883  139.870   39.812  7.0602 2.8329 10.850 2.0473 -0.000000      0.000000  
1 1 1 7  26 1  o 5.9530 1.2656 41.888   16.541  31.864    22.582  53.492    24.297  5.2508 1.7921 6.6552 1.7875 -1.404435      2.531149  
1 1 1 7  26 2  f 5.7714 1.2849 39.860   16.621  34.882    23.126  45.178    23.905  5.4393 1.8137 6.1035 1.8206 -0.6641707     2.569800  
1 1 1 7  26 3  o 3.4672 1.1013 -4.2010  15.906  -4.8490   23.133  -3.6199   21.907  3.4904 1.5724 3.4439 1.5425 0.4651070E-01  2.202668  
1 1 1 7  26 4  o 9.6118 0.9915 103.075  19.058  100.674   26.816  105.525   27.090  9.4913 1.4127 9.7323 1.3918 -0.2410517     1.983087  
1 1 1 7  26 5  o 3.7876 1.1580 4.0938   16.345  -4.1932   23.997  11.266    22.324  3.5369 1.5967 4.0384 1.6778 -0.5015597     2.316091  
1 1 1 7  26 6  o 6.0724 1.2282 45.710   17.643  18.702    25.560  70.290    24.384  4.5052 1.8247 7.6396 1.6446 -3.134335      2.456485  
1 1 1 7  26 7  o 13.342 0.7885 192.887  20.989  177.347   29.541  208.730   29.828  12.760 1.1576 13.925 1.0710 -1.165426      1.577053  
1 1 1 7  26 8  o 8.7178 1.1165 90.369   18.741  92.527    27.003  88.364    26.031  8.8096 1.5912 8.6260 1.5666 0.1835337      2.232939  
1 1 1 7  26 9  o 3.1455 1.0397 -19.0123 16.494  0.8250    24.525  -35.3933  22.287  3.6958 1.6453 2.5953 1.2714 1.100537       2.079319  
1 1 1 7  26 10 o 3.4165 1.1092 -6.9857  17.262  -11.1222  23.785  -2.3824   25.092  3.2450 1.5101 3.5881 1.6250 -0.3430462     2.218326  
1 1 1 7  26 11 o 4.4492 1.1982 16.186   17.173  42.701    24.106  -11.1342  24.470  5.6356 1.8504 3.2629 1.5228 2.372662       2.396438  
1 1 1 7  26 12 o 3.8850 1.2623 4.3661   20.533  4.4371    24.037  4.1743    39.496  3.6104 1.6165 4.1597 1.9391 -0.5493362     2.524504  
1 1 1 7  26 13 o 4.9230 1.4153 35.603   21.772  40.105    24.911  21.039    44.803  5.2327 1.8751 4.6133 2.1203 0.6194148      2.830510  
1 1 1 7  26 14 o 7.2763 1.3321 97.869   23.268  112.359   26.306  45.777    49.878  9.5364 1.3793 5.0162 2.2794 4.520187       2.664209  
1 1 1 7  26 15 o 6.4621 1.4110 78.587   21.836  83.860    24.916  61.131    45.336  7.7196 1.6629 5.2045 2.2801 2.515124       2.822054  
1 1 1 7  26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 0  o 5.0673 1.6915 41.337   23.805  71.024    32.944  8.9003    34.436  6.7533 2.5842 3.3812 2.1834 -0.000000      0.000000  
1 1 1 7  27 1  o 7.4037 1.2766 69.010   18.774  74.202    26.032  63.382    27.100  7.7771 1.7193 7.0303 1.8876 0.7467766      2.553255  
1 1 1 7  27 2  o 10.222 0.9903 119.066  20.039  108.344   29.397  128.372   27.388  9.6857 1.5176 10.759 1.2728 -1.073435      1.980641  
1 1 1 7  27 3  o 7.0127 1.2971 62.611   18.635  74.415    26.516  51.092    26.195  7.7502 1.7519 6.2753 1.9134 1.474974       2.594275  
1 1 1 7  27 4  o 9.3737 1.0605 103.006  19.140  92.371    28.162  112.135   26.093  8.7264 1.6745 10.021 1.3019 -1.294727      2.121093  
1 1 1 7  27 5  o 8.4929 1.1469 86.923   18.770  87.453    26.655  86.401    26.434  8.5172 1.6241 8.4685 1.6198 0.4871655E-01  2.293747  
1 1 1 7  27 6  o 5.5760 1.3554 40.311   18.281  40.896    25.531  39.697    26.188  5.6147 1.9056 5.5373 1.9280 0.7736921E-01  2.710808  
1 1 1 7  27 7  o 4.8972 1.2591 27.045   17.578  6.2405    25.643  45.486    24.142  3.9134 1.7146 5.8809 1.8444 -1.967479      2.518267  
1 1 1 7  27 8  o 4.0672 1.2315 10.889   18.062  3.2100    25.579  18.527    25.509  3.7725 1.6798 4.3618 1.8013 -0.5893013     2.463002  
1 1 1 7  27 9  o 4.0618 1.2473 11.278   18.830  9.2937    26.340  13.352    26.928  3.9762 1.7401 4.1473 1.7874 -0.1710644     2.494545  
1 1 1 7  27 10 o 4.9331 1.2715 29.728   18.214  58.825    26.951  5.2632    24.713  6.2240 1.9482 3.6423 1.6343 2.581683       2.542949  
1 1 1 7  27 11 o 5.8229 1.4596 56.746   22.500  63.937    26.912  40.043    41.013  6.5757 1.9240 5.0701 2.1955 1.505643       2.919218  
1 1 1 7  27 12 o 5.4463 1.5429 40.150   22.130  24.149    25.216  93.777    46.163  4.3285 1.7895 6.5641 2.5140 -2.235527      3.085876  
1 1 1 7  27 13 f 3.8790 1.2655 9.8665   21.461  9.8928    25.401  9.8011    40.122  3.7005 1.6589 4.0575 1.9115 -0.3570042     2.530964  
1 1 1 7  27 14 o 5.0424 1.4578 48.844   22.650  47.776    25.594  52.704    48.645  5.2683 1.8993 4.8164 2.2121 0.4519238      2.915576  
1 1 1 7  27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  27 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 0  o 3.5221 1.5388 7.1277   23.477  -21.6683  32.369  39.088    34.102  2.5171 1.7574 4.5272 2.5264 -0.000000      0.000000  
1 1 1 7  28 1  o 6.0081 1.2674 47.172   19.187  14.384    28.247  75.263    26.145  4.3147 1.8445 7.7015 1.7386 -3.386712      2.534754  
1 1 1 7  28 2  o 9.5768 1.1481 116.667  20.223  66.676    28.925  164.470   28.284  6.9737 1.9809 12.180 1.1611 -5.206372      2.296140  
1 1 1 7  28 3  o 5.2540 1.3712 34.972   19.533  49.092    28.439  22.363    26.874  5.9323 2.0112 4.5758 1.8645 1.356474       2.742471  
1 1 1 7  28 4  o 4.2958 1.3344 11.735   21.099  10.019    25.878  15.138    36.440  4.0268 1.7438 4.5647 2.0202 -0.5378332     2.668715  
1 1 1 7  28 5  o 3.5267 1.1313 -2.0491  17.359  2.6312    24.329  -6.9034   24.777  3.6639 1.6344 3.3895 1.5647 0.2743988      2.262640  
1 1 1 7  28 6  o 5.1960 1.2551 31.467   18.323  64.242    26.714  2.3474    25.179  6.7473 1.8992 3.6447 1.6413 3.102515       2.510190  
1 1 1 7  28 7  o 4.8737 1.3533 33.666   19.462  43.792    28.437  24.745    26.691  5.3120 1.9869 4.4353 1.8379 0.8767042      2.706625  
1 1 1 7  28 8  o 5.1781 1.2540 33.754   19.307  -3.2723   27.993  67.347    26.664  3.5507 1.6475 6.8056 1.8911 -3.254975      2.508084  
1 1 1 7  28 9  o 5.8615 1.3999 53.631   19.494  52.710    28.395  54.452    26.810  5.7711 2.0077 5.9519 1.9513 -0.1808352     2.799735  
1 1 1 7  28 10 o 4.8811 1.4762 28.397   22.346  13.031    25.728  75.600    45.092  3.8741 1.7068 5.8882 2.4090 -2.014094      2.952359  
1 1 1 7  28 11 o 3.7090 1.2135 4.4493   21.923  17.034    25.928  -27.1184  41.064  3.9485 1.7272 3.4695 1.7050 0.4790354      2.426945  
1 1 1 7  28 12 f 4.5883 1.4352 31.641   22.749  20.629    26.183  65.555    45.951  4.0051 1.7442 5.1715 2.2796 -1.166397      2.870371  
1 1 1 7  28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  28 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 0  o 3.9535 1.6883 25.673   26.827  -3.2359   38.052  54.241    37.827  2.9851 2.0388 4.9218 2.6916 -0.000000      0.000000  
1 1 1 7  29 1  o 5.0034 1.3430 37.102   18.546  35.686    26.895  38.385    25.607  4.9241 1.9101 5.0828 1.8885 -0.1586618     2.686099  
1 1 1 7  29 2  o 3.4959 1.1408 -4.6550  18.612  11.161    28.032  -17.1236  24.889  3.9567 1.7604 3.0351 1.4514 0.9216697      2.281585  
1 1 1 7  29 3  o 6.2437 1.2822 55.606   19.262  88.235    27.783  25.404    26.729  8.0107 1.7803 4.4767 1.8458 3.533932       2.564455  
1 1 1 7  29 4  o 4.0186 1.2224 9.9703   18.663  -8.9588   25.656  31.244    27.199  3.2883 1.5426 4.7490 1.8967 -1.460697      2.444797  
1 1 1 7  29 5  f 5.8175 1.3888 52.237   19.195  50.808    28.613  53.406    25.884  5.6764 2.0122 5.9585 1.9146 -0.2820106     2.777538  
1 1 1 7  29 6  o 5.1668 1.3999 42.332   20.235  42.001    29.927  42.612    27.465  5.1237 2.0073 5.2099 1.9519 -0.8622789E-01 2.799825  
1 1 1 7  29 7  o 5.0662 1.3862 41.516   20.029  39.301    28.722  43.613    27.943  4.9541 1.9584 5.1783 1.9625 -0.2242079     2.772492  
1 1 1 7  29 8  o 5.5397 1.3507 50.959   19.418  33.385    28.571  66.047    26.472  4.6203 1.9070 6.4591 1.9133 -1.838807      2.701387  
1 1 1 7  29 9  o 4.4203 1.3006 30.313   19.012  35.435    27.709  25.757    26.135  4.6168 1.8886 4.2239 1.7888 0.3928604      2.601268  
1 1 1 7  29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  29 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 0  o 5.2291 1.9699 64.443   27.956  64.982    40.920  63.972    38.284  5.1867 2.8115 5.2714 2.7600 -0.000000      0.000000  
1 1 1 7  30 1  o 3.3177 1.0981 -5.1877  18.279  -11.1566  25.891  0.7442    25.811  3.1674 1.5049 3.4680 1.5996 -0.3005404     2.196233  
1 1 1 7  30 2  o 3.6212 1.1580 5.6226   18.240  -4.4403   26.295  14.954    25.322  3.3428 1.5661 3.8997 1.7063 -0.5569322     2.316055  
1 1 1 7  30 3  o 3.3630 1.1127 -3.2288  18.675  -1.5532   25.876  -5.0503   26.980  3.3835 1.5747 3.3424 1.5724 0.4105520E-01  2.225322  
1 1 1 7  30 4  o 5.4669 1.3187 48.828   20.093  18.653    29.369  75.378    27.549  4.0510 1.8022 6.8828 1.9256 -2.831807      2.637401  
1 1 1 7  30 5  o 4.6624 1.3461 34.292   20.516  53.396    30.119  17.754    28.023  5.3662 2.0365 3.9586 1.7608 1.407609       2.692182  
1 1 1 7  30 6  o 3.2325 1.0838 -8.8273  19.206  -25.2723  27.670  6.4616    26.680  2.9051 1.4218 3.5598 1.6362 -0.6546988     2.167600  
1 1 1 7  30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  30 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  31 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  32 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  33 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  34 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 7  35 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  1  0  f 6.1196 1.0900 44.114   11.538  42.679    16.256  45.571    16.380  5.9845 1.5720 6.2548 1.5103 -0.000000      0.000000  
1 1 1 8  1  1  o 37.264 0.5530 1394.71  41.211  1398.44   58.304  1390.99   58.258  37.314 0.7813 37.214 0.7827 0.9994888E-01  1.105910  
1 1 1 8  1  2  o 28.888 0.5167 837.729  29.852  847.804   42.204  827.641   42.230  29.063 0.7261 28.713 0.7354 0.3490524      1.033422  
1 1 1 8  1  3  o 22.965 0.5701 525.711  22.849  538.602   45.416  521.342   26.439  23.125 0.9820 22.805 0.5797 0.3207493      1.140299  
1 1 1 8  1  4  o 19.160 0.5651 364.280  18.857  378.581   37.728  359.518   21.771  19.384 0.9732 18.936 0.5748 0.4482098      1.130269  
1 1 1 8  1  5  o 15.461 0.5821 242.589  15.448  236.243   31.063  244.675   17.807  15.301 1.0151 15.620 0.5700 -0.3185549     1.164147  
1 1 1 8  1  6  o 24.057 0.5043 581.285  24.264  576.125   34.201  586.515   34.430  23.949 0.7140 24.165 0.7124 -0.2152367     1.008636  
1 1 1 8  1  7  o 11.394 0.5296 130.367  12.063  133.215   16.921  127.424   17.202  11.522 0.7343 11.267 0.7634 0.2548294      1.059211  
1 1 1 8  1  8  f 33.543 0.5391 1129.79  36.169  1128.24   51.073  1131.36   51.228  33.520 0.7618 33.566 0.7631 -0.4615021E-01 1.078282  
1 1 1 8  1  9  o 34.202 0.5421 1173.76  37.078  1149.91   52.241  1197.96   52.634  33.851 0.7716 34.553 0.7617 -0.7015152     1.084211  
1 1 1 8  1  10 o 9.1947 0.5663 84.913   10.409  85.664    14.546  84.125    14.902  9.2370 0.7874 9.1524 0.8141 0.8463192E-01  1.132571  
1 1 1 8  1  11 o 10.482 0.5547 109.857  11.594  98.829    15.848  122.556   17.006  9.9175 0.7990 11.046 0.7698 -1.128441      1.109496  
1 1 1 8  1  12 o 24.155 0.5122 586.046  24.732  559.183   34.590  614.146   35.377  23.587 0.7332 24.722 0.7155 -1.135025      1.024473  
1 1 1 8  1  13 o 21.507 0.5072 464.721  21.792  434.374   30.429  496.674   31.224  20.784 0.7320 22.229 0.7023 -1.445440      1.014468  
1 1 1 8  1  14 o 10.594 0.5759 113.018  12.178  104.744   16.658  122.519   17.850  10.178 0.8183 11.009 0.8107 -0.8308954     1.151887  
1 1 1 8  1  15 o 14.103 0.7275 218.816  18.233  166.270   32.172  243.677   22.130  12.680 1.2686 15.527 0.7126 -2.846709      1.455072  
1 1 1 8  1  16 o 11.652 0.7817 152.054  16.167  114.487   28.349  170.161   19.681  10.383 1.3652 12.920 0.7616 -2.537791      1.563308  
1 1 1 8  1  17 o 22.426 0.6341 526.508  26.942  545.797   33.556  491.521   45.194  23.130 0.7254 21.723 1.0402 1.406361       1.268170  
1 1 1 8  1  18 o 3.0087 0.9358 0.8340   9.4445  4.1938    10.439  -14.3269  22.174  2.8568 1.1628 3.1606 1.4665 -0.3038063     1.871525  
1 1 1 8  1  19 o 5.7604 0.9156 36.617   10.296  31.171    13.953  43.126    15.255  5.2749 1.3245 6.2460 1.2646 -0.9710903     1.831247  
1 1 1 8  1  20 o 6.5640 0.8633 47.678   10.987  56.766    15.494  38.486    15.582  7.3137 1.0592 5.8142 1.3636 1.499510       1.726640  
1 1 1 8  1  21 o 3.3583 0.9438 7.1658   9.8778  14.385    13.834  -0.3433   14.109  3.8019 1.3924 2.9148 1.2746 0.8870201      1.887667  
1 1 1 8  1  22 o 12.021 0.6091 150.477  14.322  151.078   18.470  149.570   22.681  12.102 0.7631 11.941 0.9497 0.1604900      1.218286  
1 1 1 8  1  23 o 2.7355 0.7800 0.9403   5.1999  12.922    12.791  -1.4319   5.6914  3.6593 1.3391 1.8117 0.8002 1.847641       1.559972  
1 1 1 8  1  24 o 6.7583 0.6227 47.021   8.3632  55.108    12.486  40.441    11.263  7.2870 0.8567 6.2296 0.9040 1.057419       1.245474  
1 1 1 8  1  25 o 12.595 0.4491 162.688  11.215  155.529   16.788  168.459   15.072  12.325 0.6810 12.866 0.5857 -0.5411997     0.8982776 
1 1 1 8  1  26 o 8.5753 0.5681 76.925   9.3918  72.664    15.213  79.550    11.939  8.3397 0.9121 8.8109 0.6775 -0.4712124     1.136158  
1 1 1 8  1  27 o 13.024 0.4650 175.753  12.004  160.949   17.695  188.374   16.339  12.483 0.7088 13.565 0.6023 -1.081966      0.9300936 
1 1 1 8  1  28 o 2.6466 0.7882 1.8125   7.3807  -4.9267   11.531  6.4901    9.6065  2.4005 1.0928 2.8926 1.1361 -0.4921906     1.576325  
1 1 1 8  1  29 o 7.1553 0.6789 56.004   9.5920  69.133    14.265  45.168    12.959  7.9572 0.8963 6.3535 1.0199 1.603649       1.357768  
1 1 1 8  1  30 o 9.6891 0.5688 101.826  11.019  104.991   15.774  98.810    15.400  9.8387 0.8016 9.5395 0.8072 0.2991858      1.137586  
1 1 1 8  1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  2  0  o 7.9102 0.8931 67.424   13.037  70.495    18.745  64.547    18.143  8.1052 1.2434 7.7152 1.2823 -0.000000      0.000000  
1 1 1 8  2  1  o 20.745 0.4910 431.923  20.367  418.825   28.723  445.168   28.883  20.427 0.7030 21.062 0.6857 -0.6345043     0.9820548 
1 1 1 8  2  2  o 18.075 0.4897 327.912  17.704  323.366   24.982  332.497   25.092  17.949 0.6959 18.201 0.6893 -0.2523003     0.9794933 
1 1 1 8  2  3  f 15.690 0.4925 247.162  15.455  244.557   21.859  249.765   21.853  15.607 0.7003 15.773 0.6927 -0.1659727     0.9850249 
1 1 1 8  2  4  o 19.762 0.4942 392.194  19.532  391.390   27.594  393.001   27.652  19.741 0.6989 19.782 0.6989 -0.4057121E-01 0.9884036 
1 1 1 8  2  5  o 10.594 0.5292 112.808  11.210  115.802   15.850  109.811   15.857  10.735 0.7382 10.452 0.7585 0.2827635      1.058477  
1 1 1 8  2  6  o 48.517 0.5645 2371.45  53.667  2326.19   84.403  2402.17   69.534  48.105 0.8773 48.928 0.7106 -0.8230133     1.128948  
1 1 1 8  2  7  o 23.699 0.5778 561.968  23.859  568.996   47.400  559.583   27.612  23.770 0.9970 23.627 0.5843 0.1433620      1.155644  
1 1 1 8  2  8  o 32.539 0.6146 1065.49  34.893  1060.70   68.888  1067.15   40.468  32.452 1.0614 32.627 0.6202 -0.1754990     1.229289  
1 1 1 8  2  9  o 30.984 0.6191 983.612  33.240  925.202   65.336  1004.01   38.610  30.315 1.0776 31.652 0.6099 -1.336823      1.238238  
1 1 1 8  2  10 o 28.642 0.6046 830.461  30.115  812.237   59.481  836.742   34.922  28.394 1.0474 28.890 0.6044 -0.4969234     1.209296  
1 1 1 8  2  11 f 10.088 0.6526 100.468  11.335  106.493   23.170  98.573    12.996  10.265 1.1286 9.9105 0.6557 0.3543720      1.305251  
1 1 1 8  2  12 o 15.617 0.6110 249.844  16.328  237.522   32.772  253.913   18.832  15.326 1.0692 15.907 0.5919 -0.5813475     1.222087  
1 1 1 8  2  13 o 11.804 0.5486 140.408  12.866  120.212   17.918  161.910   18.488  10.922 0.8202 12.686 0.7287 -1.763767      1.097168  
1 1 1 8  2  14 o 24.398 0.5213 601.684  25.367  545.080   35.567  660.289   36.190  23.220 0.7659 25.577 0.7075 -2.356726      1.042647  
1 1 1 8  2  15 o 5.7354 0.9952 32.116   10.788  48.888    19.491  24.709    12.953  6.6834 1.4956 4.7874 1.3133 1.896029       1.990337  
1 1 1 8  2  16 o 26.768 0.5288 728.381  28.295  698.060   39.774  759.447   40.260  26.198 0.7591 27.339 0.7363 -1.141237      1.057547  
1 1 1 8  2  17 o 4.5739 0.7974 19.079   8.9466  0.3293    12.059  42.032    13.343  2.7953 1.2003 6.3526 1.0502 -3.557252      1.594897  
1 1 1 8  2  18 o 11.883 0.8479 165.397  17.068  186.051   20.375  116.804   31.253  13.470 0.7563 10.295 1.5179 3.175675       1.695874  
1 1 1 8  2  19 o 12.622 0.5874 165.667  14.671  193.888   20.847  137.979   20.649  13.727 0.7593 11.517 0.8965 2.210680       1.174858  
1 1 1 8  2  20 o 2.6322 0.8191 -4.8924  8.7687  -13.7448  12.044  5.0941    12.792  2.1487 1.0225 3.1157 1.2798 -0.9670515     1.638146  
1 1 1 8  2  21 o 7.4470 0.8394 60.369   12.157  52.217    16.638  69.706    17.806  6.8295 1.2647 8.0646 1.1040 -1.235107      1.678745  
1 1 1 8  2  22 o 14.326 0.5779 216.225  16.113  232.776   21.069  192.904   25.009  15.064 0.6993 13.589 0.9202 1.475103       1.155799  
1 1 1 8  2  23 o 3.9956 0.9034 13.573   10.808  32.536    13.871  -15.7329  17.244  5.3499 1.3075 2.6414 1.2470 2.708506       1.806798  
1 1 1 8  2  24 o 12.229 0.5173 152.281  12.420  159.666   19.716  147.423   15.991  12.447 0.7920 12.012 0.6656 0.4340906      1.034575  
1 1 1 8  2  25 f 11.350 0.5491 131.613  12.294  140.358   19.264  125.603   15.969  11.642 0.8274 11.058 0.7220 0.5835485      1.098128  
1 1 1 8  2  26 o 13.963 0.4883 199.388  13.623  188.921   18.806  210.945   19.761  13.577 0.6926 14.348 0.6886 -0.7715797     0.9766530 
1 1 1 8  2  27 o 2.5147 0.7482 2.4093   6.1244  -3.6019   11.821  4.6148    7.1603  2.5099 1.1280 2.5195 0.9833 -0.9561062E-02 1.496388  
1 1 1 8  2  28 o 3.9473 0.8152 18.488   7.6564  5.6464    12.506  26.186    9.6830  3.0576 1.2618 4.8371 1.0324 -1.779492      1.630323  
1 1 1 8  2  29 o 3.6017 0.9140 13.679   8.3119  20.506    13.308  9.3121    10.643  4.0884 1.3758 3.1149 1.2035 0.9734550      1.827919  
1 1 1 8  2  30 o 11.686 0.5318 146.611  12.400  156.711   18.303  138.042   16.859  12.048 0.7596 11.324 0.7444 0.7238197      1.063501  
1 1 1 8  2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  3  0  o 15.333 0.7041 239.138  21.370  233.132   30.429  244.984   30.019  15.136 1.0157 15.531 0.9752 -0.000000      0.000000  
1 1 1 8  3  1  o 22.696 0.4932 517.250  22.387  524.857   31.639  509.623   31.680  22.864 0.6919 22.528 0.7031 0.3357487      0.9864714 
1 1 1 8  3  2  o 21.040 0.4906 444.503  20.643  443.510   29.203  445.495   29.184  21.016 0.6948 21.063 0.6928 -0.4722023E-01 0.9811497 
1 1 1 8  3  3  f 13.261 0.4984 176.886  13.196  187.860   18.602  165.770   18.722  13.678 0.6800 12.844 0.7288 0.8332539      0.9967870 
1 1 1 8  3  4  o 28.712 0.5129 828.206  29.449  812.765   41.576  843.753   41.719  28.443 0.7309 28.982 0.7197 -0.5391865     1.025768  
1 1 1 8  3  5  o 20.862 0.4952 436.701  20.661  433.130   29.289  440.238   29.149  20.777 0.7049 20.947 0.6958 -0.1706753     0.9904152 
1 1 1 8  3  6  o 20.741 0.4956 431.671  20.558  431.379   29.069  431.962   29.077  20.734 0.7010 20.748 0.7007 -0.1402855E-01 0.9911596 
1 1 1 8  3  7  o 16.175 0.4979 262.506  16.104  257.014   22.731  268.040   22.817  16.004 0.7102 16.345 0.6980 -0.3406315     0.9957444 
1 1 1 8  3  8  f 15.787 0.5024 250.019  15.858  256.287   22.380  243.698   22.474  15.986 0.7000 15.587 0.7209 0.3989077      1.004813  
1 1 1 8  3  9  o 31.947 0.6154 1032.65  34.188  1011.47   67.558  1039.94   39.638  31.686 1.0661 32.208 0.6153 -0.5220070     1.230897  
1 1 1 8  3  10 o 19.290 0.5800 376.825  19.458  368.140   38.416  379.822   22.566  19.116 1.0048 19.465 0.5797 -0.3491058     1.160044  
1 1 1 8  3  11 f 40.875 0.6620 1679.45  47.090  1693.93   93.567  1674.54   54.494  40.912 1.1435 40.838 0.6672 0.7427979E-01  1.323936  
1 1 1 8  3  12 o 9.3313 0.8392 87.693   15.661  0.0000    0.0000  87.693    15.661  ?      ?      9.3313 0.8392 ?              ?         
1 1 1 8  3  13 o 19.940 0.6364 429.235  21.118  352.774   42.298  454.622   24.373  18.609 1.1365 21.271 0.5729 -2.662285      1.272736  
1 1 1 8  3  14 o 10.001 0.7615 115.671  12.098  79.462    24.351  127.537   13.940  8.7511 1.3913 11.251 0.6195 -2.500269      1.522975  
1 1 1 8  3  15 o 2.8986 0.8393 4.7699   6.5970  -1.9638   15.690  6.2158    7.2709  3.0656 1.3422 2.7316 1.0080 0.3340075      1.678587  
1 1 1 8  3  16 o 12.004 0.6358 145.842  15.263  0.0000    0.0000  145.842   15.263  ?      ?      12.004 0.6358 ?              ?         
1 1 1 8  3  17 f 6.4315 0.9420 53.088   9.5232  30.759    21.517  58.527    10.620  5.2820 1.7489 7.5809 0.7004 -2.298877      1.883929  
1 1 1 8  3  18 o 5.9065 1.1984 38.366   15.617  22.205    20.854  59.005    23.567  4.6781 1.7101 7.1348 1.6794 -2.456738      2.396846  
1 1 1 8  3  19 o 9.3773 0.8422 88.032   14.797  114.460   27.194  76.917    17.635  10.225 1.3298 8.5294 1.0338 1.695713       1.684355  
1 1 1 8  3  20 o 10.512 0.8577 121.854  16.257  112.995   29.502  125.717   19.481  10.048 1.4680 10.976 0.8874 -0.9277945     1.715402  
1 1 1 8  3  21 o 7.6366 1.0861 63.402   15.107  82.887    27.336  54.834    18.127  8.3234 1.6996 6.9497 1.3528 1.373759       2.172266  
1 1 1 8  3  22 o 13.772 0.6539 196.837  17.945  220.451   26.627  177.189   24.289  14.529 0.9163 13.016 0.9331 1.513582       1.307765  
1 1 1 8  3  23 o 3.7298 1.0717 9.4895   12.737  2.5042    19.502  14.685    16.820  3.4930 1.5132 3.9667 1.5179 -0.4736781     2.143365  
1 1 1 8  3  24 o 2.8753 0.9446 -12.1432 12.939  -15.4988  20.181  -9.8012   16.860  2.9371 1.3747 2.8136 1.2959 0.1235836      1.889270  
1 1 1 8  3  25 o 15.398 0.7021 251.666  21.414  223.535   31.153  276.865   29.485  14.511 1.0735 16.286 0.9052 -1.775597      1.404185  
1 1 1 8  3  26 o 7.8370 1.0955 71.220   16.742  58.055    24.090  83.518    23.283  6.9474 1.7381 8.7265 1.3341 -1.779054      2.191040  
1 1 1 8  3  27 o 6.5837 1.2179 54.330   16.506  42.938    23.615  65.213    23.080  5.8187 1.8240 7.3488 1.6145 -1.530022      2.435892  
1 1 1 8  3  28 f 5.9832 1.1851 46.586   14.752  49.879    18.862  41.399    23.673  6.3868 1.5018 5.5796 1.8338 0.8071909      2.370295  
1 1 1 8  3  29 o 8.1284 0.8350 75.024   13.430  85.030    20.929  68.020    17.510  8.5400 1.2253 7.7169 1.1345 0.8230672      1.669909  
1 1 1 8  3  30 o 3.2041 0.9793 7.3446   11.548  2.1121    18.552  10.654    14.755  3.1011 1.4015 3.3071 1.3682 -0.2060673     1.958605  
1 1 1 8  3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  4  0  o 3.9590 1.2185 22.713   10.019  21.610    15.105  23.579    13.389  3.8232 1.7788 4.0948 1.6657 -0.000000      0.000000  
1 1 1 8  4  1  o 33.742 0.5293 1144.32  35.718  1159.59   50.595  1129.14   50.431  33.967 0.7448 33.517 0.7523 0.4506149      1.058608  
1 1 1 8  4  2  o 28.410 0.5079 810.780  28.859  820.073   40.816  801.489   40.810  28.574 0.7142 28.247 0.7224 0.3270531      1.015848  
1 1 1 8  4  3  o 46.743 0.5983 2196.70  55.928  2155.97   78.929  2237.77   79.259  46.306 0.8523 47.180 0.8400 -0.8739548     1.196607  
1 1 1 8  4  4  o 10.205 0.5340 104.580  10.892  106.702   15.247  102.368   15.565  10.311 0.7393 10.098 0.7707 0.2131157      1.067984  
1 1 1 8  4  5  o 8.0227 0.5819 64.683   9.3344  63.961    13.318  65.380    13.087  7.9781 0.8347 8.0672 0.8111 -0.8915043E-01 1.163857  
1 1 1 8  4  6  o 25.853 0.5036 670.808  26.035  654.320   36.813  687.309   36.826  25.534 0.7209 26.172 0.7035 -0.6379833     1.007262  
1 1 1 8  4  7  o 14.666 0.5012 215.753  14.694  224.467   20.838  207.135   20.723  14.961 0.6964 14.370 0.7210 0.5906706      1.002426  
1 1 1 8  4  8  o 24.623 0.5037 608.183  24.805  610.373   35.144  606.008   35.016  24.667 0.7124 24.579 0.7123 0.8835220E-01  1.007424  
1 1 1 8  4  9  o 8.6807 0.5767 75.904   9.9822  81.756    14.018  69.884    14.218  9.0229 0.7768 8.3386 0.8525 0.6843510      1.153366  
1 1 1 8  4  10 o 12.983 0.6171 165.901  15.301  182.190   26.347  157.611   18.795  13.443 0.9800 12.524 0.7504 0.9184418      1.234258  
1 1 1 8  4  11 o 36.539 0.5545 1343.16  40.523  1343.73   57.623  1342.61   56.998  36.545 0.7884 36.533 0.7801 0.1287460E-01  1.109092  
1 1 1 8  4  12 o 10.718 0.6922 116.325  13.217  115.590   25.225  116.604   15.517  10.668 1.1822 10.767 0.7206 -0.9875488E-01 1.384500  
1 1 1 8  4  13 o 8.5824 0.8246 81.488   10.856  67.950    23.140  85.308    12.293  7.9652 1.5078 9.1995 0.6681 -1.234385      1.649196  
1 1 1 8  4  14 o 5.7209 0.9318 39.975   10.218  19.324    19.176  48.165    12.076  4.5611 1.6440 6.8806 0.8775 -2.319443      1.863575  
1 1 1 8  4  15 o 13.098 0.7439 205.930  14.987  131.564   30.580  229.437   17.193  11.129 1.3739 15.066 0.5706 -3.937836      1.487709  
1 1 1 8  4  16 o 5.3595 0.9641 31.919   8.7613  27.729    21.029  32.799    9.6375  5.0697 1.7294 5.6494 0.8530 -0.5796762     1.928296  
1 1 1 8  4  17 o 5.2067 0.9510 28.137   8.3097  33.085    19.412  27.027    9.1948  5.3861 1.6481 5.0274 0.9493 0.3587031      1.901960  
1 1 1 8  4  18 f 7.8330 0.9940 80.908   12.336  44.347    24.376  93.495    14.303  6.1166 1.8415 9.5495 0.7489 -3.432985      1.987987  
1 1 1 8  4  19 o 7.7525 1.0627 75.667   14.156  52.672    26.501  84.848    16.745  6.5060 1.9108 8.9989 0.9304 -2.492904      2.125308  
1 1 1 8  4  20 o 6.3428 1.1515 41.439   13.138  66.325    26.782  33.552    15.077  7.3009 1.8360 5.3846 1.3904 1.916230       2.303027  
1 1 1 8  4  21 o 7.1103 1.1413 65.785   15.490  41.429    28.204  76.306    18.537  5.7763 2.0015 8.4442 1.0976 -2.667914      2.282661  
1 1 1 8  4  22 o 5.1379 1.1595 29.705   13.436  37.861    20.572  23.639    17.742  5.6488 1.6898 4.6270 1.5883 1.021847       2.319061  
1 1 1 8  4  23 o 5.9569 1.1843 42.714   14.614  40.819    22.805  44.035    19.036  5.7950 1.7886 6.1187 1.5529 -0.3237534     2.368673  
1 1 1 8  4  24 o 6.7686 1.1713 54.958   15.774  47.051    23.853  61.104    21.028  6.2330 1.8078 7.3042 1.4899 -1.071257      2.342674  
1 1 1 8  4  25 o 10.582 0.8441 119.952  17.759  128.773   26.926  113.161   23.626  10.896 1.2356 10.268 1.1505 0.6283941      1.688288  
1 1 1 8  4  26 o 7.3911 1.1780 66.617   16.965  57.691    25.620  73.588    22.640  6.7968 1.8397 7.9853 1.4718 -1.188590      2.356054  
1 1 1 8  4  27 o 4.1756 1.1887 10.374   16.135  30.997    24.367  -5.7307   21.533  5.0676 1.8491 3.2837 1.4943 1.783840       2.377435  
1 1 1 8  4  28 o 5.4816 1.2088 34.163   17.575  70.505    25.930  3.2812    23.903  7.3063 1.7889 3.6569 1.6264 3.649489       2.417677  
1 1 1 8  4  29 o 6.4860 1.3347 62.395   18.710  77.122    27.270  49.298    25.717  7.2982 1.8622 5.6739 1.9126 1.624289       2.669366  
1 1 1 8  4  30 o 3.5338 1.0280 13.784   11.234  14.032    19.890  13.668    13.614  3.6261 1.5489 3.4415 1.3522 0.1845443      2.056076  
1 1 1 8  4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  4  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  5  0  o 32.576 0.7446 1068.29  48.392  1090.97   68.843  1046.15   68.038  32.920 1.0480 32.233 1.0580 -0.000000      0.000000  
1 1 1 8  5  1  o 23.469 0.4932 552.564  23.149  557.564   32.699  547.540   32.776  23.576 0.6935 23.362 0.7015 0.2137432      0.9864173 
1 1 1 8  5  2  o 31.745 0.5205 1011.29  33.045  1012.57   46.724  1010.01   46.742  31.765 0.7355 31.725 0.7367 0.4044914E-01  1.040951  
1 1 1 8  5  3  o 20.820 0.4902 434.979  20.405  449.983   28.918  420.100   28.798  21.179 0.6827 20.462 0.7037 0.7173405      0.9804492 
1 1 1 8  5  4  o 4.4991 0.7928 21.272   7.2544  27.409    10.237  15.081    10.282  5.1253 1.0343 3.8729 1.2019 1.252408       1.585664  
1 1 1 8  5  5  o 34.738 0.5350 1211.25  37.169  1209.16   52.603  1213.34   52.526  34.708 0.7578 34.768 0.7554 -0.6043625E-01 1.069965  
1 1 1 8  5  6  o 40.220 0.5629 1623.61  45.278  1635.75   64.117  1611.53   63.950  40.370 0.7941 40.069 0.7980 0.3007774      1.125789  
1 1 1 8  5  7  f 9.7588 0.5484 95.634   10.698  98.177    15.031  93.024    15.228  9.8910 0.7598 9.6265 0.7909 0.2644949      1.096784  
1 1 1 8  5  8  o 27.897 0.5124 781.065  28.590  777.405   40.480  784.707   40.386  27.831 0.7272 27.963 0.7221 -0.1311169     1.024870  
1 1 1 8  5  9  o 12.623 0.5205 160.332  13.093  176.826   18.579  144.058   18.455  13.271 0.7000 11.974 0.7706 1.297617       1.041052  
1 1 1 8  5  10 o 25.395 0.6107 648.982  29.579  647.701   36.669  651.366   50.049  25.386 0.7222 25.404 0.9851 -0.1730537E-01 1.221458  
1 1 1 8  5  11 o 32.282 0.5346 1047.92  34.507  1083.56   49.248  1013.54   48.364  32.823 0.7502 31.742 0.7618 1.081013       1.069200  
1 1 1 8  5  12 o 17.356 0.5104 303.894  17.700  295.216   25.372  312.120   24.705  17.111 0.7414 17.601 0.7018 -0.4906311     1.020889  
1 1 1 8  5  13 o 16.576 0.5158 278.045  17.072  264.041   24.400  291.474   23.895  16.160 0.7549 16.991 0.7032 -0.8310795     1.031672  
1 1 1 8  5  14 o 4.4447 0.8274 19.966   8.0823  33.907    12.045  8.5482    10.901  5.6300 1.1092 3.2594 1.2280 2.370556       1.654757  
1 1 1 8  5  15 o 9.7070 0.7513 103.367  11.616  86.823    24.712  108.059   13.160  9.0789 1.3609 10.335 0.6367 -1.256047      1.502504  
1 1 1 8  5  16 o 7.6651 0.9607 74.773   10.640  46.958    24.021  81.563    11.868  6.3715 1.8036 8.9588 0.6624 -2.587319      1.921394  
1 1 1 8  5  17 o 6.5661 0.9940 55.308   9.8038  34.711    24.309  59.308    10.714  5.5135 1.8595 7.6188 0.7031 -2.105355      1.987969  
1 1 1 8  5  18 o 12.506 0.6985 155.966  15.869  184.152   30.385  145.394   18.609  13.136 1.1565 11.876 0.7835 1.259993       1.396916  
1 1 1 8  5  19 o 4.3888 0.9982 21.537   12.129  -12.6957  23.216  34.387    14.224  3.2583 1.5078 5.5192 1.3085 -2.260905      1.996436  
1 1 1 8  5  20 o 10.533 0.8364 108.175  16.633  161.708   30.261  84.998    19.911  12.171 1.2432 8.8948 1.1193 3.275914       1.672793  
1 1 1 8  5  21 o 3.9018 1.1213 10.416   12.314  13.691    24.339  9.2888    14.275  4.3073 1.7669 3.4964 1.3811 0.8108766      2.242650  
1 1 1 8  5  22 o 5.6477 1.1631 37.832   13.812  37.469    21.658  38.080    17.931  5.5924 1.7458 5.7029 1.5372 -0.1104894     2.326117  
1 1 1 8  5  23 o 8.0663 1.0410 77.990   15.618  51.967    24.027  97.028    20.551  6.5641 1.7837 9.5685 1.0739 -3.004309      2.082009  
1 1 1 8  5  24 o 7.7608 1.0996 71.882   16.173  55.586    25.784  82.452    20.767  6.7528 1.8531 8.7688 1.1841 -2.015991      2.199100  
1 1 1 8  5  25 o 17.292 0.6898 318.357  23.537  275.473   34.398  356.115   32.276  16.098 1.0684 18.486 0.8730 -2.388178      1.379675  
1 1 1 8  5  26 f 10.460 0.9042 120.555  18.859  126.390   27.975  115.695   25.533  10.665 1.3115 10.255 1.2450 0.4103022      1.808334  
1 1 1 8  5  27 o 8.0163 1.1870 78.391   18.358  88.005    27.521  70.685    24.640  8.4619 1.6854 7.5707 1.6720 0.8911276      2.374039  
1 1 1 8  5  28 o 3.1513 1.0476 -12.1484 16.599  -1.5082   25.601  -19.8666  21.804  3.5090 1.6091 2.7936 1.3418 0.7153397      2.095139  
1 1 1 8  5  29 o 3.0237 1.0197 -14.1371 17.032  -11.2739  25.211  -16.5409  23.101  3.1468 1.4922 2.9006 1.3900 0.2461202      2.039312  
1 1 1 8  5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  5  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  6  0  o 7.2692 1.0209 59.132   13.115  65.066    18.628  53.298    18.470  7.7312 1.3203 6.8072 1.5574 -0.000000      0.000000  
1 1 1 8  6  1  o 19.720 0.4869 390.358  19.194  401.565   27.074  379.032   27.216  20.006 0.6766 19.435 0.7002 0.5716839      0.9737159 
1 1 1 8  6  2  o 26.918 0.5018 727.091  27.015  723.175   38.159  731.026   38.252  26.845 0.7107 26.990 0.7086 -0.1456013     1.003644  
1 1 1 8  6  3  o 6.4731 0.6590 42.105   8.5270  43.857    12.247  40.456    11.880  6.6039 0.9272 6.3423 0.9365 0.2616043      1.317909  
1 1 1 8  6  4  o 18.064 0.4912 327.317  17.735  313.023   24.968  341.873   25.195  17.665 0.7067 18.463 0.6823 -0.7980556     0.9823157 
1 1 1 8  6  5  o 19.356 0.4894 375.648  18.943  370.112   26.685  381.270   26.894  19.212 0.6945 19.500 0.6896 -0.2878227     0.9787201 
1 1 1 8  6  6  o 21.682 0.4921 471.630  21.331  457.028   30.131  486.302   30.202  21.345 0.7058 22.020 0.6858 -0.6749115     0.9841229 
1 1 1 8  6  7  o 18.274 0.4950 335.184  18.077  319.568   25.517  350.916   25.611  17.845 0.7150 18.703 0.6847 -0.8575077     0.9899433 
1 1 1 8  6  8  o 23.631 0.6107 571.377  27.337  593.781   34.012  530.495   45.946  24.320 0.6993 22.941 1.0014 1.379236       1.221359  
1 1 1 8  6  9  o 5.7332 0.7400 35.017   8.0698  49.964    11.472  20.375    11.354  7.0467 0.8140 4.4196 1.2361 2.627132       1.480067  
1 1 1 8  6  10 o 7.3985 0.6540 55.591   9.5993  51.321    14.150  59.232    13.065  7.1286 0.9925 7.6683 0.8519 -0.5396552     1.307974  
1 1 1 8  6  11 o 11.940 0.7097 149.460  15.422  157.698   18.637  131.566   27.467  12.514 0.7446 11.365 1.2084 1.148442       1.419394  
1 1 1 8  6  12 o 25.602 0.5147 661.504  26.331  702.471   37.773  622.776   36.726  26.377 0.7160 24.828 0.7396 1.549232       1.029417  
1 1 1 8  6  13 o 11.688 0.5589 138.452  13.053  145.917   18.855  131.581   18.089  11.991 0.7862 11.385 0.7945 0.6060009      1.117745  
1 1 1 8  6  14 o 15.365 0.5297 240.312  16.272  245.001   23.419  235.935   22.625  15.508 0.7551 15.223 0.7431 0.2852564      1.059426  
1 1 1 8  6  15 o 5.2561 0.8017 29.657   8.1081  32.049    12.487  27.914    10.662  5.4264 1.1838 5.0859 1.0814 0.3405128      1.603434  
1 1 1 8  6  16 o 3.5755 0.8720 12.788   7.5496  10.581    11.972  14.245    9.7274  3.4688 1.2908 3.6822 1.1727 -0.2134016     1.743995  
1 1 1 8  6  17 o 4.7946 0.9756 24.729   9.0368  0.0000    0.0000  24.729    9.0368  ?      ?      4.7946 0.9756 ?              ?         
1 1 1 8  6  18 o 6.4411 1.0209 56.487   11.419  27.679    25.185  63.941    12.812  5.0272 1.8719 7.8551 0.8155 -2.827919      2.041834  
1 1 1 8  6  19 o 3.9598 1.0153 5.1348   6.8699  38.296    22.744  1.8054    7.2066  5.6284 1.7933 2.2912 0.9527 3.337170       2.030624  
1 1 1 8  6  20 o 7.9181 1.0293 74.915   11.027  65.886    28.562  76.496    11.953  7.2122 1.9384 8.6241 0.6930 -1.411914      2.058605  
1 1 1 8  6  21 o 9.9802 0.8070 106.779  15.868  104.193   24.400  108.674   20.890  9.8155 1.2429 10.145 1.0296 -0.3295279     1.613942  
1 1 1 8  6  22 o 3.8562 1.0587 2.3598   13.016  30.919    21.044  -15.3353  16.564  5.1284 1.7301 2.5841 1.2206 2.544274       2.117328  
1 1 1 8  6  23 o 7.8090 1.0778 69.179   16.058  72.039    24.795  67.112    21.076  7.8863 1.6260 7.7316 1.4151 0.1547861      2.155596  
1 1 1 8  6  24 o 4.1018 1.1668 11.838   14.374  19.683    23.224  6.9668    18.301  4.5595 1.7732 3.6442 1.5170 0.9152443      2.333567  
1 1 1 8  6  25 o 12.759 0.7767 172.375  19.684  178.365   29.806  167.741   26.215  12.916 1.1538 12.602 1.0401 0.3139906      1.553382  
1 1 1 8  6  26 o 7.4273 1.1754 70.004   17.651  45.155    26.745  89.181    23.495  5.9119 1.9494 8.9427 1.3136 -3.030887      2.350735  
1 1 1 8  6  27 o 5.2554 1.3312 35.609   17.664  38.313    26.547  33.460    23.662  5.3861 1.9351 5.1248 1.8285 0.2612362      2.662319  
1 1 1 8  6  28 o 6.7006 1.2806 61.497   18.956  100.261   29.331  33.694    24.841  8.5483 1.7737 4.8529 1.8476 3.695408       2.561233  
1 1 1 8  6  29 o 3.9868 1.1985 16.771   17.683  -0.0089   27.021  29.339    23.386  3.4813 1.6165 4.4922 1.7699 -1.010866      2.397001  
1 1 1 8  6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  7  0  o 56.205 0.9296 3180.72  104.357 3156.40   147.880 3204.84   147.286 55.988 1.3223 56.421 1.3068 -0.000000      0.000000  
1 1 1 8  7  1  o 15.213 0.5005 232.164  15.226  236.546   21.515  227.768   21.551  15.358 0.7005 15.069 0.7151 0.2885695      1.000991  
1 1 1 8  7  2  o 21.816 0.4929 477.286  21.502  484.987   30.411  469.588   30.407  21.992 0.6914 21.639 0.7026 0.3529224      0.9857344 
1 1 1 8  7  3  o 30.205 0.5145 915.146  31.078  913.722   44.013  916.563   43.890  30.182 0.7291 30.229 0.7260 -0.4727364E-01 1.028906  
1 1 1 8  7  4  o 65.925 0.7223 4373.90  95.242  4370.60   134.728 4377.19   134.656 65.900 1.0222 65.951 1.0209 -0.5024719E-01 1.444687  
1 1 1 8  7  5  o 12.598 0.5177 159.269  13.043  158.830   18.516  159.701   18.376  12.580 0.7359 12.615 0.7283 -0.3491497E-01 1.035401  
1 1 1 8  7  6  o 3.5918 0.8867 11.430   7.7423  10.266    10.095  13.094    12.066  3.4001 1.1963 3.7835 1.3092 -0.3834484     1.773426  
1 1 1 8  7  7  o 46.163 0.5956 2143.32  54.975  2087.70   77.448  2199.80   78.048  45.557 0.8500 46.769 0.8344 -1.212032      1.191113  
1 1 1 8  7  8  f 15.041 0.5091 227.246  15.311  234.528   21.865  220.239   21.448  15.278 0.7156 14.804 0.7244 0.4735994      1.018240  
1 1 1 8  7  9  o 14.640 0.5131 215.529  15.005  229.226   21.336  202.127   21.106  15.103 0.7064 14.178 0.7443 0.9246597      1.026133  
1 1 1 8  7  10 o 2.4687 0.7292 -3.3848  6.4628  7.5066    10.122  -10.8814  8.3974  3.1495 1.1839 1.7878 0.8516 1.361727       1.458407  
1 1 1 8  7  11 o 17.843 0.5124 321.310  18.285  323.366   26.009  319.301   25.711  17.899 0.7266 17.787 0.7228 0.1120071      1.024821  
1 1 1 8  7  12 o 14.920 0.5257 225.003  15.682  232.990   22.460  217.408   21.904  15.179 0.7398 14.661 0.7470 0.5179520      1.051371  
1 1 1 8  7  13 o 13.649 0.5368 189.842  14.646  196.538   20.772  183.221   20.655  13.892 0.7476 13.405 0.7704 0.4864006      1.073527  
1 1 1 8  7  14 o 10.573 0.5921 114.404  12.482  104.956   17.741  123.663   17.563  10.130 0.8757 11.017 0.7971 -0.8868742     1.184168  
1 1 1 8  7  15 o 3.9330 0.8912 15.852   7.9495  19.659    11.930  12.811    10.661  4.2711 1.2888 3.5948 1.2313 0.6762965      1.782497  
1 1 1 8  7  16 o 8.5077 0.6285 74.863   10.657  75.290    15.748  74.503    14.474  8.5184 0.9244 8.4971 0.8517 0.2135944E-01  1.256930  
1 1 1 8  7  17 o 10.649 0.6232 120.653  12.907  95.227    19.015  142.379   17.577  9.5272 0.9979 11.772 0.7466 -2.244289      1.246306  
1 1 1 8  7  18 o 10.169 0.6326 112.098  12.306  83.191    18.447  135.277   16.518  8.8656 1.0404 11.472 0.7200 -2.605864      1.265200  
1 1 1 8  7  19 o 5.4618 0.9692 42.557   9.3932  8.1029    27.017  47.294    10.018  4.1585 1.7914 6.7651 0.7404 -2.606565      1.938343  
1 1 1 8  7  20 o 12.029 0.7724 160.798  14.460  142.805   31.910  165.448   16.221  11.340 1.4070 12.719 0.6377 -1.379471      1.544785  
1 1 1 8  7  21 o 19.336 0.5712 398.206  20.184  357.214   35.757  417.375   24.452  18.439 0.9696 20.232 0.6043 -1.792641      1.142474  
1 1 1 8  7  22 o 12.227 0.7730 163.723  18.290  134.162   27.742  186.449   24.325  11.107 1.2488 13.347 0.9112 -2.240075      1.545917  
1 1 1 8  7  23 o 12.325 0.7906 164.281  18.979  148.553   29.448  175.457   24.822  11.713 1.2571 12.938 0.9593 -1.224874      1.581298  
1 1 1 8  7  24 o 8.7727 1.0508 90.094   17.284  69.783    26.139  105.874   23.040  7.6177 1.7522 9.9277 1.1604 -2.310008      2.101575  
1 1 1 8  7  25 f 10.223 0.9308 114.610  18.729  118.333   29.296  112.037   24.355  10.281 1.4247 10.164 1.1981 0.1172123      1.861512  
1 1 1 8  7  26 o 5.8445 1.2777 42.702   16.149  46.448    26.030  40.358    20.590  5.9798 1.9198 5.7092 1.6865 0.2705221      2.555371  
1 1 1 8  7  27 o 6.5680 1.3366 57.267   18.324  68.619    28.598  49.359    23.868  7.0575 1.9575 6.0785 1.8205 0.9789381      2.673203  
1 1 1 8  7  28 o 8.1528 1.2456 88.714   19.437  103.060   30.769  79.187    25.074  8.5978 1.8446 7.7079 1.6744 0.8898592      2.491220  
1 1 1 8  7  29 f 2.5916 0.9132 -40.0746 17.189  -20.0899  27.682  -52.6164  21.929  3.0125 1.4626 2.1707 1.0937 0.8418348      1.826365  
1 1 1 8  7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  8  0  o 9.9605 0.8608 105.112  16.077  87.931    22.977  121.590   22.502  9.0649 1.3570 10.856 1.0596 -0.000000      0.000000  
1 1 1 8  8  1  o 12.921 0.5157 167.595  13.318  174.763   18.823  160.409   18.846  13.198 0.7131 12.643 0.7453 0.5555201      1.031495  
1 1 1 8  8  2  f 19.645 0.4931 387.173  19.372  385.920   27.361  388.433   27.432  19.613 0.6975 19.677 0.6971 -0.6379509E-01 0.9861009 
1 1 1 8  8  3  o 11.382 0.5320 130.354  12.082  123.453   17.368  136.826   16.819  11.088 0.7832 11.677 0.7202 -0.5888443     1.064000  
1 1 1 8  8  4  o 18.402 0.6046 343.809  21.052  351.327   26.032  329.601   35.786  18.712 0.6956 18.093 0.9890 0.6191006      1.209100  
1 1 1 8  8  5  o 27.667 0.5094 768.527  28.186  778.848   39.914  758.261   39.808  27.853 0.7165 27.481 0.7243 0.3717384      1.018808  
1 1 1 8  8  6  o 22.940 0.5003 528.512  22.953  533.749   32.571  523.346   32.350  23.053 0.7064 22.827 0.7086 0.2260761      1.000571  
1 1 1 8  8  7  o 33.472 0.5323 1126.51  35.633  1116.30   50.458  1136.67   50.329  33.319 0.7572 33.624 0.7484 -0.3047867     1.064635  
1 1 1 8  8  8  o 8.6146 0.5973 74.568   10.260  83.110    14.876  66.817    14.170  9.0859 0.8186 8.1432 0.8700 0.9426517      1.194619  
1 1 1 8  8  9  o 9.9476 0.5882 99.782   11.696  103.766   16.567  95.824    16.514  10.147 0.8164 9.7481 0.8470 0.3989000      1.176412  
1 1 1 8  8  10 o 11.790 0.5692 140.700  13.349  159.617   19.102  122.645   18.662  12.572 0.7597 11.007 0.8477 1.564963       1.138328  
1 1 1 8  8  11 o 11.424 0.5800 132.233  13.249  133.155   18.949  131.352   18.531  11.462 0.8266 11.386 0.8138 0.7553387E-01  1.159967  
1 1 1 8  8  12 o 20.109 0.5172 410.850  20.798  417.781   29.566  404.061   29.263  20.277 0.7290 19.940 0.7338 0.3378048      1.034383  
1 1 1 8  8  13 o 8.7846 0.6479 78.810   11.344  88.522    16.509  70.124    15.613  9.3022 0.8874 8.2670 0.9443 1.035213       1.295807  
1 1 1 8  8  14 o 12.890 0.5715 170.346  14.733  172.741   20.969  168.012   20.703  12.979 0.8078 12.800 0.8087 0.1792736      1.143049  
1 1 1 8  8  15 o 6.8414 0.7272 48.915   9.9387  50.472    14.469  47.525    13.675  6.9402 1.0424 6.7427 1.0141 0.1974206      1.454303  
1 1 1 8  8  16 o 8.6696 0.6574 78.995   11.246  67.665    16.369  89.121    15.476  8.0417 1.0178 9.2975 0.8323 -1.255750      1.314728  
1 1 1 8  8  17 o 6.1870 0.8111 43.739   9.4781  30.409    14.296  54.195    12.661  5.1629 1.3640 7.2110 0.8779 -2.048119      1.622125  
1 1 1 8  8  18 o 14.324 0.5597 213.250  15.967  197.283   23.012  228.074   22.173  13.778 0.8351 14.871 0.7455 -1.093412      1.119466  
1 1 1 8  8  19 o 9.3125 0.6620 92.458   12.108  82.253    18.236  100.504   16.192  8.7946 1.0367 9.8303 0.8236 -1.035688      1.324051  
1 1 1 8  8  20 o 16.601 0.5657 285.303  18.726  278.199   27.344  291.577   25.697  16.382 0.8346 16.820 0.7639 -0.4375134     1.131395  
1 1 1 8  8  21 o 3.3872 1.0223 4.2080   11.785  -0.8832   20.903  6.5807    14.269  3.4608 1.5309 3.3135 1.3553 0.1472986      2.044659  
1 1 1 8  8  22 o 8.1479 1.0447 71.555   16.338  101.488   25.726  51.321    21.152  9.6604 1.3315 6.6354 1.6102 3.024947       2.089423  
1 1 1 8  8  23 o 7.1961 1.1225 62.585   16.005  43.321    24.771  76.389    20.970  5.9822 1.8670 8.4100 1.2467 -2.427806      2.244998  
1 1 1 8  8  24 o 11.766 0.8529 147.239  19.899  166.677   30.689  133.138   26.138  12.404 1.2370 11.128 1.1744 1.275687       1.705738  
1 1 1 8  8  25 o 6.9910 1.1540 64.040   17.089  31.726    27.130  85.292    22.002  5.1815 1.9402 8.8005 1.2500 -3.618921      2.308022  
1 1 1 8  8  26 o 10.582 0.9639 128.662  19.840  117.689   30.797  136.447   25.941  10.020 1.5367 11.144 1.1639 -1.123487      1.927747  
1 1 1 8  8  27 o 4.6170 1.2868 24.658   17.579  40.911    27.439  13.343    22.894  5.3000 1.9577 3.9341 1.6706 1.365901       2.573661  
1 1 1 8  8  28 f 4.2604 1.2493 14.767   17.588  46.361    29.479  -2.6951   21.916  5.3143 2.0153 3.2065 1.4772 2.107767       2.498673  
1 1 1 8  8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  8  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  9  0  o 8.5517 0.9695 79.305   15.023  67.475    21.070  91.536    21.425  7.7838 1.5192 9.3195 1.2049 -0.000000      0.000000  
1 1 1 8  9  1  o 15.977 0.5043 256.540  16.089  271.302   22.669  241.557   22.838  16.442 0.6893 15.511 0.7362 0.9313354      1.008555  
1 1 1 8  9  2  o 4.3803 0.9663 19.430   9.1783  20.596    11.366  17.246    15.560  4.4467 1.2344 4.3139 1.4871 0.1328406      1.932610  
1 1 1 8  9  3  o 26.268 0.5042 692.869  26.488  693.272   37.429  692.464   37.491  26.276 0.7122 26.260 0.7138 0.1555252E-01  1.008388  
1 1 1 8  9  4  o 7.0298 0.6661 49.801   9.3643  49.180    13.218  50.426    13.269  6.9856 0.9461 7.0740 0.9378 -0.8834648E-01 1.332146  
1 1 1 8  9  5  o 29.575 0.5181 879.117  30.638  907.050   43.492  851.598   43.168  30.043 0.7238 29.107 0.7415 0.9363613      1.036247  
1 1 1 8  9  6  o 34.935 0.5405 1227.39  37.756  1260.46   53.640  1194.91   53.153  35.403 0.7576 34.466 0.7711 0.9364586      1.080961  
1 1 1 8  9  7  o 22.949 0.5057 529.366  23.192  558.458   33.044  501.123   32.559  23.572 0.7009 22.325 0.7292 1.247427       1.011447  
1 1 1 8  9  8  f 9.8186 0.5969 97.256   11.720  99.004    16.703  95.562    16.449  9.9055 0.8431 9.7316 0.8451 0.1739254      1.193783  
1 1 1 8  9  9  o 23.522 0.5153 558.427  24.238  573.741   34.426  543.374   34.131  23.844 0.7219 23.200 0.7356 0.6436138      1.030636  
1 1 1 8  9  10 o 13.680 0.7097 180.606  17.826  166.421   21.003  217.147   33.709  12.816 0.8194 14.544 1.1589 -1.728271      1.419315  
1 1 1 8  9  11 o 11.305 0.5966 132.271  13.259  107.006   19.038  156.072   18.478  10.217 0.9317 12.394 0.7455 -2.176814      1.193222  
1 1 1 8  9  12 o 9.1209 0.6341 85.636   11.512  78.048    16.528  92.786    16.045  8.7136 0.9484 9.5282 0.8420 -0.8146439     1.268193  
1 1 1 8  9  13 o 5.0079 0.8924 27.385   9.0105  33.340    13.082  22.008    12.429  5.5244 1.2169 4.4915 1.3056 1.032856       1.784771  
1 1 1 8  9  14 o 17.103 0.5382 299.298  18.410  301.047   26.096  297.566   25.974  17.153 0.7607 17.053 0.7616 0.9988213E-01  1.076414  
1 1 1 8  9  15 o 9.9367 0.6231 101.893  12.371  108.010   17.901  96.300    17.116  10.224 0.8754 9.6496 0.8869 0.5742197      1.246164  
1 1 1 8  9  16 f 8.1374 0.6880 70.010   11.080  60.023    15.872  79.503    15.475  7.5340 1.0534 8.7409 0.8852 -1.206869      1.375941  
1 1 1 8  9  17 o 15.185 0.5542 238.265  16.815  233.390   24.140  242.860   23.436  15.022 0.8035 15.348 0.7635 -0.3264847     1.108382  
1 1 1 8  9  18 o 7.2696 0.7612 56.797   10.963  53.951    16.376  59.108    14.758  7.0663 1.1587 7.4729 0.9874 -0.4065719     1.522373  
1 1 1 8  9  19 o 6.6555 0.8095 48.587   10.390  44.044    15.450  52.340    14.040  6.2681 1.2758 7.0428 0.9967 -0.7746873     1.618983  
1 1 1 8  9  20 o 17.218 0.5678 306.474  19.535  312.690   28.324  300.835   26.978  17.376 0.8151 17.061 0.7907 0.3152523      1.135548  
1 1 1 8  9  21 o 6.2042 1.3126 42.060   14.233  39.255    15.524  56.848    35.644  5.8671 1.3509 6.5413 2.2510 -0.6741896     2.625214  
1 1 1 8  9  22 o 5.6354 1.2736 36.694   14.034  37.287    15.388  33.761    34.219  5.7351 1.3619 5.5356 2.1526 0.1995173      2.547184  
1 1 1 8  9  23 o 15.611 0.7360 264.937  22.214  218.292   33.908  300.009   29.402  14.240 1.1906 16.981 0.8658 -2.740577      1.472068  
1 1 1 8  9  24 o 5.3411 1.2975 32.035   16.485  41.618    26.378  25.894    21.116  5.8399 1.9365 4.8422 1.7273 0.9977460      2.594958  
1 1 1 8  9  25 o 8.8231 1.1383 94.987   18.838  79.200    29.641  105.683   24.399  7.8666 1.9044 9.7795 1.2474 -1.912958      2.276589  
1 1 1 8  9  26 o 3.5449 1.1246 -1.7910  16.226  8.8227    25.747  -8.7840   20.899  3.9917 1.7340 3.0981 1.4326 0.8936348      2.249255  
1 1 1 8  9  27 o 4.5179 1.2826 26.745   17.506  26.678    27.906  26.789    22.478  4.5324 1.8788 4.5034 1.7464 0.2907372E-01  2.565169  
1 1 1 8  9  28 o 5.2300 1.3751 43.429   18.729  56.108    30.568  35.808    23.699  5.6295 2.0685 4.8304 1.8124 0.7991061      2.750232  
1 1 1 8  9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  10 0  o 22.407 0.9996 507.365  44.595  0.0000    0.0000  507.365   44.595  22.407 0.9996 22.407 0.9996 -0.000000      0.000000  
1 1 1 8  10 1  o 24.581 0.5034 607.086  24.747  618.800   35.062  595.458   34.933  24.818 0.7064 24.344 0.7175 0.4743862      1.006858  
1 1 1 8  10 2  o 10.667 0.5736 114.903  12.175  102.105   17.262  127.573   17.176  10.069 0.8571 11.264 0.7624 -1.194186      1.147171  
1 1 1 8  10 3  o 11.469 0.5656 132.274  12.913  150.252   18.611  115.589   17.930  12.223 0.7613 10.715 0.8367 1.508537       1.131216  
1 1 1 8  10 4  o 23.174 0.5056 539.771  23.431  538.973   33.405  540.542   32.874  23.156 0.7213 23.192 0.7087 -0.3573990E-01 1.011229  
1 1 1 8  10 5  o 11.153 0.5692 125.793  12.637  114.061   18.122  136.897   17.630  10.641 0.8516 11.666 0.7556 -1.025735      1.138450  
1 1 1 8  10 6  o 13.674 0.5387 188.205  14.733  189.755   20.888  186.671   20.785  13.730 0.7607 13.618 0.7631 0.1122952      1.077486  
1 1 1 8  10 7  o 12.821 0.5574 166.064  14.279  158.152   20.241  173.902   20.147  12.514 0.8087 13.129 0.7673 -0.6147413     1.114774  
1 1 1 8  10 8  o 2.0108 0.6595 -12.6398 6.8255  -1.1346   9.6172  -24.3171  9.6888  2.4503 1.0621 1.5713 0.7820 0.8790559      1.318930  
1 1 1 8  10 9  o 20.352 0.5211 419.192  21.181  445.003   29.927  393.289   29.980  20.988 0.7130 19.717 0.7603 1.270870       1.042284  
1 1 1 8  10 10 o 17.690 0.5250 317.941  18.572  326.761   26.516  309.448   26.021  17.932 0.7394 17.448 0.7457 0.4838963      1.050074  
1 1 1 8  10 11 o 13.255 0.5637 179.180  14.942  179.870   21.327  178.514   20.941  13.278 0.8031 13.232 0.7913 0.4631901E-01  1.127454  
1 1 1 8  10 12 o 10.711 0.6195 117.839  13.265  115.799   18.425  120.034   19.112  10.618 0.8677 10.805 0.8844 -0.1868248     1.238974  
1 1 1 8  10 13 o 9.6346 0.6426 95.825   12.370  92.498    17.669  99.022    17.322  9.4623 0.9337 9.8068 0.8832 -0.3445368     1.285201  
1 1 1 8  10 14 o 4.6847 0.9709 24.356   9.6997  25.954    13.625  22.713    13.812  4.8270 1.3556 4.5424 1.3903 0.2845440      1.941741  
1 1 1 8  10 15 o 20.696 0.5394 440.358  22.326  436.384   31.575  444.332   31.571  20.600 0.7664 20.792 0.7592 -0.1921024     1.078765  
1 1 1 8  10 16 o 11.062 0.6157 127.826  13.575  118.433   19.439  136.766   18.964  10.642 0.9134 11.482 0.8258 -0.8400221     1.231370  
1 1 1 8  10 17 o 2.3129 0.7269 -5.5771  7.3483  -17.0608  11.087  3.4190    9.8131  1.9172 0.9297 2.7086 1.1178 -0.7914450     1.453843  
1 1 1 8  10 18 o 3.4467 0.9308 9.2434   8.9715  15.828    13.942  4.5906    11.720  3.9195 1.4030 2.9738 1.2237 0.9457757      1.861698  
1 1 1 8  10 19 f 7.1244 0.8260 55.986   11.248  47.535    16.686  63.024    15.227  6.5049 1.3275 7.7440 0.9832 -1.239133      1.651932  
1 1 1 8  10 20 o 6.0568 0.8869 41.165   10.383  41.994    15.010  40.404    14.378  6.1088 1.2700 6.0047 1.2384 0.1040173      1.773808  
1 1 1 8  10 21 o 8.0703 1.0188 68.466   16.444  68.466    16.444  0.0000    0.0000  8.0703 1.0188 ?      ?      ?              ?         
1 1 1 8  10 22 o 4.5232 1.1751 22.207   13.221  27.387    14.230  -10.5098  35.763  4.9149 1.3871 4.1315 1.8972 0.7834125      2.350195  
1 1 1 8  10 23 o 7.3945 1.2260 78.607   16.679  89.261    18.601  34.897    37.677  9.1910 1.0119 5.5981 2.2335 3.592899       2.452042  
1 1 1 8  10 24 o 9.0394 1.2709 78.122   17.507  66.523    19.040  141.569   44.531  7.7934 1.2216 10.285 2.2291 -2.492150      2.541857  
1 1 1 8  10 25 o 10.591 1.0841 140.663  20.042  95.749    32.149  169.213   25.631  8.6300 1.9129 12.553 1.0210 -3.922545      2.168299  
1 1 1 8  10 26 o 13.941 0.8392 219.756  23.136  211.357   34.846  226.377   30.940  13.568 1.2841 14.314 1.0808 -0.7456732     1.678412  
1 1 1 8  10 27 f 3.7721 1.1897 4.6331   17.419  23.564    29.530  -5.4701   21.572  4.4144 1.8865 3.1299 1.4502 1.284494       2.379449  
1 1 1 8  10 28 o 6.8119 1.4122 77.317   20.308  87.816    31.241  69.634    26.725  7.1102 2.0709 6.5136 1.9206 0.5966053      2.824352  
1 1 1 8  10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  11 0  o 9.9256 0.9197 104.090  17.371  109.148   25.133  99.464    24.036  10.170 1.2925 9.6808 1.3088 -0.000000      0.000000  
1 1 1 8  11 1  o 11.954 0.5625 143.798  13.445  147.674   19.168  140.044   18.865  12.113 0.7912 11.795 0.7997 0.3179188      1.124925  
1 1 1 8  11 2  o 7.7735 0.9407 63.777   12.760  59.919    23.750  65.343    15.129  7.5004 1.6298 8.0467 0.9401 -0.5462608     1.881477  
1 1 1 8  11 3  o 8.1980 0.6821 68.486   11.063  57.868    15.807  78.680    15.489  7.5625 1.0451 8.8334 0.8767 -1.270946      1.364149  
1 1 1 8  11 4  o 35.054 0.5448 1237.69  38.186  1202.52   53.854  1273.26   54.154  34.550 0.7794 35.558 0.7615 -1.007687      1.089638  
1 1 1 8  11 5  o 2.9115 0.8577 2.0979   8.2858  2.6964    11.599  1.4741    11.841  2.9366 1.2138 2.8864 1.2122 0.5020356E-01  1.715458  
1 1 1 8  11 6  o 10.806 0.6049 118.274  13.069  114.377   18.374  122.264   18.591  10.624 0.8648 10.987 0.8460 -0.3633251     1.209786  
1 1 1 8  11 7  o 17.980 0.5216 326.702  18.742  310.017   26.356  343.771   26.657  17.511 0.7526 18.448 0.7225 -0.9365463     1.043240  
1 1 1 8  11 8  o 7.6204 0.7214 59.667   10.843  72.455    15.598  47.710    15.083  8.4292 0.9252 6.8116 1.1072 1.617600       1.442872  
1 1 1 8  11 9  o 3.9420 0.9349 15.597   8.9119  10.260    13.196  20.072    12.084  3.5567 1.3484 4.3273 1.2952 -0.7705700     1.869726  
1 1 1 8  11 10 o 10.091 0.6398 104.256  12.873  115.302   18.476  93.834    17.946  10.619 0.8699 9.5627 0.9383 1.056609       1.279553  
1 1 1 8  11 11 o 6.9354 0.8149 51.496   10.880  61.684    15.459  41.495    15.316  7.7132 1.0021 6.1577 1.2852 1.555518       1.629709  
1 1 1 8  11 12 o 10.920 0.6196 122.786  13.516  119.956   19.437  125.436   18.808  10.789 0.9008 11.050 0.8510 -0.2613001     1.239205  
1 1 1 8  11 13 o 10.619 0.6355 116.852  13.490  113.246   19.170  120.389   18.986  10.449 0.9173 10.789 0.8799 -0.3399448     1.271032  
1 1 1 8  11 14 o 17.052 0.5488 298.813  18.713  294.352   26.243  303.428   26.691  16.923 0.7754 17.181 0.7768 -0.2580833     1.097544  
1 1 1 8  11 15 o 8.2422 0.6865 71.527   11.305  69.232    16.180  73.717    15.801  8.1011 0.9986 8.3833 0.9424 -0.2821579     1.373093  
1 1 1 8  11 16 o 3.6303 0.8292 10.905   8.2510  -3.7325   11.716  25.307    11.622  2.5104 1.1260 4.7502 1.2176 -2.239858      1.658416  
1 1 1 8  11 17 o 12.114 0.6056 153.042  14.667  154.775   21.072  151.413   20.428  12.176 0.8653 12.053 0.8474 0.1225939      1.211148  
1 1 1 8  11 18 o 4.6858 0.9747 24.260   9.8914  31.567    14.640  18.122    13.417  5.2629 1.3755 4.1088 1.3815 1.154112       1.949492  
1 1 1 8  11 19 o 10.786 0.6408 121.427  13.813  127.594   19.869  115.658   19.217  11.054 0.8987 10.517 0.9136 0.5371733      1.281531  
1 1 1 8  11 20 o 4.8081 0.9713 26.298   9.7891  26.602    14.404  26.037    13.345  4.8273 1.4062 4.7889 1.3404 0.3844166E-01  1.942651  
1 1 1 8  11 21 o 7.0225 1.2517 62.381   15.404  65.556    17.010  47.901    36.324  7.8599 1.0821 6.1850 2.2576 1.674934       2.503482  
1 1 1 8  11 22 o 7.1966 1.2430 46.758   14.820  35.462    16.376  97.900    34.843  5.5428 1.4577 8.8504 2.0138 -3.307610      2.486029  
1 1 1 8  11 23 o 7.5660 1.3280 71.773   16.349  73.400    17.759  62.736    41.864  8.3180 1.0675 6.8140 2.4320 1.504022       2.655964  
1 1 1 8  11 24 o 11.831 1.1433 161.230  20.333  159.292   22.682  169.162   45.884  12.274 0.9240 11.388 2.0917 0.8861160      2.286665  
1 1 1 8  11 25 o 4.5813 1.2890 23.547   16.356  28.303    17.584  -6.9881   44.557  4.8168 1.5803 4.3457 2.0368 0.4711599      2.577948  
1 1 1 8  11 26 o 4.3562 1.3325 18.329   15.930  15.643    17.078  36.327    44.201  3.7919 1.5066 4.9205 2.1983 -1.128552      2.665043  
1 1 1 8  11 27 o 7.7135 1.2657 89.515   19.755  69.412    31.047  103.192   25.609  6.3640 2.1005 9.0630 1.4128 -2.698951      2.531407  
1 1 1 8  11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  11 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  12 0  o 1.9939 0.9595 -16.6961 11.725  -32.6442  15.647  3.7260    17.706  1.3952 1.0129 2.5926 1.6298 -0.000000      0.000000  
1 1 1 8  12 1  o 27.105 0.5183 740.854  28.094  747.205   39.640  734.445   39.822  27.223 0.7281 26.987 0.7378 0.2364025      1.036538  
1 1 1 8  12 2  o 15.485 0.5357 241.812  16.581  253.143   23.811  231.143   23.104  15.838 0.7517 15.132 0.7634 0.7060223      1.071396  
1 1 1 8  12 3  o 12.627 0.5764 161.387  14.550  157.113   20.715  165.550   20.441  12.459 0.8313 12.795 0.7988 -0.3360529     1.152888  
1 1 1 8  12 4  f 8.2453 0.9512 69.795   13.692  75.039    26.148  67.814    16.071  8.3302 1.6278 8.1604 0.9847 0.1697855      1.902485  
1 1 1 8  12 5  o 15.524 0.5477 243.571  16.926  212.857   23.477  276.815   24.425  14.498 0.8097 16.550 0.7379 -2.052838      1.095468  
1 1 1 8  12 6  o 12.086 0.5857 148.392  14.143  154.184   19.858  142.430   20.146  12.330 0.8053 11.841 0.8507 0.4888468      1.171350  
1 1 1 8  12 7  o 21.625 0.5229 475.022  22.614  480.360   31.946  469.662   32.016  21.749 0.7344 21.500 0.7445 0.2481117      1.045817  
1 1 1 8  12 8  f 17.051 0.5408 297.105  18.397  314.384   25.714  278.984   26.332  17.574 0.7316 16.528 0.7966 1.045935       1.081553  
1 1 1 8  12 9  o 13.719 0.7632 190.678  18.590  186.222   21.673  203.077   36.158  13.522 0.8014 13.916 1.2991 -0.3943014     1.526451  
1 1 1 8  12 10 o 7.9002 0.7177 65.838   11.131  53.056    16.001  77.824    15.494  7.1116 1.1250 8.6889 0.8916 -1.577269      1.435461  
1 1 1 8  12 11 o 10.259 0.6397 109.908  12.914  129.385   18.043  89.451    18.491  11.236 0.8029 9.2822 0.9960 1.953962       1.279332  
1 1 1 8  12 12 o 7.5527 0.7646 59.819   11.531  64.634    16.766  55.497    15.885  7.8446 1.0686 7.2607 1.0939 0.5839005      1.529211  
1 1 1 8  12 13 o 11.735 0.6220 142.222  14.567  155.844   21.149  129.925   20.093  12.277 0.8613 11.194 0.8975 1.083074       1.243966  
1 1 1 8  12 14 o 7.0438 0.8458 54.081   11.654  50.754    16.315  57.547    16.653  6.7559 1.2536 7.3317 1.1357 -0.5758500     1.691530  
1 1 1 8  12 15 o 2.5116 0.7954 -3.7742  8.2831  -7.3896   12.462  -0.9131   11.086  2.4354 1.1189 2.5879 1.1308 -0.1524887     1.590802  
1 1 1 8  12 16 o 13.133 0.6087 180.077  15.987  183.151   22.576  176.986   22.641  13.251 0.8519 13.015 0.8698 0.2363682      1.217465  
1 1 1 8  12 17 o 8.6262 0.7547 79.846   12.613  57.344    17.539  103.944   18.151  7.2845 1.2039 9.9680 0.9104 -2.683473      1.509376  
1 1 1 8  12 18 o 12.115 0.6134 152.728  14.856  148.886   21.094  156.510   20.927  11.956 0.8821 12.275 0.8525 -0.3185015     1.226723  
1 1 1 8  12 19 o 12.761 0.6195 170.156  15.808  164.727   22.196  175.745   22.520  12.550 0.8843 12.973 0.8679 -0.4233685     1.239085  
1 1 1 8  12 20 o 8.5677 1.2028 107.640  16.501  123.660   18.564  47.337    36.016  10.929 0.8493 6.2067 2.2506 4.722132       2.405563  
1 1 1 8  12 21 o 5.9144 1.3136 31.906   13.625  25.828    14.840  64.540    34.387  4.7767 1.4366 7.0522 2.1995 -2.275421      2.627120  
1 1 1 8  12 22 o 14.556 0.9051 235.011  21.080  238.705   23.799  221.559   45.414  15.199 0.7829 13.913 1.6320 1.286138       1.810110  
1 1 1 8  12 23 o 4.6568 1.3163 3.6170   14.459  -6.0961   15.673  59.129    37.468  2.8028 1.2752 6.5107 2.3032 -3.707947      2.632651  
1 1 1 8  12 24 o 9.6370 1.2871 118.662  18.682  121.078   20.807  108.612   42.439  10.649 0.9770 8.6255 2.3817 2.023041       2.574270  
1 1 1 8  12 25 o 11.048 1.3672 177.688  21.032  188.299   23.322  131.464   48.676  13.276 0.8783 8.8199 2.5895 4.456257       2.734425  
1 1 1 8  12 26 o 3.5670 1.1784 2.1018   14.523  2.4203    15.446  -0.3260   42.649  3.0206 1.3269 4.1135 1.9478 -1.092952      2.356792  
1 1 1 8  12 27 o 5.2399 1.4932 32.427   17.437  20.633    18.744  108.201   47.512  3.9604 1.5769 6.5195 2.5361 -2.559073      2.986317  
1 1 1 8  12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  13 0  o 2.4817 1.1343 -2.9377  13.384  8.6141    20.084  -12.1677  17.952  2.9617 1.8039 2.0018 1.3758 -0.000000      0.000000  
1 1 1 8  13 1  o 16.124 0.5498 262.991  17.723  253.350   24.811  273.034   25.324  15.821 0.7841 16.427 0.7708 -0.6064577     1.099529  
1 1 1 8  13 2  o 4.1265 0.9010 13.996   9.9975  -5.3714   14.452  31.771    13.845  2.8118 1.2566 5.4411 1.2916 -2.629265      1.801993  
1 1 1 8  13 3  o 4.7590 1.0190 23.918   10.563  26.351    14.985  21.516    14.892  4.9611 1.4311 4.5569 1.4510 0.4041901      2.038022  
1 1 1 8  13 4  o 18.519 0.5262 347.886  19.481  333.956   27.484  361.950   27.617  18.142 0.7575 18.897 0.7307 -0.7545547     1.052490  
1 1 1 8  13 5  o 7.8863 0.8101 67.496   11.937  85.239    16.531  48.162    17.256  9.1185 0.9065 6.6542 1.3429 2.464296       1.620229  
1 1 1 8  13 6  o 3.5004 0.8807 6.4921   9.3271  22.276    13.017  -10.1636  13.371  4.5365 1.3412 2.4643 1.1418 2.072150       1.761338  
1 1 1 8  13 7  o 3.3856 0.9283 7.0791   9.2113  13.643    13.517  1.3879    12.586  3.8409 1.3807 2.9302 1.2412 0.9106474      1.856618  
1 1 1 8  13 8  o 10.794 0.8258 116.182  16.038  109.167   18.712  135.604   31.135  10.304 0.9080 11.283 1.3797 -0.9793968     1.651643  
1 1 1 8  13 9  o 16.681 0.5534 284.589  18.452  282.403   25.626  286.943   26.590  16.620 0.7709 16.742 0.7941 -0.1219387     1.106769  
1 1 1 8  13 10 o 10.858 0.6281 121.731  13.618  131.081   19.500  112.829   19.026  11.274 0.8648 10.442 0.9110 0.8316936      1.256141  
1 1 1 8  13 11 o 9.8801 0.6577 101.377  12.984  98.597    18.593  104.023   18.138  9.7382 0.9547 10.022 0.9049 -0.2837763     1.315392  
1 1 1 8  13 12 o 5.6279 0.8585 36.022   10.812  7.1975    15.537  63.088    15.056  3.4814 1.4180 7.7744 0.9683 -4.293009      1.717087  
1 1 1 8  13 13 o 3.2953 0.8782 2.2260   9.5165  21.002    13.751  -15.0337  13.184  4.3507 1.3952 2.2400 1.0670 2.110767       1.756463  
1 1 1 8  13 14 o 4.9541 1.0035 27.984   10.696  20.807    15.233  34.963    15.022  4.3660 1.4720 5.5421 1.3644 -1.176097      2.007018  
1 1 1 8  13 15 o 12.775 0.6123 170.546  15.643  171.292   22.056  169.790   22.191  12.806 0.8611 12.744 0.8706 0.6226635E-01  1.224556  
1 1 1 8  13 16 o 3.1840 0.9221 5.1152   9.4595  9.9138    13.805  0.8679    12.988  3.4918 1.3646 2.8762 1.2405 0.6155443      1.844163  
1 1 1 8  13 17 o 5.4720 1.0033 34.385   11.553  21.686    16.332  47.101    16.344  4.4595 1.5240 6.4845 1.3054 -2.025004      2.006681  
1 1 1 8  13 18 o 6.4649 0.9359 47.051   11.896  38.116    16.772  56.097    16.876  5.7229 1.4605 7.2070 1.1708 -1.484108      1.871820  
1 1 1 8  13 19 o 12.833 0.6235 171.311  15.983  178.167   22.420  164.225   22.792  13.109 0.8551 12.558 0.9075 0.5514565      1.246913  
1 1 1 8  13 20 o 3.5342 1.0802 4.9576   12.370  10.561    13.364  -28.5365  32.675  3.5272 1.3523 3.5412 1.6849 -0.1400328E-01 2.160438  
1 1 1 8  13 21 o 7.7470 1.2651 70.129   16.026  69.082    17.775  74.675    37.042  8.0425 1.1051 7.4515 2.2761 0.5910110      2.530213  
1 1 1 8  13 22 o 4.3596 1.4880 20.865   15.568  20.865    15.568  0.0000    0.0000  4.3596 1.4880 ?      ?      ?              ?         
1 1 1 8  13 23 o 4.4448 1.3038 15.814   14.650  14.829    15.823  21.733    38.778  3.8920 1.4763 4.9976 2.1494 -1.105536      2.607607  
1 1 1 8  13 24 o 4.0712 1.2681 9.6816   14.327  9.2825    15.250  12.683    41.819  3.4650 1.4074 4.6775 2.1100 -1.212475      2.536291  
1 1 1 8  13 25 o 3.0706 1.0563 -7.6305  12.032  -7.2996   12.680  -10.6230  38.134  2.3670 1.1018 3.7742 1.8025 -1.407248      2.112594  
1 1 1 8  13 26 o 5.2133 1.3568 43.970   17.951  45.602    19.278  33.320    49.234  5.7285 1.6138 4.6982 2.1817 1.030290       2.713675  
1 1 1 8  13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  13 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  14 0  o 12.917 0.8694 176.172  21.509  141.247   30.021  213.005   30.831  11.496 1.3552 14.338 1.0896 -0.000000      0.000000  
1 1 1 8  14 1  o 9.3347 0.7092 89.791   13.223  84.477    18.205  95.726    19.238  9.0420 1.0067 9.6275 0.9991 -0.5855665     1.418357  
1 1 1 8  14 2  o 3.6184 0.9611 6.2006   10.195  -4.8494   13.314  21.865    15.852  2.6798 1.2012 4.5569 1.5007 -1.877099      1.922288  
1 1 1 8  14 3  o 7.9123 0.7813 65.543   12.272  69.757    16.763  60.676    18.015  8.2107 1.0208 7.6139 1.1830 0.5967832      1.562560  
1 1 1 8  14 4  o 25.421 0.5278 657.235  26.826  636.624   37.634  678.527   38.250  25.012 0.7523 25.829 0.7404 -0.8170509     1.055559  
1 1 1 8  14 5  o 5.5384 0.9847 33.591   11.026  26.425    15.516  40.902    15.671  4.9387 1.4652 6.1382 1.3161 -1.199405      1.969488  
1 1 1 8  14 6  o 9.4105 0.7015 91.663   13.175  98.735    18.673  84.653    18.591  9.7839 0.9543 9.0371 1.0286 0.7467909      1.403073  
1 1 1 8  14 7  o 8.9006 0.7217 82.377   12.783  93.262    18.378  72.174    17.793  9.4872 0.9686 8.3141 1.0701 1.173180       1.443305  
1 1 1 8  14 8  o 10.637 0.6624 117.385  14.028  106.915   20.081  127.363   19.605  10.152 0.9891 11.122 0.8814 -0.9697046     1.324794  
1 1 1 8  14 9  o 3.4607 0.9550 6.8501   10.185  -2.9736   14.365  16.778    14.441  2.8533 1.2653 4.0681 1.4309 -1.214744      1.910083  
1 1 1 8  14 10 o 8.0326 0.7975 68.600   12.700  74.457    17.433  61.976    18.540  8.4346 1.0334 7.6307 1.2149 0.8039336      1.594938  
1 1 1 8  14 11 o 14.125 0.5923 207.505  16.571  239.589   23.446  175.477   23.425  15.259 0.7682 12.990 0.9017 2.269092       1.184567  
1 1 1 8  14 12 o 6.2378 0.9389 43.938   11.352  45.122    16.236  42.806    15.879  6.3227 1.3263 6.1530 1.3292 0.1697488      1.877722  
1 1 1 8  14 13 o 6.5369 0.9158 47.629   11.500  50.062    17.236  45.677    15.438  6.6675 1.3391 6.4063 1.2497 0.2612171      1.831663  
1 1 1 8  14 14 o 10.798 0.6741 123.196  14.520  118.097   20.986  127.878   20.111  10.559 0.9937 11.037 0.9111 -0.4778881     1.348157  
1 1 1 8  14 15 o 7.6315 0.8245 62.926   12.570  60.117    17.847  65.691    17.707  7.4465 1.1984 7.8165 1.1327 -0.3699541     1.648947  
1 1 1 8  14 16 o 6.2563 0.9588 44.076   11.688  35.537    16.088  53.622    17.010  5.5640 1.4360 6.9486 1.2708 -1.384641      1.917559  
1 1 1 8  14 17 o 13.075 0.6449 178.830  16.729  150.701   23.142  209.616   24.210  11.962 0.9673 14.188 0.8532 -2.225514      1.289806  
1 1 1 8  14 18 o 6.1250 0.9609 42.298   11.827  30.349    16.650  54.468    16.804  5.1290 1.5170 7.1210 1.1799 -1.991982      1.921801  
1 1 1 8  14 19 o 4.6848 0.9496 23.929   10.166  37.185    14.467  11.001    14.287  5.7553 1.2889 3.6143 1.3949 2.141052       1.899232  
1 1 1 8  14 20 o 10.735 1.1372 138.136  17.880  142.613   19.997  120.284   39.927  11.715 0.8535 9.7545 2.1081 1.960353       2.274350  
1 1 1 8  14 21 o 6.0017 1.3579 34.396   14.632  28.576    15.982  64.551    36.378  4.9982 1.4880 7.0052 2.2718 -2.007028      2.715738  
1 1 1 8  14 22 o 4.8578 1.3786 15.039   14.853  9.1502    15.982  52.370    40.240  3.5564 1.4420 6.1592 2.3500 -2.602803      2.757175  
1 1 1 8  14 23 o 4.7864 1.2933 25.835   15.141  27.358    16.554  18.037    37.457  4.7863 1.5304 4.7864 2.0853 -0.1111031E-03 2.586638  
1 1 1 8  14 24 o 5.4579 1.3049 42.002   15.636  44.240    16.725  26.472    44.056  6.0100 1.4149 4.9059 2.1931 1.104095       2.609858  
1 1 1 8  14 25 f 4.1619 1.1125 21.846   15.161  33.146    16.305  -50.3685  41.216  5.0203 1.5049 3.3036 1.6389 1.716694       2.225002  
1 1 1 8  14 26 o 4.2277 1.1981 26.409   15.440  30.996    16.285  -14.3786  48.559  4.6870 1.5200 3.7684 1.8523 0.9185495      2.396100  
1 1 1 8  14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  15 0  o 7.2049 1.4511 67.136   18.239  75.515    24.516  56.750    27.295  8.0544 1.7343 6.3553 2.3270 -0.000000      0.000000  
1 1 1 8  15 1  o 10.546 0.6505 114.213  13.707  107.938   19.329  120.560   19.440  10.247 0.9431 10.844 0.8963 -0.5968046     1.301088  
1 1 1 8  15 2  o 2.5092 0.8248 -14.1101 10.113  -22.5068  13.632  -3.8319   15.082  2.1045 1.0228 2.9139 1.2941 -0.8094494     1.649541  
1 1 1 8  15 3  o 14.231 0.5872 207.649  16.709  212.352   23.690  202.993   23.570  14.394 0.8229 14.067 0.8378 0.3270016      1.174327  
1 1 1 8  15 4  o 6.6922 0.9276 48.863   12.131  40.636    17.186  57.032    17.126  6.0242 1.4450 7.3603 1.1634 -1.336060      1.855125  
1 1 1 8  15 5  o 15.204 0.5745 236.897  17.459  227.727   24.693  246.063   24.688  14.903 0.8285 15.506 0.7961 -0.6030722     1.148961  
1 1 1 8  15 6  f 15.247 0.5794 238.586  17.660  238.809   24.644  238.350   25.320  15.260 0.8075 15.234 0.8310 0.2590656E-01  1.158735  
1 1 1 8  15 7  o 8.8437 0.7437 82.211   13.125  87.099    18.422  77.171    18.704  9.1276 1.0091 8.5597 1.0926 0.5679178      1.487318  
1 1 1 8  15 8  o 6.9357 1.1310 44.339   14.341  29.218    16.621  88.396    28.372  5.0932 1.5178 8.7782 1.6772 -3.684927      2.262003  
1 1 1 8  15 9  o 12.241 0.6415 155.388  15.696  162.366   22.406  148.665   21.994  12.516 0.8951 11.965 0.9191 0.5511684      1.282917  
1 1 1 8  15 10 o 3.5545 0.9451 8.7376   10.038  -3.2817   14.421  20.035    13.981  2.8264 1.2597 4.2825 1.4094 -1.456170      1.890293  
1 1 1 8  15 11 o 15.704 0.7692 257.805  21.892  274.221   41.018  251.267   25.887  15.849 1.2940 15.559 0.8319 0.2895231      1.538365  
1 1 1 8  15 12 o 7.1429 0.8955 56.367   12.381  67.902    17.837  45.643    17.198  7.9663 1.1196 6.3194 1.3978 1.646855       1.790900  
1 1 1 8  15 13 o 12.296 0.6449 158.885  15.831  153.449   22.816  163.930   21.984  12.072 0.9450 12.521 0.8779 -0.4486828     1.289863  
1 1 1 8  15 14 o 6.4144 0.9394 47.255   11.813  35.290    17.277  57.759    16.188  5.4838 1.5217 7.3450 1.1020 -1.861153      1.878761  
1 1 1 8  15 15 o 5.4209 1.0422 33.788   11.718  40.201    16.748  27.637    16.401  5.9237 1.4299 4.9182 1.5166 1.005545       2.084385  
1 1 1 8  15 16 o 8.6692 0.7740 80.399   13.279  66.952    18.554  94.521    19.014  7.8812 1.1771 9.4572 1.0052 -1.575997      1.547923  
1 1 1 8  15 17 o 2.6174 0.8384 -8.9446  9.6752  2.2981    14.606  -17.7346  12.915  3.1087 1.3276 2.1261 1.0241 0.9826214      1.676703  
1 1 1 8  15 18 o 5.3574 1.0526 33.030   11.690  34.702    16.651  31.404    16.416  5.4889 1.4821 5.2258 1.4951 0.2631121      2.105179  
1 1 1 8  15 19 o 17.318 0.7917 317.254  22.928  315.371   26.123  323.572   47.850  17.505 0.7462 17.132 1.3965 0.3724670      1.583342  
1 1 1 8  15 20 f 4.3455 1.2692 11.553   14.239  8.8034    15.679  24.487    34.009  3.5618 1.4339 5.1291 2.0945 -1.567298      2.538310  
1 1 1 8  15 21 o 4.3259 1.2847 0.5292   14.109  -7.4455   15.288  46.340    36.642  2.7141 1.2442 5.9378 2.2480 -3.223642      2.569338  
1 1 1 8  15 22 o 8.4026 1.2892 69.841   17.043  57.909    18.696  128.502   41.454  7.0762 1.3706 9.7291 2.1840 -2.652856      2.578420  
1 1 1 8  15 23 o 3.2564 1.0527 -1.0736  13.422  5.8840    14.420  -46.1757  36.714  3.2049 1.3414 3.3080 1.6228 -0.1030693     2.105439  
1 1 1 8  15 24 f 3.9347 1.2031 14.238   15.931  20.000    16.943  -29.7094  46.790  4.0743 1.5318 3.7951 1.8556 0.2792513      2.406109  
1 1 1 8  15 25 f 6.0740 1.5253 51.477   18.463  41.001    20.127  107.118   46.385  5.3042 1.6866 6.8438 2.5420 -1.539621      3.050615  
1 1 1 8  15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  15 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  16 0  o 28.058 0.7712 808.404  43.076  759.109   60.487  859.133   61.359  27.168 1.1175 28.948 1.0631 -0.000000      0.000000  
1 1 1 8  16 1  o 4.9600 1.0691 26.932   11.750  33.361    16.767  20.728    16.470  5.4543 1.4933 4.4658 1.5305 0.9884801      2.138286  
1 1 1 8  16 2  o 5.2295 0.9016 25.770   11.934  57.168    17.363  -2.3508   16.431  7.3624 1.1791 3.0966 1.3642 4.265882       1.803135  
1 1 1 8  16 3  o 6.2968 1.0137 44.421   12.463  42.383    17.086  46.739    18.220  6.1461 1.4187 6.4475 1.4483 -0.3014097     2.027415  
1 1 1 8  16 4  f 3.8782 0.9669 10.634   10.758  27.333    15.404  -5.2681   15.032  4.9359 1.4589 2.8205 1.2693 2.115399       1.933789  
1 1 1 8  16 5  o 6.2381 1.0206 43.960   12.480  42.470    17.919  45.365    17.393  6.1175 1.4805 6.3587 1.4051 -0.2412601     2.041109  
1 1 1 8  16 6  o 9.2687 0.7516 90.185   13.924  87.470    19.805  92.840    19.581  9.1212 1.0857 9.4161 1.0397 -0.2948599     1.503237  
1 1 1 8  16 7  o 9.8044 0.7228 100.739  14.167  103.632   19.965  97.806    20.105  9.9546 1.0028 9.6542 1.0412 0.3003616      1.445627  
1 1 1 8  16 8  o 5.8610 1.0241 39.360   11.938  40.741    16.991  38.013    16.776  5.9671 1.4402 5.7549 1.4563 0.2121696      2.048174  
1 1 1 8  16 9  o 3.5299 0.9981 8.6732   10.711  12.373    15.618  5.3874    14.718  3.7730 1.4578 3.2868 1.3636 0.4861779      1.996176  
1 1 1 8  16 10 o 13.687 0.6191 195.070  16.912  209.894   24.024  180.507   23.812  14.221 0.8447 13.152 0.9052 1.068660       1.238111  
1 1 1 8  16 11 o 7.6214 0.8407 63.070   12.815  63.338    18.096  62.799    18.150  7.6401 1.1843 7.6028 1.1936 0.3725147E-01  1.681450  
1 1 1 8  16 12 o 4.8202 1.0829 26.858   11.736  25.185    17.609  28.195    15.741  4.7062 1.5826 4.9341 1.4786 -0.2279477     2.165841  
1 1 1 8  16 13 o 4.4334 1.1955 19.625   13.767  13.373    27.872  21.643    15.834  4.4370 1.8614 4.4298 1.5007 0.7201672E-02  2.391018  
1 1 1 8  16 14 o 7.8769 0.8391 66.783   13.175  68.586    18.100  64.750    19.215  8.0161 1.1290 7.7377 1.2416 0.2783689      1.678174  
1 1 1 8  16 15 f 6.2398 1.0283 45.042   12.669  37.420    17.758  52.943    18.080  5.6499 1.5327 6.8297 1.3713 -1.179818      2.056589  
1 1 1 8  16 16 o 4.7583 1.0320 24.342   11.965  40.217    16.868  8.2635    16.976  5.9056 1.4409 3.6110 1.4778 2.294654       2.063976  
1 1 1 8  16 17 o 9.7963 0.7400 101.347  14.486  102.103   20.117  100.534   20.875  9.8464 1.0216 9.7462 1.0709 0.1002274      1.480030  
1 1 1 8  16 18 o 12.395 0.6809 161.259  16.842  156.725   24.400  165.385   23.276  12.206 0.9995 12.584 0.9248 -0.3774118     1.361739  
1 1 1 8  16 19 o 4.6021 1.3238 16.582   14.904  15.223    16.186  24.157    38.208  3.9880 1.4976 5.2163 2.1834 -1.228328      2.647604  
1 1 1 8  16 20 o 4.0646 1.2682 1.9826   15.630  -2.3429   17.249  21.831    36.950  3.1024 1.3806 5.0267 2.1278 -1.924314      2.536468  
1 1 1 8  16 21 o 12.127 1.0358 166.393  20.171  165.214   22.732  170.757   43.742  12.505 0.9089 11.748 1.8616 0.7566462      2.071665  
1 1 1 8  16 22 o 5.1704 1.3499 33.480   16.779  34.142    18.731  30.791    37.743  5.2217 1.6225 5.1191 2.1578 0.1026187      2.699756  
1 1 1 8  16 23 o 3.3935 1.1618 -7.7762  14.546  -9.4798   15.446  5.5793    43.247  2.5535 1.1976 4.2334 1.9913 -1.679836      2.323686  
1 1 1 8  16 24 o 7.8753 1.4705 90.850   19.695  85.157    21.432  121.752   49.931  8.4185 1.2729 7.3322 2.6513 1.086230       2.941079  
1 1 1 8  16 25 o 3.4585 1.0980 8.3553   15.377  16.252    16.288  -56.3826  46.634  3.6585 1.4654 3.2584 1.6355 0.4001195      2.196022  
1 1 1 8  16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  17 0  o 19.525 0.8049 395.501  31.180  385.345   43.591  406.142   44.618  19.265 1.1405 19.785 1.1361 -0.000000      0.000000  
1 1 1 8  17 1  o 5.1402 0.9424 25.492   12.013  -0.6175   16.409  55.651    17.635  3.1600 1.3784 7.1203 1.2857 -3.960356      1.884898  
1 1 1 8  17 2  o 4.0230 1.0309 10.353   12.453  29.499    17.502  -9.2788   17.722  5.1145 1.5650 2.9314 1.3422 2.183092       2.061708  
1 1 1 8  17 3  o 2.6669 0.8711 -10.1264 10.851  -9.7273   15.960  -10.4695  14.798  2.7411 1.2619 2.5928 1.2012 0.1482515      1.742236  
1 1 1 8  17 4  o 12.602 0.6480 164.839  16.320  156.599   22.830  173.450   23.339  12.273 0.9301 12.931 0.9024 -0.6578913     1.295911  
1 1 1 8  17 5  o 3.0937 0.9486 -0.9344  11.122  -8.0996   15.868  5.9866    15.595  2.7801 1.2719 3.4074 1.4078 -0.6273274     1.897282  
1 1 1 8  17 6  o 7.6087 0.9457 64.757   13.785  82.617    19.746  47.781    19.252  8.7997 1.1220 6.4178 1.5228 2.381877       1.891490  
1 1 1 8  17 7  o 5.2300 1.1241 31.960   12.800  31.346    18.496  32.525    17.732  5.1825 1.6126 5.2775 1.5665 -0.9500599E-01 2.248228  
1 1 1 8  17 8  o 5.7897 1.0611 39.316   12.603  30.420    18.360  47.243    17.331  5.1265 1.6085 6.4529 1.3843 -1.326410      2.122209  
1 1 1 8  17 9  o 7.4449 0.9166 61.484   13.274  70.274    19.088  53.254    18.471  8.0629 1.1837 6.8268 1.3998 1.236033       1.833205  
1 1 1 8  17 10 o 2.7176 0.8720 -8.9924  10.511  2.2649    15.707  -18.1224  14.146  3.1868 1.3692 2.2483 1.0801 0.9385474      1.743987  
1 1 1 8  17 11 o 6.4125 0.9782 47.001   12.692  68.006    18.346  27.719    17.577  7.9371 1.1557 4.8878 1.5785 3.049373       1.956353  
1 1 1 8  17 12 o 11.371 0.7007 136.461  15.779  159.665   22.553  114.212   22.083  12.364 0.9120 10.377 1.0640 1.986387       1.401399  
1 1 1 8  17 13 o 10.291 0.7420 112.484  15.134  130.221   21.551  95.229    21.256  11.137 0.9675 9.4455 1.1252 1.691889       1.483958  
1 1 1 8  17 14 o 9.8566 0.7916 104.895  15.459  117.646   21.556  91.394    22.181  10.533 1.0233 9.1808 1.2080 1.351722       1.583208  
1 1 1 8  17 15 o 12.414 0.6780 161.852  16.832  160.026   23.873  163.656   23.735  12.340 0.9673 12.489 0.9502 -0.1498375     1.355954  
1 1 1 8  17 16 o 6.7063 1.0208 50.912   13.625  37.914    19.083  64.429    19.460  5.6935 1.6061 7.7192 1.2605 -2.025746      2.041685  
1 1 1 8  17 17 o 8.9783 1.2216 78.072   18.004  64.584    20.116  132.364   40.358  7.5861 1.3765 10.371 2.0184 -2.784527      2.443149  
1 1 1 8  17 18 o 4.6866 1.0772 24.894   11.662  21.095    16.967  28.294    16.054  4.4175 1.5511 4.9556 1.4951 -0.5380940     2.154358  
1 1 1 8  17 19 o 3.5458 1.1349 -0.9760  15.189  6.0796    16.572  -38.0330  37.980  3.4519 1.4408 3.6397 1.7540 -0.1877649     2.269869  
1 1 1 8  17 20 o 4.6231 1.3282 18.347   16.369  15.275    18.429  29.829    35.631  4.0348 1.5767 5.2114 2.1378 -1.176639      2.656363  
1 1 1 8  17 21 o 4.4389 1.3221 16.844   16.005  16.715    17.354  17.576    41.403  4.0349 1.5424 4.8430 2.1478 -0.8080478     2.644258  
1 1 1 8  17 22 o 7.7039 1.3137 92.214   18.302  97.914    20.230  66.505    42.961  9.3532 1.0814 6.0546 2.3946 3.298601       2.627488  
1 1 1 8  17 23 o 4.7747 1.2909 32.747   16.411  35.623    17.743  15.706    43.185  5.1435 1.5760 4.4059 2.0450 0.7376466      2.581830  
1 1 1 8  17 24 o 3.9508 1.2524 16.330   16.782  16.088    18.103  17.807    44.754  3.7065 1.5225 4.1950 1.9889 -0.4884849     2.504805  
1 1 1 8  17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  17 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  18 0  o 2.7408 1.2671 -5.3148  18.001  -23.8309  25.371  13.453    25.544  2.1675 1.5224 3.3142 2.0259 -0.000000      0.000000  
1 1 1 8  18 1  f 6.3658 1.0685 47.058   13.431  51.552    18.867  42.439    19.126  6.7126 1.4479 6.0191 1.5717 0.6934867      2.136973  
1 1 1 8  18 2  o 9.6862 0.7838 98.832   15.044  82.244    20.204  119.478   22.540  8.7600 1.1532 10.612 1.0619 -1.852495      1.567655  
1 1 1 8  18 3  o 6.2375 1.0124 45.400   13.180  25.131    18.955  64.371    18.339  4.7448 1.6410 7.7303 1.1862 -2.985458      2.024806  
1 1 1 8  18 4  o 9.0069 0.8529 87.712   15.205  73.001    21.171  103.386   21.853  8.1747 1.2949 9.8390 1.1105 -1.664365      1.705884  
1 1 1 8  18 5  o 3.5263 1.0340 6.6398   11.969  7.9443    16.634  5.2394    17.235  3.5767 1.4632 3.4760 1.4613 0.1007147      2.067931  
1 1 1 8  18 6  o 5.7341 1.0835 38.312   12.643  38.414    18.588  38.224    17.246  5.7243 1.5744 5.7439 1.4889 -0.1968384E-01 2.166955  
1 1 1 8  18 7  f 6.9612 1.2640 58.357   16.551  56.720    19.580  62.454    30.976  7.0122 1.4442 6.9103 2.0749 0.1019659      2.528022  
1 1 1 8  18 8  o 3.3676 1.0100 2.7194   12.014  10.965    17.717  -4.2996   16.347  3.7877 1.5244 2.9476 1.3254 0.8400974      2.020033  
1 1 1 8  18 9  o 11.068 0.7398 131.181  16.185  109.443   22.878  152.958   22.899  10.085 1.1342 12.050 0.9501 -1.965195      1.479612  
1 1 1 8  18 10 o 2.4392 0.8096 -22.4186 11.110  -49.0499  16.580  -0.7195   14.966  1.8903 0.9523 2.9882 1.3096 -1.097958      1.619177  
1 1 1 8  18 11 o 3.8325 1.0566 11.111   12.034  19.206    17.207  3.3617    16.835  4.3094 1.5567 3.3556 1.4290 0.9537919      2.113150  
1 1 1 8  18 12 o 9.7930 0.7783 102.032  15.194  113.478   21.927  91.459    21.074  10.342 1.0600 9.2436 1.1399 1.098851       1.556641  
1 1 1 8  18 13 o 4.7103 1.1299 25.181   12.728  22.834    18.206  27.426    17.802  4.5503 1.6060 4.8703 1.5897 -0.3200402     2.259707  
1 1 1 8  18 14 o 7.7434 0.9710 66.538   14.606  55.958    20.215  78.096    21.128  6.9839 1.4925 8.5029 1.2424 -1.518998      1.941988  
1 1 1 8  18 15 o 10.361 0.7569 113.775  15.667  120.513   22.249  107.149   22.064  10.681 1.0415 10.041 1.0987 0.6397743      1.513893  
1 1 1 8  18 16 o 6.7023 1.0370 51.213   14.037  32.749    19.523  70.972    20.196  5.3014 1.6580 8.1032 1.2462 -2.801808      2.074088  
1 1 1 8  18 17 o 13.840 0.6928 202.480  18.967  238.368   27.085  167.946   26.569  15.105 0.8966 12.575 1.0564 2.530256       1.385597  
1 1 1 8  18 18 o 4.9964 1.4073 12.303   16.906  2.6934    18.579  58.593    40.777  3.4376 1.4831 6.5552 2.3921 -3.117640      2.814537  
1 1 1 8  18 19 f 7.8054 1.3787 76.662   18.108  75.916    19.927  80.197    43.384  8.3225 1.1972 7.2882 2.4840 1.034355       2.757410  
1 1 1 8  18 20 o 5.8732 1.4200 39.697   17.174  33.421    19.294  63.648    37.690  5.1995 1.6511 6.5468 2.3107 -1.347316      2.839964  
1 1 1 8  18 21 o 8.5439 1.3056 121.785  19.500  135.538   21.533  59.096    45.972  11.176 0.9633 5.9115 2.4270 5.264813       2.611221  
1 1 1 8  18 22 o 3.8185 1.2372 4.0574   16.346  0.6147    17.961  20.663    39.447  3.1209 1.3973 4.5161 2.0421 -1.395207      2.474445  
1 1 1 8  18 23 o 7.8479 1.3720 105.573  20.022  108.374   22.037  92.321    47.934  9.5779 1.1504 6.1179 2.4911 3.460022       2.743936  
1 1 1 8  18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 0  o 4.0811 1.5990 26.679   19.333  35.498    28.710  19.361    26.152  4.5495 2.3879 3.6127 2.1272 -0.000000      0.000000  
1 1 1 8  19 1  o 11.505 0.7346 140.144  16.902  137.311   23.902  142.977   23.903  11.382 1.0500 11.629 1.0278 -0.2462521     1.469262  
1 1 1 8  19 2  o 6.8835 1.0395 54.761   14.346  34.322    20.094  76.012    20.489  5.3882 1.6815 8.3789 1.2227 -2.990674      2.079032  
1 1 1 8  19 3  o 4.8618 1.1738 27.081   13.712  28.316    18.849  25.693    19.983  4.9445 1.6368 4.7791 1.6829 0.1654081      2.347672  
1 1 1 8  19 4  o 9.0272 0.8206 88.205   14.802  89.038    20.574  87.312    21.313  9.0880 1.1319 8.9663 1.1885 0.1216927      1.641293  
1 1 1 8  19 5  o 3.2204 0.9979 -0.1961  12.322  -3.3830   17.149  3.2050    17.716  3.0540 1.3665 3.3867 1.4546 -0.3326690     1.995821  
1 1 1 8  19 6  o 6.2821 1.0666 46.217   13.448  58.751    19.335  34.472    18.716  7.1744 1.3977 5.3898 1.6116 1.784579       2.133282  
1 1 1 8  19 7  o 5.4506 1.0877 34.251   13.094  50.007    18.963  19.892    18.102  6.5527 1.4817 4.3485 1.5927 2.204197       2.175352  
1 1 1 8  19 8  o 3.4197 1.0199 1.8825   12.639  -10.6764  18.257  13.438    17.513  2.9001 1.3403 3.9394 1.5377 -1.039361      2.039823  
1 1 1 8  19 9  o 4.5781 1.1328 22.169   13.260  13.044    19.193  30.501    18.340  4.0196 1.5971 5.1366 1.6070 -1.117042      2.265678  
1 1 1 8  19 10 o 11.792 0.7338 147.066  17.303  143.346   24.405  150.826   24.535  11.636 1.0487 11.949 1.0267 -0.3135347     1.467596  
1 1 1 8  19 11 o 10.537 0.7937 119.438  16.632  132.182   23.415  106.460   23.629  11.151 1.0499 9.9231 1.1906 1.227434       1.587418  
1 1 1 8  19 12 o 4.5622 1.1466 22.364   13.236  27.576    19.186  17.630    18.283  4.9017 1.6520 4.2228 1.5905 0.6788645      2.293164  
1 1 1 8  19 13 o 21.389 0.5894 473.075  25.202  474.242   35.155  471.842   36.149  21.428 0.8203 21.351 0.8465 0.7635689E-01  1.178788  
1 1 1 8  19 14 o 11.054 0.7595 129.766  16.762  134.627   23.364  124.611   24.061  11.290 1.0347 10.817 1.1122 0.4726830      1.519080  
1 1 1 8  19 15 o 4.5351 1.1611 21.599   13.638  25.217    19.075  17.815    19.506  4.7644 1.6463 4.3058 1.6377 0.4586797      2.322156  
1 1 1 8  19 16 o 6.1422 1.0564 42.324   14.549  70.394    21.121  16.978    20.070  8.0158 1.3174 4.2687 1.6517 3.747078       2.112738  
1 1 1 8  19 17 o 12.350 0.6900 161.264  17.026  167.815   23.955  154.577   24.204  12.622 0.9490 12.078 1.0020 0.5431404      1.380033  
1 1 1 8  19 18 o 5.0630 1.2097 31.852   18.564  49.826    20.585  -46.4358  42.961  6.4117 1.6081 3.7144 1.8077 2.697260       2.419480  
1 1 1 8  19 19 o 3.7653 1.2148 -1.9323  16.589  -4.4300   18.667  7.4531    36.184  3.0986 1.4026 4.4320 1.9839 -1.333392      2.429657  
1 1 1 8  19 20 o 9.0170 1.5951 116.581  27.518  105.434   33.705  138.867   47.655  8.7815 1.9678 9.2526 2.5111 -0.4710741     3.190288  
1 1 1 8  19 21 o 3.1168 1.0729 -18.0882 17.223  -16.3691  19.338  -24.6831  37.876  2.6834 1.2821 3.5502 1.7207 -0.8667855     2.145871  
1 1 1 8  19 22 o 3.7253 1.2342 4.7695   16.195  2.8423    17.319  18.191    45.704  3.1052 1.3825 4.3454 2.0449 -1.240187      2.468415  
1 1 1 8  19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  19 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 0  o 3.0598 1.3351 1.5606   17.857  -21.6791  24.973  25.879    25.545  2.1784 1.5258 3.9412 2.1912 -0.000000      0.000000  
1 1 1 8  20 1  o 6.7733 1.1699 55.228   15.777  61.301    21.987  48.782    22.652  7.2219 1.5673 6.3247 1.7374 0.8971739      2.339835  
1 1 1 8  20 2  o 8.5852 0.9742 84.302   15.630  56.418    21.926  113.110   22.286  6.8853 1.6194 10.285 1.0834 -3.399853      1.948380  
1 1 1 8  20 3  o 9.3843 0.8791 96.386   16.234  76.815    22.592  117.280   23.342  8.3199 1.3577 10.449 1.1170 -2.128682      1.758134  
1 1 1 8  20 4  o 10.007 0.8063 107.489  15.942  130.214   23.239  87.289    21.910  11.057 1.0508 8.9569 1.2231 2.100566       1.612513  
1 1 1 8  20 5  o 7.0167 1.0871 57.528   14.841  52.235    21.374  62.456    20.624  6.6417 1.6228 7.3917 1.4469 -0.7499833     2.174187  
1 1 1 8  20 6  o 5.4014 1.1290 33.606   13.712  20.531    19.360  46.767    19.423  4.4657 1.6454 6.3370 1.5462 -1.871337      2.257903  
1 1 1 8  20 7  o 5.0657 1.1051 29.322   13.218  14.911    19.484  41.612    17.992  4.1374 1.6200 5.9941 1.5035 -1.856755      2.210132  
1 1 1 8  20 8  o 7.9601 0.9640 70.780   14.853  59.814    20.960  81.841    21.050  7.2086 1.5025 8.7117 1.2082 -1.503089      1.928031  
1 1 1 8  20 9  o 4.8561 1.1791 26.368   14.192  18.033    20.238  34.432    19.906  4.3253 1.6627 5.3869 1.6724 -1.061616      2.358284  
1 1 1 8  20 10 o 4.3583 1.0919 13.585   13.919  38.654    20.448  -8.0612   19.001  5.6712 1.6819 3.0454 1.3927 2.625788       2.183720  
1 1 1 8  20 11 o 3.5201 1.0610 3.5199   13.250  -0.9980   18.901  7.8859    18.580  3.3272 1.4645 3.7130 1.5356 -0.3857837     2.122022  
1 1 1 8  20 12 o 10.392 0.8129 115.864  16.741  132.389   23.624  99.193    23.727  11.192 1.0553 9.5922 1.2368 1.600148       1.625864  
1 1 1 8  20 13 o 2.8684 0.9075 -18.1175 12.463  -47.9834  18.054  9.0720    17.226  2.0493 1.0271 3.6874 1.4964 -1.638168      1.814990  
1 1 1 8  20 14 o 5.2118 1.1727 31.016   14.196  41.876    20.403  20.825    19.765  5.9348 1.6560 4.4887 1.6609 1.446127       2.345417  
1 1 1 8  20 15 o 3.8420 1.1053 9.8339   13.433  5.6713    19.190  13.833    18.809  3.6408 1.5369 4.0432 1.5891 -0.4023507     2.210698  
1 1 1 8  20 16 o 6.4575 1.1835 50.893   15.523  43.923    22.348  57.390    21.578  5.9700 1.7551 6.9450 1.5880 -0.9749842     2.366904  
1 1 1 8  20 17 o 8.2187 1.3971 82.648   19.699  79.250    22.104  95.764    43.425  8.4267 1.3115 8.0108 2.4674 0.4158993      2.794290  
1 1 1 8  20 18 o 5.5800 1.4238 40.119   18.884  40.411    21.466  39.121    39.719  5.6465 1.7340 5.5134 2.2589 0.1330886      2.847693  
1 1 1 8  20 19 o 7.5913 1.3074 93.058   20.131  105.010   22.459  44.215    45.402  9.6865 1.1593 5.4962 2.3437 4.190385       2.614780  
1 1 1 8  20 20 o 7.9829 1.3956 100.492  20.232  103.486   22.391  87.174    47.228  9.4675 1.1825 6.4982 2.5283 2.969264       2.791155  
1 1 1 8  20 21 o 2.9045 1.0027 -19.9923 17.091  -9.1317   18.843  -70.3658  40.581  2.7972 1.3153 3.0118 1.5136 -0.2145531     2.005304  
1 1 1 8  20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  20 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  21 0  o 2.7535 1.2950 -3.7801  18.947  0.8257    28.516  -7.4203   25.352  2.9550 1.9363 2.5519 1.7202 -0.000000      0.000000  
1 1 1 8  21 1  o 14.644 0.6959 226.123  20.255  253.760   28.646  198.490   28.643  15.588 0.9189 13.701 1.0453 1.887038       1.391768  
1 1 1 8  21 2  o 15.479 0.6463 250.300  19.930  223.689   27.930  277.907   28.448  14.609 0.9559 16.348 0.8701 -1.738962      1.292563  
1 1 1 8  21 3  o 3.6150 1.0478 2.0296   13.211  -14.1409  18.162  20.199    19.251  2.7876 1.3046 4.4424 1.6401 -1.654798      2.095648  
1 1 1 8  21 4  o 9.9475 0.8511 106.463  16.848  120.486   24.268  93.415    23.409  10.614 1.1432 9.2809 1.2611 1.333322       1.702159  
1 1 1 8  21 5  o 4.8440 1.1705 24.405   14.704  8.9520    20.732  40.044    20.857  3.8906 1.6166 5.7974 1.6931 -1.906826      2.340936  
1 1 1 8  21 6  f 6.0457 1.3096 30.961   17.641  10.280    20.771  84.504    33.421  3.9465 1.6271 8.1450 2.0524 -4.198475      2.619167  
1 1 1 8  21 7  f 7.8020 1.0065 70.705   14.994  53.397    21.930  85.903    20.548  6.6760 1.6515 8.9280 1.1508 -2.252014      2.012905  
1 1 1 8  21 8  o 3.7272 1.1048 7.1000   13.957  10.832    19.351  3.0528    20.151  3.8856 1.5826 3.5688 1.5421 0.3168366      2.209676  
1 1 1 8  21 9  o 8.6472 0.9915 85.491   16.025  58.271    22.885  111.677   22.446  7.0378 1.6539 10.257 1.0942 -3.218814      1.983097  
1 1 1 8  21 10 o 19.398 0.6179 390.702  23.965  380.431   33.916  400.943   33.867  19.134 0.8863 19.663 0.8612 -0.5297737     1.235772  
1 1 1 8  21 11 o 7.5332 1.1005 66.889   16.574  97.779    23.545  36.548    23.334  9.5154 1.2372 5.5511 1.8204 3.964342       2.201031  
1 1 1 8  21 12 o 9.8560 0.8679 105.536  16.832  84.932    23.709  126.474   23.901  8.8053 1.3463 10.907 1.0957 -2.101385      1.735831  
1 1 1 8  21 13 o 4.9450 1.2223 26.710   15.416  15.933    21.580  37.940    22.029  4.2724 1.6948 5.6176 1.7619 -1.345190      2.444686  
1 1 1 8  21 14 o 5.4878 1.2081 34.559   15.477  20.090    21.695  49.554    22.086  4.5238 1.7257 6.4517 1.6911 -1.927895      2.416113  
1 1 1 8  21 15 o 8.9198 0.9934 89.661   17.716  87.104    24.980  92.248    25.131  8.7790 1.4227 9.0605 1.3868 -0.2815552     1.986786  
1 1 1 8  21 16 o 5.8396 1.1472 40.736   15.040  62.605    21.806  20.895    20.771  7.2415 1.5523 4.4376 1.6895 2.803923       2.294328  
1 1 1 8  21 17 o 4.5409 1.2689 -13.2785 17.343  -37.7801  19.807  67.241    35.906  2.3359 1.1547 6.7459 2.2600 -4.409988      2.537885  
1 1 1 8  21 18 o 5.5958 1.2668 48.192   19.921  63.350    22.122  -16.8281  45.817  7.0849 1.5991 4.1068 1.9653 2.978134       2.533673  
1 1 1 8  21 19 o 5.5155 1.3970 48.287   19.643  51.679    21.725  33.092    45.975  6.1314 1.7081 4.8996 2.2111 1.231824       2.794041  
1 1 1 8  21 20 o 4.7516 1.4237 29.108   20.177  19.825    22.969  60.480    42.226  4.0639 1.6962 5.4392 2.2870 -1.375229      2.847384  
1 1 1 8  21 21 o 4.0040 1.3166 13.426   19.436  8.4329    21.137  40.752    49.449  3.4344 1.5283 4.5736 2.1443 -1.139235      2.633182  
1 1 1 8  21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 0  o 3.2621 1.4211 10.129   18.962  -3.6029   27.529  22.525    26.155  2.7604 1.8396 3.7639 2.1666 -0.000000      0.000000  
1 1 1 8  22 1  o 6.3964 1.0910 46.107   15.489  77.177    22.846  19.676    21.072  8.3468 1.3686 4.4460 1.6996 3.900784       2.182081  
1 1 1 8  22 2  o 3.1467 1.0080 -9.4619  14.158  -22.5844  20.014  3.6850    20.032  2.7097 1.2973 3.5837 1.5431 -0.8740244     2.015984  
1 1 1 8  22 3  o 5.1040 1.2194 29.275   15.409  17.062    21.357  42.538    22.255  4.3045 1.6928 5.9034 1.7556 -1.598943      2.438813  
1 1 1 8  22 4  o 3.2388 1.0065 -3.2307  13.109  -14.9244  18.705  8.0562    18.377  2.7991 1.3144 3.6784 1.5247 -0.8792789     2.013068  
1 1 1 8  22 5  o 11.549 0.7713 143.134  17.646  163.045   24.818  122.775   25.096  12.425 0.9987 10.673 1.1756 1.751827       1.542539  
1 1 1 8  22 6  o 8.9231 0.9297 86.448   16.508  75.474    22.624  98.945    24.142  8.2916 1.3643 9.5545 1.2634 -1.262946      1.859404  
1 1 1 8  22 7  o 5.5716 1.1882 36.181   14.468  41.817    20.440  30.523    20.481  5.9723 1.6544 5.1710 1.7060 0.8013320      2.376406  
1 1 1 8  22 8  o 5.8428 1.2543 40.686   15.966  44.450    22.993  37.181    22.186  6.0837 1.7779 5.6018 1.7697 0.4818859      2.508569  
1 1 1 8  22 9  o 5.1231 1.2230 28.600   15.822  13.636    22.407  43.483    22.346  4.2198 1.7087 6.0264 1.7503 -1.806581      2.446069  
1 1 1 8  22 10 o 5.1406 1.2277 28.508   16.027  12.622    22.499  44.874    22.836  4.1730 1.7038 6.1083 1.7681 -1.935357      2.455384  
1 1 1 8  22 11 o 3.4374 1.0718 -1.0677  14.454  -5.6175   20.399  3.5203    20.485  3.2555 1.4706 3.6193 1.5594 -0.3638132     2.143510  
1 1 1 8  22 12 o 8.4985 1.0376 81.180   17.182  72.185    23.985  90.660    24.624  7.9016 1.5730 9.0954 1.3537 -1.193737      2.075286  
1 1 1 8  22 13 o 5.7462 1.2779 40.649   16.471  44.564    22.753  36.337    23.875  6.0224 1.7711 5.4700 1.8428 0.5524507      2.555887  
1 1 1 8  22 14 o 5.9808 1.2623 45.069   17.082  29.265    24.703  59.548    23.646  5.0068 1.8560 6.9549 1.7115 -1.948110      2.524686  
1 1 1 8  22 15 o 4.8354 1.1900 20.453   17.030  -9.7565   23.931  51.446    24.240  3.3277 1.5367 6.3432 1.8174 -3.015545      2.379990  
1 1 1 8  22 16 o 2.9326 1.0218 -33.7008 17.884  -31.5399  20.749  -39.9440  35.269  2.5237 1.2343 3.3415 1.6288 -0.8178225     2.043652  
1 1 1 8  22 17 o 5.1674 1.3453 39.931   20.660  51.165    23.215  -2.8366   45.296  6.0874 1.7886 4.2474 2.0101 1.840024       2.690634  
1 1 1 8  22 18 f 5.9588 1.5235 53.908   20.593  49.275    22.858  73.870    47.447  5.8903 1.7855 6.0272 2.4691 -0.1368122     3.047011  
1 1 1 8  22 19 f 10.101 1.4050 156.558  22.941  159.656   26.179  146.307   47.621  11.716 1.1172 8.4855 2.5783 3.230547       2.809933  
1 1 1 8  22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 0  o 2.7482 1.3098 -15.4588 20.359  10.753    31.792  -33.6796  26.507  3.4329 2.1688 2.0635 1.4694 -0.000000      0.000000  
1 1 1 8  23 1  o 10.262 0.8559 114.696  17.215  132.649   23.651  94.465    25.106  11.214 1.0546 9.3103 1.3483 1.903203       1.711723  
1 1 1 8  23 2  o 11.034 0.7948 129.464  17.426  112.352   24.423  147.212   24.872  10.250 1.1914 11.817 1.0523 -1.567442      1.589582  
1 1 1 8  23 3  o 18.854 0.6187 368.530  23.321  356.703   32.502  381.081   33.481  18.542 0.8765 19.167 0.8734 -0.6255245     1.237342  
1 1 1 8  23 4  o 4.5322 1.2088 19.870   15.211  12.824    21.909  26.426    21.134  4.1639 1.6884 4.9005 1.7302 -0.7365451     2.417499  
1 1 1 8  23 5  o 2.9787 0.9799 -18.8514 14.761  -36.4327  20.954  -1.5352   20.796  2.5063 1.2289 3.4510 1.5267 -0.9446619     1.959859  
1 1 1 8  23 6  o 3.7041 1.1212 3.8977   14.945  -1.9107   21.587  9.2442    20.711  3.4961 1.5507 3.9121 1.6199 -0.4159982     2.242477  
1 1 1 8  23 7  o 3.7782 1.1248 6.2214   14.653  -0.1697   21.634  11.638    19.917  3.5679 1.5687 3.9886 1.6124 -0.4207304     2.249630  
1 1 1 8  23 8  o 3.8745 1.1691 5.4495   16.093  10.936    23.013  0.1986    22.512  4.1141 1.7059 3.6349 1.5992 0.4791827      2.338245  
1 1 1 8  23 9  o 3.5591 1.1040 -2.1644  15.717  -16.3674  22.960  10.358    21.559  3.1245 1.4637 3.9937 1.6531 -0.8691747     2.207982  
1 1 1 8  23 10 o 7.9035 1.1138 76.570   17.569  33.826    25.320  116.261   24.399  5.3926 1.8948 10.415 1.1714 -5.021919      2.227655  
1 1 1 8  23 11 o 8.6353 1.0556 85.074   17.783  91.349    25.051  78.701    25.248  9.0730 1.3805 8.1976 1.5974 0.8754320      2.111278  
1 1 1 8  23 12 o 2.9691 0.9963 -20.2881 15.872  -14.8612  23.429  -24.8915  21.579  3.1676 1.4822 2.7706 1.3318 0.3970306      1.992648  
1 1 1 8  23 13 o 7.4406 1.2758 69.781   18.861  61.900    26.621  77.725    26.726  6.9412 1.8739 7.9400 1.7318 -0.9988055     2.551538  
1 1 1 8  23 14 o 5.2465 1.2814 32.531   18.263  9.0510    26.589  53.502    25.128  4.0868 1.7687 6.4062 1.8548 -2.319442      2.562893  
1 1 1 8  23 15 o 8.7308 1.1164 97.174   18.467  146.424   26.249  48.908    25.985  11.486 1.1426 5.9753 1.9182 5.510968       2.232702  
1 1 1 8  23 16 o 3.1166 1.0944 -28.7982 18.948  -29.4762  21.105  -25.9800  43.027  2.5241 1.2367 3.7091 1.8060 -1.185014      2.188853  
1 1 1 8  23 17 o 6.7900 1.5804 71.889   22.119  64.101    24.855  101.530   48.490  6.7012 1.8113 6.8787 2.5903 -0.1774940     3.160755  
1 1 1 8  23 18 o 5.9286 1.5506 55.165   20.938  42.738    23.604  101.048   45.355  5.2195 1.8297 6.6376 2.5039 -1.418106      3.101206  
1 1 1 8  23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 0  o 22.552 0.8541 531.900  38.261  517.712   54.088  546.109   54.130  22.235 1.2248 22.869 1.1908 -0.000000      0.000000  
1 1 1 8  24 1  o 6.7685 1.1929 54.429   16.184  61.748    22.821  47.022    22.956  7.2766 1.6107 6.2604 1.7601 1.016160       2.385792  
1 1 1 8  24 2  f 9.7050 0.9314 103.335  17.829  85.527    25.284  120.946   25.143  8.7903 1.4382 10.620 1.1838 -1.829513      1.862734  
1 1 1 8  24 3  o 4.2600 1.2046 14.479   15.711  19.976    21.874  8.6218    22.580  4.5266 1.7313 3.9934 1.6754 0.5332234      2.409237  
1 1 1 8  24 4  o 7.7345 1.1215 69.300   16.740  73.340    24.542  65.785    22.892  7.9403 1.6007 7.5288 1.5711 0.4114900      2.242906  
1 1 1 8  24 5  o 3.6948 1.1868 -5.3994  18.524  3.7912    21.696  -30.1168  35.581  3.7175 1.6033 3.6721 1.7502 0.4538035E-01  2.373590  
1 1 1 8  24 6  o 5.0041 1.2616 28.386   15.998  31.422    21.772  24.823    23.584  5.1867 1.7597 4.8214 1.8082 0.3652358      2.523162  
1 1 1 8  24 7  o 4.8312 1.2497 24.602   16.081  33.105    22.797  16.180    22.687  5.3159 1.8007 4.3464 1.7335 0.9694419      2.499456  
1 1 1 8  24 8  o 13.033 0.7901 181.399  20.484  160.591   28.909  202.378   29.028  12.233 1.1816 13.833 1.0493 -1.599658      1.580219  
1 1 1 8  24 9  o 3.4167 1.0982 -7.8767  16.486  0.9825    24.083  -15.6887  22.615  3.7331 1.6477 3.1003 1.4524 0.6328335      2.196462  
1 1 1 8  24 10 o 3.6429 1.1187 -5.2900  16.774  19.162    23.469  -30.8206  23.982  4.4515 1.7669 2.8342 1.3726 1.617359       2.237442  
1 1 1 8  24 11 o 2.8971 0.9783 -21.9285 15.816  -26.9117  24.081  -18.1478  20.975  2.9155 1.4029 2.8787 1.3639 0.3682542E-01  1.956593  
1 1 1 8  24 12 o 5.4325 1.3456 37.408   18.080  42.265    26.261  33.032    24.929  5.6953 1.9326 5.1697 1.8728 0.5255513      2.691182  
1 1 1 8  24 13 o 5.3650 1.3661 38.196   18.737  39.578    26.312  36.774    26.687  5.4436 1.9296 5.2864 1.9342 0.1572084      2.732162  
1 1 1 8  24 14 o 4.1108 1.2262 13.850   17.703  2.7453    25.213  24.649    24.863  3.6770 1.6503 4.5445 1.8140 -0.8675761     2.452335  
1 1 1 8  24 15 o 3.9845 1.2815 8.9471   21.051  13.870    24.075  -7.0379   43.385  3.9422 1.6945 4.0268 1.9230 -0.8468032E-01 2.563060  
1 1 1 8  24 16 f 4.4448 1.3762 24.303   21.526  23.103    24.838  27.922    43.149  4.2752 1.7724 4.6144 2.1058 -0.3391132     2.752403  
1 1 1 8  24 17 o 3.9134 1.2819 12.237   21.639  14.623    24.222  2.8039    48.163  3.7990 1.6654 4.0278 1.9493 -0.2288001     2.563867  
1 1 1 8  24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  24 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 0  o 5.0253 1.4836 30.197   23.295  -30.0559  35.205  77.129    31.070  2.5610 1.7977 7.4895 2.3606 -0.000000      0.000000  
1 1 1 8  25 1  o 3.6461 1.1075 -2.5790  15.751  17.103    22.207  -22.5055  22.344  4.3708 1.7239 2.9215 1.3909 1.449395       2.215041  
1 1 1 8  25 2  o 9.2908 0.9776 95.223   18.115  93.524    26.428  96.728    24.880  9.1761 1.4400 9.4056 1.3226 -0.2294598     1.955243  
1 1 1 8  25 3  o 3.9095 1.1606 7.4423   15.527  13.061    21.200  0.9417    22.803  4.1286 1.6655 3.6904 1.6169 0.4382513      2.321219  
1 1 1 8  25 4  o 3.9653 1.1616 6.9813   15.702  -5.5490   22.137  19.669    22.275  3.4064 1.5360 4.5243 1.7430 -1.117941      2.323218  
1 1 1 8  25 5  o 13.375 0.7767 191.579  20.498  155.714   28.648  229.203   29.341  12.012 1.1925 14.738 0.9954 -2.726349      1.553350  
1 1 1 8  25 6  o 4.2540 1.2203 14.966   16.106  16.918    24.200  13.413    21.579  4.3966 1.7773 4.1114 1.6725 0.2851405      2.440524  
1 1 1 8  25 7  o 10.883 0.9422 133.093  19.812  95.905    27.625  172.479   28.429  9.1411 1.5110 12.626 1.1259 -3.484435      1.884326  
1 1 1 8  25 8  o 3.9546 1.1635 1.8802   17.314  -26.2477  25.036  27.665    23.970  3.0057 1.4422 4.9034 1.8261 -1.897643      2.326925  
1 1 1 8  25 9  o 5.4322 1.3136 35.170   17.652  51.527    26.466  22.062    23.691  6.2838 1.9247 4.5806 1.7883 1.703230       2.627264  
1 1 1 8  25 10 o 3.6337 1.1546 -2.1144  17.507  5.1030    25.880  -8.2028   23.770  3.9155 1.7188 3.3519 1.5420 0.5636046      2.309153  
1 1 1 8  25 11 o 5.8947 1.4071 47.961   19.689  49.094    27.737  46.811    27.953  5.9629 1.9862 5.8265 1.9938 0.1363521      2.814297  
1 1 1 8  25 12 o 9.6906 1.1128 115.707  20.855  101.480   29.703  129.538   29.287  8.8818 1.7344 10.499 1.3947 -1.617568      2.225568  
1 1 1 8  25 13 o 3.1447 1.0612 -18.9733 18.728  -2.0230   27.280  -34.0837  25.757  3.5320 1.6345 2.7574 1.3541 0.7746105      2.122487  
1 1 1 8  25 14 o 4.1901 1.2096 17.085   17.034  35.973    24.687  -0.0772   23.533  4.9720 1.8529 3.4082 1.5552 1.563866       2.419109  
1 1 1 8  25 15 o 7.7135 1.5389 99.417   23.425  94.158    27.142  114.768   46.374  8.2185 1.7071 7.2084 2.5610 1.010021       3.077832  
1 1 1 8  25 16 o 4.3192 1.3336 28.850   22.217  35.146    25.058  5.7103    48.038  4.6337 1.8300 4.0046 1.9402 0.6290879      2.667122  
1 1 1 8  25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  25 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 0  o 4.3471 1.7493 27.182   25.842  2.7668    35.374  55.127    37.844  3.2421 2.1356 5.4521 2.7711 -0.000000      0.000000  
1 1 1 8  26 1  o 14.969 0.7302 239.360  21.851  233.125   30.359  246.061   31.475  14.771 1.0276 15.166 1.0377 -0.3947849     1.460404  
1 1 1 8  26 2  o 8.3940 1.1230 85.231   18.092  111.829   25.305  57.419    25.876  10.068 1.2567 6.7196 1.8614 3.348750       2.245909  
1 1 1 8  26 3  o 5.4737 1.3149 37.299   17.195  36.498    24.627  38.062    24.019  5.4245 1.8708 5.5230 1.8484 -0.9853172E-01 2.629901  
1 1 1 8  26 4  o 3.7301 1.1607 1.6845   16.926  -4.8606   23.947  8.2178    23.926  3.4932 1.5843 3.9670 1.6968 -0.4738154     2.321402  
1 1 1 8  26 5  o 13.165 0.8048 188.398  21.171  192.545   30.717  184.645   29.220  13.286 1.1560 13.043 1.1201 0.2421074      1.609649  
1 1 1 8  26 6  o 4.0637 1.2092 7.4332   17.369  24.244    25.488  -7.1428   23.733  4.7324 1.8529 3.3951 1.5541 1.337314       2.418322  
1 1 1 8  26 7  o 10.510 0.9899 126.399  20.710  117.639   29.841  134.540   28.765  10.081 1.4801 10.939 1.3148 -0.8580065     1.979747  
1 1 1 8  26 8  o 3.0072 1.0040 -24.6294 16.891  -53.9705  25.210  -0.7242   22.755  2.5085 1.2505 3.5059 1.5710 -0.9974387     2.007971  
1 1 1 8  26 9  o 4.7452 1.3233 26.356   18.477  30.065    27.117  23.142    25.245  4.9262 1.9160 4.5641 1.8258 0.3620272      2.646617  
1 1 1 8  26 10 o 4.0966 1.2340 11.209   18.375  27.353    26.652  -3.4150   25.367  4.6984 1.8772 3.4948 1.6022 1.203644       2.468005  
1 1 1 8  26 11 o 3.6463 1.1702 2.9969   18.623  -3.8215   26.213  9.9464    26.463  3.4328 1.5933 3.8598 1.7142 -0.4269972     2.340356  
1 1 1 8  26 12 o 4.2405 1.2754 19.766   18.934  18.032    26.579  21.552    26.980  4.1673 1.7856 4.3136 1.8217 -0.1463156     2.550820  
1 1 1 8  26 13 o 2.5189 0.8808 -35.8235 16.282  -40.5289  24.538  -32.1218  21.764  2.5449 1.2629 2.4930 1.2282 0.5193472E-01  1.761624  
1 1 1 8  26 14 o 5.6631 1.5483 36.648   22.347  8.9339    25.156  140.364   48.664  3.6161 1.6334 7.7100 2.6308 -4.093970      3.096573  
1 1 1 8  26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  26 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 0  o 3.4503 1.5277 1.3290   23.738  -29.0421  32.113  37.919    35.248  2.3909 1.6862 4.5096 2.5480 -0.000000      0.000000  
1 1 1 8  27 1  o 4.0540 1.1621 5.5697   16.823  -21.3362  23.914  31.930    23.670  3.0135 1.4359 5.0946 1.8276 -2.081101      2.324190  
1 1 1 8  27 2  o 6.0498 1.3592 48.200   18.847  37.660    26.492  59.001    26.818  5.4119 1.9343 6.6877 1.9101 -1.275783      2.718455  
1 1 1 8  27 3  o 3.8315 1.1426 -8.2958  17.507  31.881    25.884  -42.1713  23.768  5.0796 1.8965 2.5834 1.2748 2.496118       2.285109  
1 1 1 8  27 4  o 7.9410 1.4750 84.395   22.892  76.095    28.305  100.092   38.925  7.6185 1.8712 8.2636 2.2806 -0.6450458     2.950019  
1 1 1 8  27 5  o 5.3487 1.3462 37.647   18.072  41.318    26.785  34.579    24.484  5.5291 1.9483 5.1683 1.8582 0.3608379      2.692382  
1 1 1 8  27 6  o 8.9352 1.1756 100.199  20.249  75.804    28.517  125.008   28.758  7.5054 1.8984 10.365 1.3873 -2.859628      2.351293  
1 1 1 8  27 7  o 3.3198 1.0718 -8.7911  16.770  -29.8135  24.538  9.6331    22.971  2.8123 1.3681 3.8274 1.6502 -1.015098      2.143599  
1 1 1 8  27 8  o 3.1458 1.0471 -10.5585 16.900  -8.1555   24.896  -12.6122  23.016  3.2594 1.5260 3.0322 1.4343 0.2271578      2.094253  
1 1 1 8  27 9  o 3.5262 1.1292 -6.7306  18.002  -29.6548  24.344  20.937    26.744  2.7544 1.3449 4.2980 1.8143 -1.543615      2.258429  
1 1 1 8  27 10 o 4.2966 1.2861 21.867   19.138  24.491    26.424  18.972    27.754  4.3946 1.8255 4.1986 1.8121 0.1960082      2.572215  
1 1 1 8  27 11 o 3.5705 1.1390 3.7483   17.883  -11.8013  26.865  16.120    23.963  3.2095 1.5273 3.9314 1.6903 -0.7219067     2.278063  
1 1 1 8  27 12 o 5.0780 1.3401 43.380   18.989  30.987    27.632  54.469    26.138  4.4638 1.8616 5.6922 1.9281 -1.228413      2.680111  
1 1 1 8  27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  27 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 0  o 5.2487 1.9461 56.256   26.906  46.207    35.702  69.464    40.932  4.7208 2.6027 5.7767 2.8941 -0.000000      0.000000  
1 1 1 8  28 1  f 5.2555 1.3445 37.764   19.069  54.138    27.200  21.938    26.740  6.0848 1.9635 4.4263 1.8374 1.658509       2.689062  
1 1 1 8  28 2  o 6.5468 1.3591 63.002   19.252  54.471    28.615  70.057    26.022  5.9829 2.0174 7.1106 1.8216 -1.127702      2.718178  
1 1 1 8  28 3  o 3.6289 1.1703 1.2457   18.876  -3.8197   26.849  6.1965    26.544  3.4887 1.6169 3.7691 1.6923 -0.2804179     2.340589  
1 1 1 8  28 4  o 4.7676 1.3105 31.169   18.450  43.500    26.337  19.288    25.854  5.3460 1.9268 4.1892 1.7769 1.156851       2.621054  
1 1 1 8  28 5  o 3.3188 1.0898 -8.9353  17.716  -24.1671  24.488  7.7917    25.662  2.8659 1.3877 3.7717 1.6808 -0.9058490     2.179657  
1 1 1 8  28 6  o 5.4794 1.3052 42.353   18.990  67.440    26.863  17.293    26.848  6.7993 1.9012 4.1594 1.7887 2.639908       2.610397  
1 1 1 8  28 7  o 4.7752 1.3282 31.269   18.960  46.388    28.201  18.799    25.612  5.4082 1.9869 4.1423 1.7632 1.265823       2.656444  
1 1 1 8  28 8  o 4.1051 1.2399 14.695   19.152  36.700    27.516  -5.9826   26.673  4.8631 1.9186 3.3471 1.5710 1.515971       2.479754  
1 1 1 8  28 9  f 3.1182 1.0581 -15.1743 18.976  -9.5494   27.897  -20.0173  25.886  3.2784 1.5590 2.9580 1.4310 0.3204303      2.116177  
1 1 1 8  28 10 o 4.0763 1.2594 20.552   19.605  31.716    28.586  10.637    26.939  4.4497 1.8769 3.7030 1.6798 0.7466948      2.518801  
1 1 1 8  28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  28 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 0  o 5.4302 1.7687 52.499   27.556  102.541   39.950  7.0842    38.059  7.6684 2.8178 3.1921 2.1384 -0.000000      0.000000  
1 1 1 8  29 1  o 4.1705 1.2739 19.087   19.442  17.340    28.508  20.606    26.583  4.1299 1.8087 4.2111 1.7945 -0.8119106E-01 2.547852  
1 1 1 8  29 2  o 7.2269 1.3375 77.603   19.562  76.234    28.028  78.904    27.315  7.1079 1.9244 7.3459 1.8580 -0.2380629     2.674928  
1 1 1 8  29 3  o 6.7209 1.3517 70.559   20.204  92.373    28.495  48.504    28.652  8.0221 1.8181 5.4197 2.0008 2.602410       2.703455  
1 1 1 8  29 4  o 3.4345 1.1250 -3.2844  18.693  10.452    26.459  -16.9720  26.412  3.7960 1.6980 3.0731 1.4763 0.7228506      2.250057  
1 1 1 8  29 5  o 4.1723 1.2685 20.185   19.690  6.3925    28.151  33.395    27.550  3.6972 1.6924 4.6473 1.8900 -0.9501228     2.537023  
1 1 1 8  29 6  o 4.4504 1.2560 19.756   19.171  59.277    28.988  -10.9652  25.558  5.7904 2.0278 3.1104 1.4828 2.679968       2.512081  
1 1 1 8  29 7  o 3.8593 1.2163 12.253   19.652  31.644    28.418  -5.5205   27.207  4.4392 1.8719 3.2794 1.5537 1.159796       2.432645  
1 1 1 8  29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  29 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 0  o 3.7474 2.3678 -50.0933 27.836  -146.6929 41.006  32.466    37.909  3.7474 2.3678 3.7474 2.3678 -0.000000      0.000000  
1 1 1 8  30 1  o 3.1628 1.0601 -8.5609  18.211  -21.0624  26.080  3.3336    25.439  2.8973 1.4097 3.4282 1.5836 -0.5308552     2.120152  
1 1 1 8  30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  30 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  31 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  32 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  33 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  34 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  35 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 8  35 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  1  0  o 18.873 0.7161 360.711  26.848  358.461   38.265  362.892   37.678  18.812 1.0240 18.934 1.0014 -0.000000      0.000000  
1 1 1 9  1  1  o 24.396 0.5092 597.569  24.838  577.419   34.924  618.193   35.333  23.979 0.7282 24.814 0.7120 -0.8344898     1.018422  
1 1 1 9  1  2  o 21.499 0.5038 464.132  21.662  463.642   30.577  464.626   30.694  21.488 0.7115 21.510 0.7135 -0.2256012E-01 1.007604  
1 1 1 9  1  3  o 32.963 0.6048 1062.91  34.955  1157.23   69.962  1031.53   40.353  33.863 1.0330 32.063 0.6293 1.799770       1.209601  
1 1 1 9  1  4  o 16.505 0.5743 267.937  16.495  286.561   33.264  261.864   18.994  16.853 0.9869 16.157 0.5878 0.6964436      1.148675  
1 1 1 9  1  5  o 14.000 0.6045 199.797  14.448  192.049   29.188  202.312   16.628  13.797 1.0578 14.204 0.5853 -0.4076424     1.208964  
1 1 1 9  1  6  o 23.366 0.5970 560.136  24.031  525.395   47.607  572.015   27.838  22.841 1.0421 23.890 0.5826 -1.049595      1.193935  
1 1 1 9  1  7  o 6.8231 0.6593 46.908   8.9830  48.507    12.515  45.210    12.902  6.9445 0.9010 6.7017 0.9626 0.2428803      1.318509  
1 1 1 9  1  8  o 18.337 0.5077 337.313  18.619  337.435   26.247  337.190   26.417  18.341 0.7155 18.334 0.7204 0.7078171E-02  1.015384  
1 1 1 9  1  9  o 24.231 0.5122 589.149  24.814  604.670   35.069  573.589   35.114  24.551 0.7142 23.910 0.7343 0.6414604      1.024340  
1 1 1 9  1  10 o 44.287 0.5969 1971.01  52.850  1899.06   74.308  2044.67   75.182  43.466 0.8548 45.107 0.8334 -1.641277      1.193803  
1 1 1 9  1  11 o 32.407 0.5376 1055.55  34.841  1051.53   49.072  1059.64   49.477  32.345 0.7586 32.469 0.7619 -0.1237564     1.075136  
1 1 1 9  1  12 o 17.678 0.5189 314.092  18.343  304.881   25.727  323.618   26.161  17.414 0.7387 17.942 0.7290 -0.5283737     1.037861  
1 1 1 9  1  13 o 33.967 0.6871 1196.69  43.702  1081.68   74.520  1256.98   53.954  32.613 1.1425 35.320 0.7638 -2.706882      1.374275  
1 1 1 9  1  14 o 2.8895 0.8348 1.6654   7.7694  -3.2331   10.175  8.5169    12.033  2.4018 1.0650 3.3772 1.2859 -0.9753602     1.669666  
1 1 1 9  1  15 o 14.252 0.5641 206.986  15.784  158.331   21.700  261.649   23.001  12.447 0.8717 16.057 0.7162 -3.609963      1.128199  
1 1 1 9  1  16 o 27.641 0.5322 776.303  29.410  750.120   41.296  803.252   41.896  27.163 0.7601 28.118 0.7450 -0.9546375     1.064349  
1 1 1 9  1  17 o 3.4519 0.8676 10.277   8.1013  17.269    10.900  1.6480    12.109  4.0250 1.2356 2.8788 1.2183 1.146251       1.735199  
1 1 1 9  1  18 o 7.1155 0.8122 55.166   11.043  62.842    15.022  46.139    16.290  7.7707 0.9666 6.4602 1.3057 1.310524       1.624497  
1 1 1 9  1  19 o 11.633 0.6229 141.655  14.394  154.277   19.919  127.860   20.824  12.211 0.8156 11.055 0.9418 1.156102       1.245898  
1 1 1 9  1  20 o 10.304 0.6688 111.254  13.770  110.926   19.061  111.612   19.914  10.298 0.9255 10.309 0.9658 -0.1162529E-01 1.337700  
1 1 1 9  1  21 o 5.1780 1.0251 30.283   11.422  19.807    15.509  42.699    16.884  4.2724 1.4840 6.0836 1.4145 -1.811162      2.050101  
1 1 1 9  1  22 o 7.7928 0.9040 67.224   13.598  72.666    18.512  60.846    20.040  8.2560 1.1211 7.3297 1.4183 0.9263005      1.807924  
1 1 1 9  1  23 o 10.942 0.7260 126.199  15.812  117.920   21.146  136.699   23.816  10.553 1.0019 11.331 1.0509 -0.7777348     1.451979  
1 1 1 9  1  24 o 8.4413 0.8328 74.989   13.691  71.332    17.324  81.074    22.346  8.2251 1.0531 8.6575 1.2905 -0.4323769     1.665699  
1 1 1 9  1  25 o 3.6546 0.8991 13.963   7.9894  6.0951    15.390  16.866    9.3478  3.3864 1.3988 3.9229 1.1300 -0.5365522     1.798181  
1 1 1 9  1  26 o 8.4961 0.6077 74.680   10.292  83.749    15.035  66.685    14.118  8.9878 0.8364 8.0043 0.8819 0.9835796      1.215463  
1 1 1 9  1  27 o 6.0509 0.7268 39.544   8.2588  40.402    13.644  39.048    10.375  6.0000 1.1791 6.1018 0.8502 -0.1018238     1.453637  
1 1 1 9  1  28 f 3.1334 0.8701 6.8868   7.7184  13.337    13.097  3.4549    9.5536  3.6179 1.3494 2.6489 1.0988 0.9690347      1.740149  
1 1 1 9  1  29 f 8.0353 0.6436 71.401   10.090  64.823    15.563  76.171    13.254  7.6251 1.0205 8.4455 0.7847 -0.8203845     1.287287  
1 1 1 9  1  30 o 8.7197 0.6297 83.263   10.856  102.600   16.408  68.211    14.477  9.6448 0.8506 7.7946 0.9287 1.850255       1.259352  
1 1 1 9  1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  2  0  o 3.7320 1.2093 20.107   10.545  12.632    15.059  27.299    14.771  3.0226 1.6817 4.4414 1.7383 -0.000000      0.000000  
1 1 1 9  2  1  o 13.015 0.5150 170.190  13.406  170.162   19.000  170.218   18.917  13.014 0.7300 13.016 0.7267 -0.2431870E-02 1.030021  
1 1 1 9  2  2  o 14.246 0.5091 203.889  14.503  202.387   20.485  205.398   20.537  14.193 0.7217 14.299 0.7181 -0.1054955     1.018103  
1 1 1 9  2  3  o 6.0226 0.7157 37.372   8.3548  43.018    11.841  31.773    11.790  6.5348 0.9060 5.5105 1.1082 1.024293       1.431418  
1 1 1 9  2  4  o 14.989 0.5097 225.626  15.276  218.652   21.597  232.608   21.610  14.757 0.7318 15.222 0.7098 -0.4654770     1.019480  
1 1 1 9  2  5  o 14.380 0.5147 207.502  14.802  208.873   20.968  206.139   20.898  14.428 0.7267 14.333 0.7290 0.9490776E-01  1.029331  
1 1 1 9  2  6  f 23.501 0.5757 543.475  23.674  578.679   47.301  531.710   27.345  23.972 0.9866 23.030 0.5937 0.9426270      1.151431  
1 1 1 9  2  7  o 3.3543 0.8688 9.6779   7.1700  -0.7777   15.839  12.373    8.0410  3.2131 1.3776 3.4955 1.0589 -0.2824342     1.737509  
1 1 1 9  2  8  o 20.737 0.5866 431.535  21.145  432.056   42.039  431.358   24.465  20.725 1.0142 20.748 0.5896 -0.2374458E-01 1.173129  
1 1 1 9  2  9  o 36.289 0.6322 1309.55  40.100  1353.76   79.666  1294.55   46.408  36.648 1.0869 35.929 0.6458 0.7184486      1.264311  
1 1 1 9  2  10 f 25.189 0.5943 636.841  26.142  640.348   51.664  635.635   30.309  25.202 1.0250 25.176 0.6019 0.2551270E-01  1.188691  
1 1 1 9  2  11 o 15.158 0.6238 236.240  16.044  222.440   32.512  240.683   18.447  14.829 1.0962 15.488 0.5955 -0.6584053     1.247529  
1 1 1 9  2  12 o 11.921 0.6903 142.829  15.459  145.512   27.069  141.529   18.831  11.984 1.1294 11.858 0.7940 0.1259985      1.380571  
1 1 1 9  2  13 o 9.1376 0.7205 85.914   12.517  88.404    15.600  81.413    20.973  9.3504 0.8342 8.9248 1.1750 0.4256163      1.441007  
1 1 1 9  2  14 o 19.265 0.6482 361.809  23.236  337.126   27.723  420.104   42.604  18.256 0.7593 20.273 1.0507 -2.017490      1.296367  
1 1 1 9  2  15 o 13.774 0.5533 193.329  15.223  180.376   21.133  207.296   21.946  13.291 0.7950 14.258 0.7696 -0.9666100     1.106511  
1 1 1 9  2  16 o 6.1414 0.9787 41.779   11.562  39.695    18.289  43.166    14.921  5.9628 1.5270 6.3200 1.2247 -0.3571877     1.957437  
1 1 1 9  2  17 o 10.442 0.6041 112.510  12.574  118.803   17.446  105.707   18.138  10.761 0.8106 10.122 0.8960 0.6387615      1.208232  
1 1 1 9  2  18 o 8.2163 0.7053 70.667   11.546  76.040    16.145  65.043    16.519  8.5550 0.9436 7.8776 1.0485 0.6773691      1.410540  
1 1 1 9  2  19 o 10.952 0.6454 125.317  14.126  118.620   19.737  132.350   20.227  10.645 0.9271 11.259 0.8982 -0.6146812     1.290862  
1 1 1 9  2  20 o 3.2471 0.9444 5.8480   9.8631  4.9043    13.653  6.8778    14.263  3.1641 1.3131 3.3301 1.3578 -0.1660349     1.888864  
1 1 1 9  2  21 o 11.631 0.6720 143.558  15.486  161.630   21.620  124.515   22.193  12.437 0.8692 10.826 1.0250 1.611529       1.343916  
1 1 1 9  2  22 o 4.2756 0.9846 16.378   11.543  35.260    16.061  -3.7980   16.602  5.5403 1.4372 3.0109 1.3461 2.529423       1.969148  
1 1 1 9  2  23 o 9.8659 0.7801 105.344  15.187  114.825   20.599  94.056    22.478  10.422 0.9882 9.3096 1.2073 1.112532       1.560173  
1 1 1 9  2  24 o 12.535 0.6573 165.757  16.015  172.085   20.642  156.188   25.383  12.908 0.7996 12.162 1.0436 0.7460289      1.314678  
1 1 1 9  2  25 o 4.0287 0.9342 14.580   7.5834  25.299    16.037  11.493    8.6064  4.7250 1.5058 3.3324 1.1062 1.392627       1.868489  
1 1 1 9  2  26 o 5.1881 0.9353 29.391   9.0836  33.792    16.865  27.592    10.781  5.3810 1.5071 4.9951 1.1081 0.3858867      1.870621  
1 1 1 9  2  27 o 5.1062 0.8888 33.088   9.2868  16.600    17.045  40.049    11.075  4.0529 1.5335 6.1595 0.8990 -2.106571      1.777609  
1 1 1 9  2  28 o 5.8854 0.8081 41.575   8.6239  31.737    14.841  46.591    10.597  5.1224 1.4060 6.6484 0.7969 -1.526091      1.616110  
1 1 1 9  2  29 o 4.9258 0.8457 31.434   8.4487  19.323    14.850  37.230    10.274  3.9977 1.4459 5.8539 0.8775 -1.856256      1.691303  
1 1 1 9  2  30 o 5.9801 0.8524 44.754   9.6224  40.629    15.754  47.208    12.153  5.5012 1.4216 6.4589 0.9408 -0.9577055     1.704703  
1 1 1 9  2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  3  0  o 8.7839 0.9205 83.005   14.665  100.131   21.066  66.901    20.428  9.7977 1.1120 7.7700 1.4672 -0.000000      0.000000  
1 1 1 9  3  1  o 10.832 0.5387 117.989  11.663  121.145   16.379  114.743   16.612  10.981 0.7458 10.684 0.7774 0.2962523      1.077303  
1 1 1 9  3  2  o 12.758 0.5195 163.505  13.247  156.820   18.724  170.205   18.745  12.495 0.7493 13.020 0.7199 -0.5245066     1.039024  
1 1 1 9  3  3  o 21.284 0.4987 454.536  21.227  458.053   30.066  451.040   29.974  21.366 0.7036 21.202 0.7069 0.1645203      0.9973342 
1 1 1 9  3  4  o 19.535 0.5008 382.865  19.559  369.870   27.547  396.078   27.776  19.200 0.7174 19.870 0.6990 -0.6702595     1.001580  
1 1 1 9  3  5  o 14.964 0.5051 224.738  15.114  225.421   21.246  224.038   21.507  14.987 0.7088 14.940 0.7198 0.4689026E-01  1.010177  
1 1 1 9  3  6  o 9.3076 0.5766 87.493   10.663  97.687    14.948  76.931    15.216  9.8654 0.7576 8.7497 0.8695 1.115680       1.153235  
1 1 1 9  3  7  o 22.127 0.5049 491.038  22.343  493.977   31.631  488.111   31.566  22.193 0.7126 22.061 0.7154 0.1324196      1.009784  
1 1 1 9  3  8  o 26.493 0.5165 704.328  27.366  709.379   38.706  699.279   38.698  26.588 0.7279 26.398 0.7330 0.1905899      1.032982  
1 1 1 9  3  9  o 12.134 0.6060 139.612  12.848  165.506   26.340  131.527   14.718  12.816 1.0276 11.451 0.6426 1.364719       1.211986  
1 1 1 9  3  10 o 19.629 0.6279 412.142  20.702  342.972   41.130  435.612   23.958  18.418 1.1166 20.841 0.5748 -2.422882      1.255821  
1 1 1 9  3  11 o 6.1471 0.8922 35.697   9.0786  45.876    19.980  33.048    10.191  6.5680 1.5466 5.7263 0.8899 0.8416781      1.784353  
1 1 1 9  3  12 f 24.223 0.6070 604.094  25.357  567.607   50.139  616.634   29.393  23.666 1.0593 24.780 0.5931 -1.114113      1.214031  
1 1 1 9  3  13 o 23.906 0.6220 598.448  25.494  542.687   50.289  617.734   29.576  23.039 1.0914 24.772 0.5970 -1.732040      1.243974  
1 1 1 9  3  14 o 6.6388 0.9080 46.343   9.9069  47.313    20.981  46.065    11.239  6.5482 1.6127 6.7293 0.8351 -0.1811204     1.816045  
1 1 1 9  3  15 o 5.2003 0.9495 22.294   8.7101  47.353    19.167  15.772    9.7781  6.5363 1.4982 3.8643 1.1670 2.671947       1.899090  
1 1 1 9  3  16 o 8.3499 0.8984 83.269   11.406  60.820    23.646  90.076    13.021  7.2963 1.6581 9.4034 0.6923 -2.107131      1.796807  
1 1 1 9  3  17 o 8.8335 0.8008 83.096   11.527  81.177    24.671  83.632    13.037  8.6259 1.4300 9.0411 0.7210 -0.4151449     1.601522  
1 1 1 9  3  18 o 7.0503 0.9949 59.688   10.708  47.217    24.584  62.609    11.896  6.2916 1.8383 7.8089 0.7617 -1.517369      1.989873  
1 1 1 9  3  19 o 9.6815 0.7826 91.178   12.531  116.989   28.050  84.742    14.007  10.305 1.3610 9.0581 0.7732 1.246768       1.565296  
1 1 1 9  3  20 o 12.331 0.7250 158.005  14.897  168.981   31.640  154.878   16.886  12.395 1.2764 12.268 0.6882 0.1266222      1.450072  
1 1 1 9  3  21 o 4.4521 1.1720 14.131   13.360  37.702    24.859  4.5581    15.843  5.5797 1.8804 3.3245 1.3995 2.255232       2.344015  
1 1 1 9  3  22 o 20.504 0.7214 434.403  27.791  472.673   49.189  416.460   33.681  20.979 1.1724 20.030 0.8408 0.9488392      1.442701  
1 1 1 9  3  23 o 6.3724 1.2109 53.405   16.437  29.098    29.548  64.298    19.781  5.1871 2.0049 7.5578 1.3586 -2.370703      2.421840  
1 1 1 9  3  24 o 7.6912 1.0935 66.357   16.502  94.980    24.918  43.997    22.024  9.3184 1.3371 6.0640 1.7307 3.254385       2.187002  
1 1 1 9  3  25 o 3.8623 1.1532 7.4470   15.271  3.5745    23.422  10.310    20.141  3.8130 1.6551 3.9115 1.6063 -0.9852076E-01 2.306414  
1 1 1 9  3  26 o 4.6420 1.2546 22.757   16.170  20.793    25.007  24.168    21.197  4.6047 1.8251 4.6792 1.7220 -0.7450962E-01 2.509282  
1 1 1 9  3  27 o 3.4295 1.0914 -5.1126  15.906  6.5247    23.447  -15.0340  21.650  3.8509 1.6638 3.0081 1.4130 0.8427835      2.182853  
1 1 1 9  3  28 o 5.6814 1.2967 44.643   18.018  26.444    26.567  60.145    24.519  4.6733 1.8717 6.6895 1.7952 -2.016170      2.593460  
1 1 1 9  3  29 o 5.6923 1.3298 49.633   19.255  27.698    27.761  69.968    26.729  4.5184 1.8736 6.8661 1.8878 -2.347620      2.659690  
1 1 1 9  3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  3  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  4  0  o 11.411 0.7745 134.262  17.291  139.552   24.558  129.063   24.348  11.646 1.0755 11.176 1.1148 -0.000000      0.000000  
1 1 1 9  4  1  o 12.233 0.5245 150.202  12.830  154.409   18.185  146.033   18.103  12.405 0.7330 12.062 0.7504 0.3421450      1.048984  
1 1 1 9  4  2  o 38.910 0.5580 1520.23  43.425  1533.73   61.474  1506.79   61.350  39.083 0.7865 38.737 0.7919 0.3459473      1.116067  
1 1 1 9  4  3  o 30.215 0.5205 916.455  31.451  915.578   44.533  917.329   44.425  30.200 0.7373 30.230 0.7348 -0.2925873E-01 1.040917  
1 1 1 9  4  4  o 38.878 0.5591 1518.16  43.470  1514.67   61.498  1521.65   61.453  38.834 0.7918 38.923 0.7894 -0.8977509E-01 1.118101  
1 1 1 9  4  5  o 15.747 0.5055 248.776  15.919  252.717   22.504  244.828   22.523  15.872 0.7089 15.622 0.7209 0.2505274      1.011073  
1 1 1 9  4  6  o 27.055 0.5121 734.183  27.708  728.578   39.242  739.757   39.128  26.951 0.7280 27.158 0.7204 -0.2068424     1.024184  
1 1 1 9  4  7  o 26.607 0.5119 710.339  27.235  696.077   38.477  724.658   38.555  26.339 0.7304 26.876 0.7173 -0.5369034     1.023729  
1 1 1 9  4  8  o 27.151 0.6310 735.391  32.323  758.997   56.323  723.799   39.469  27.449 1.0260 26.853 0.7349 0.5962353      1.262010  
1 1 1 9  4  9  o 10.122 0.5764 103.029  11.668  100.871   16.442  105.219   16.561  10.015 0.8209 10.229 0.8095 -0.2143612     1.152846  
1 1 1 9  4  10 o 10.958 0.5725 121.350  12.476  107.167   17.706  135.336   17.583  10.315 0.8583 11.601 0.7578 -1.285769      1.144937  
1 1 1 9  4  11 o 18.142 0.5151 330.806  18.684  338.940   26.766  323.076   26.095  18.359 0.7290 17.924 0.7279 0.4346371      1.030158  
1 1 1 9  4  12 o 23.246 0.5995 546.875  24.042  545.976   48.243  547.172   27.732  23.167 1.0412 23.326 0.5944 -0.1594543     1.198950  
1 1 1 9  4  13 o 12.274 0.6810 156.083  13.891  148.472   28.999  158.349   15.824  12.014 1.2069 12.535 0.6312 -0.5209103     1.362017  
1 1 1 9  4  14 o 5.6928 0.9313 43.595   9.4846  14.351    21.660  50.533    10.550  4.3399 1.7054 7.0456 0.7487 -2.705666      1.862525  
1 1 1 9  4  15 o 15.731 0.6531 264.603  17.283  232.747   34.654  275.151   19.941  14.963 1.1579 16.499 0.6043 -1.535739      1.306143  
1 1 1 9  4  16 o 7.2299 0.9900 74.650   11.210  28.654    24.440  86.906    12.616  5.2166 1.8586 9.2433 0.6824 -4.026681      1.979910  
1 1 1 9  4  17 o 7.4282 0.9578 61.689   10.477  58.386    24.864  62.403    11.553  7.0495 1.7669 7.8069 0.7399 -0.7574153     1.915619  
1 1 1 9  4  18 f 12.693 0.6732 162.777  14.277  179.551   30.544  158.087   16.150  12.946 1.1797 12.440 0.6491 0.5061789      1.346479  
1 1 1 9  4  19 o 7.8241 0.9588 65.740   11.066  71.699    26.568  64.490    12.172  7.7410 1.7563 7.9071 0.7697 -0.1661410     1.917587  
1 1 1 9  4  20 o 14.730 0.7121 228.618  16.931  231.802   37.037  227.777   19.037  14.546 1.2731 14.914 0.6382 -0.3682909     1.424117  
1 1 1 9  4  21 o 11.934 0.8613 144.835  19.128  178.737   35.323  130.768   22.752  12.736 1.3867 11.131 1.0220 1.604468       1.722640  
1 1 1 9  4  22 o 13.788 0.8399 206.417  21.297  201.275   37.981  208.775   25.721  13.453 1.4116 14.123 0.9106 -0.6703978     1.679839  
1 1 1 9  4  23 o 10.337 1.0922 126.052  19.235  106.422   35.001  134.545   23.023  9.3657 1.9327 11.308 1.0180 -1.941849      2.184398  
1 1 1 9  4  24 o 4.1500 1.1735 13.325   15.065  3.9905    23.477  19.859    19.642  3.8571 1.6657 4.4430 1.6534 -0.5858927     2.346919  
1 1 1 9  4  25 o 7.1734 1.1771 59.364   16.574  77.517    25.523  46.128    21.794  8.1428 1.6242 6.2040 1.7042 1.938755       2.354160  
1 1 1 9  4  26 o 4.6604 1.2712 23.098   16.823  18.728    25.886  26.293    22.134  4.5159 1.8338 4.8048 1.7610 -0.2888608     2.542429  
1 1 1 9  4  27 o 3.7108 1.1483 1.6524   16.482  14.302    24.398  -8.9645   22.353  4.1985 1.7500 3.2230 1.4873 0.9755213      2.296584  
1 1 1 9  4  28 o 4.2426 1.2073 12.738   17.555  43.523    26.201  -12.3356  23.647  5.3972 1.9242 3.0880 1.4586 2.309147       2.414581  
1 1 1 9  4  29 o 3.4375 1.1242 -1.4811  18.054  6.3162    27.273  -7.5629   24.087  3.7028 1.6837 3.1721 1.4902 0.5306373      2.248456  
1 1 1 9  4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  5  0  o 40.015 0.7988 1612.19  63.810  1622.09   90.600  1602.45   89.887  40.137 1.1307 39.893 1.1286 -0.000000      0.000000  
1 1 1 9  5  1  f 35.859 0.5424 1291.19  38.902  1280.90   54.972  1301.52   55.060  35.715 0.7696 36.003 0.7647 -0.2872887     1.084883  
1 1 1 9  5  2  o 30.655 0.5202 943.162  31.893  931.886   45.026  954.516   45.181  30.470 0.7388 30.839 0.7325 -0.3687382     1.040426  
1 1 1 9  5  3  o 20.053 0.4970 403.394  19.932  407.004   28.161  399.770   28.215  20.143 0.6990 19.962 0.7067 0.1804981      0.9940069 
1 1 1 9  5  4  o 20.082 0.4963 404.434  19.933  401.601   28.094  407.306   28.286  20.011 0.7020 20.152 0.7018 -0.1416531     0.9926177 
1 1 1 9  5  5  o 29.394 0.5177 866.636  30.432  870.205   43.174  863.113   42.903  29.454 0.7329 29.334 0.7313 0.1200714      1.035357  
1 1 1 9  5  6  o 23.509 0.5045 554.424  23.718  569.218   33.756  539.999   33.332  23.819 0.7086 23.199 0.7184 0.6204548      1.009060  
1 1 1 9  5  7  o 29.530 0.5213 875.371  30.785  865.812   43.625  884.854   43.450  29.368 0.7427 29.691 0.7317 -0.3228664     1.042605  
1 1 1 9  5  8  o 15.715 0.6022 247.079  18.250  243.395   22.869  253.539   30.282  15.567 0.7345 15.864 0.9544 -0.2970476     1.204366  
1 1 1 9  5  9  o 11.500 0.5498 132.969  12.633  140.902   18.048  125.347   17.689  11.837 0.7623 11.162 0.7923 0.6749763      1.099514  
1 1 1 9  5  10 o 11.257 0.5705 128.447  12.754  115.547   18.485  140.165   17.619  10.709 0.8631 11.806 0.7462 -1.096938      1.140924  
1 1 1 9  5  11 o 28.862 0.6603 840.203  35.778  835.235   43.595  850.452   62.618  28.789 0.7571 28.935 1.0820 -0.1457329     1.320635  
1 1 1 9  5  12 o 12.067 0.5610 147.335  13.539  149.238   19.327  145.501   18.972  12.143 0.7958 11.991 0.7911 0.1521883      1.122082  
1 1 1 9  5  13 o 31.407 0.5469 1001.80  34.338  976.831   48.889  1026.11   48.241  31.012 0.7882 31.803 0.7584 -0.7908669     1.093853  
1 1 1 9  5  14 o 8.8608 0.7587 80.431   11.060  83.147    23.826  79.684    12.487  8.8653 1.3438 8.8563 0.7050 0.9071350E-02  1.517487  
1 1 1 9  5  15 o 4.6304 0.8599 28.528   8.7762  -6.6079   21.362  35.663    9.6262  3.3642 1.5137 5.8966 0.8162 -2.532425      1.719745  
1 1 1 9  5  16 o 5.4357 0.9671 33.301   8.9934  28.830    21.073  34.296    9.9445  5.1067 1.7312 5.7648 0.8625 -0.6580634     1.934208  
1 1 1 9  5  17 o 8.6771 0.7343 77.101   12.743  0.0000    0.0000  77.101    12.743  ?      ?      8.6771 0.7343 ?              ?         
1 1 1 9  5  18 f 4.2619 0.9817 21.116   8.8019  5.2830    23.093  23.807    9.5206  3.8661 1.6606 4.6578 1.0474 -0.7917604     1.963358  
1 1 1 9  5  19 o 9.7045 0.9043 104.852  12.606  101.732   29.902  105.526   13.902  9.2747 1.6736 10.134 0.6859 -0.8595896     1.808692  
1 1 1 9  5  20 o 7.9906 1.0203 70.044   11.280  76.317    29.375  68.959    12.217  7.8117 1.8987 8.1694 0.7477 -0.3576398     2.040638  
1 1 1 9  5  21 o 7.8242 1.0856 82.706   11.581  51.007    30.007  88.254    12.554  6.3655 2.0631 9.2829 0.6762 -2.917374      2.171126  
1 1 1 9  5  22 o 15.893 0.7825 266.302  23.224  283.703   41.313  258.262   28.081  16.080 1.2846 15.705 0.8940 0.3750343      1.565066  
1 1 1 9  5  23 o 4.8237 1.2134 24.098   14.452  31.648    23.279  19.363    18.434  5.2674 1.8187 4.3801 1.6068 0.8872600      2.426836  
1 1 1 9  5  24 o 4.5991 1.2320 21.294   15.517  19.490    23.752  22.637    20.495  4.5661 1.7884 4.6321 1.6950 -0.6599379E-01 2.464040  
1 1 1 9  5  25 o 15.425 0.7552 255.393  22.913  225.262   34.180  279.984   30.878  14.492 1.1792 16.357 0.9439 -1.864647      1.510458  
1 1 1 9  5  26 o 4.8968 1.2830 27.621   16.523  27.573    26.011  27.653    21.393  4.9305 1.8874 4.8631 1.7382 0.6744432E-01  2.565906  
1 1 1 9  5  27 o 5.5238 1.3352 39.501   17.788  50.400    26.877  31.005    23.729  6.0718 1.9510 4.9758 1.8234 1.096011       2.670398  
1 1 1 9  5  28 f 5.6436 1.3435 48.872   19.002  33.422    28.971  60.537    25.172  4.8245 1.9467 6.4628 1.8521 -1.638349      2.686979  
1 1 1 9  5  29 o 7.7266 1.2335 93.555   20.713  49.796    30.783  129.755   27.999  5.2942 2.0464 10.159 1.3780 -4.864773      2.467096  
1 1 1 9  5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  6  0  o 23.660 0.7159 564.745  33.725  551.736   47.906  577.527   47.486  23.385 1.0288 23.935 0.9959 -0.000000      0.000000  
1 1 1 9  6  1  o 24.723 0.5015 613.004  24.794  628.573   35.208  597.687   34.921  25.035 0.7032 24.411 0.7153 0.6240559      1.003026  
1 1 1 9  6  2  o 4.6611 0.8514 22.679   8.0025  24.662    11.503  20.820    11.140  4.8509 1.1938 4.4712 1.2144 0.3797102      1.702852  
1 1 1 9  6  3  f 21.694 0.4995 472.016  21.671  472.898   30.580  471.125   30.714  21.715 0.7041 21.674 0.7086 0.4113197E-01  0.9989181 
1 1 1 9  6  4  o 25.093 0.5062 631.737  25.400  645.419   35.962  618.119   35.879  25.365 0.7089 24.822 0.7227 0.5437737      1.012361  
1 1 1 9  6  5  o 28.506 0.5149 815.469  29.355  803.336   41.408  827.727   41.622  28.292 0.7318 28.719 0.7246 -0.4272957     1.029863  
1 1 1 9  6  6  o 18.217 0.5903 326.773  20.640  310.713   25.520  357.148   35.097  17.594 0.7252 18.840 0.9315 -1.245844      1.180503  
1 1 1 9  6  7  o 17.793 0.5024 318.153  17.863  304.531   25.338  331.614   25.187  17.412 0.7276 18.174 0.6930 -0.7615070     1.004767  
1 1 1 9  6  8  o 47.304 0.6078 2253.38  57.498  2272.63   81.543  2234.33   81.088  47.506 0.8582 47.103 0.8608 0.4029274      1.215525  
1 1 1 9  6  9  o 10.392 0.5743 108.888  11.912  105.530   17.244  111.954   16.474  10.236 0.8423 10.549 0.7809 -0.3121901     1.148592  
1 1 1 9  6  10 o 16.250 0.5234 265.568  17.002  275.499   24.461  256.286   23.649  16.543 0.7393 15.956 0.7411 0.5875340      1.046771  
1 1 1 9  6  11 o 9.9344 0.5982 100.095  11.861  92.889    16.774  107.301   16.774  9.5717 0.8762 10.297 0.8145 -0.7253695     1.196303  
1 1 1 9  6  12 o 13.044 0.5646 172.380  14.726  175.868   21.024  169.020   20.633  13.173 0.7980 12.914 0.7989 0.2592382      1.129167  
1 1 1 9  6  13 o 11.084 0.5978 126.171  13.176  142.093   18.689  110.440   18.577  11.797 0.7921 10.371 0.8956 1.426246       1.195636  
1 1 1 9  6  14 o 16.380 0.5423 273.526  17.741  260.778   25.334  285.795   24.853  15.996 0.7919 16.765 0.7412 -0.7692795     1.084682  
1 1 1 9  6  15 f 9.5725 0.6375 94.838   12.139  87.988    17.658  100.978   16.716  9.2255 0.9570 9.9196 0.8426 -0.6941442     1.275070  
1 1 1 9  6  16 o 5.4751 0.8842 33.606   9.7919  23.220    14.481  42.354    13.291  4.5923 1.4266 6.3579 1.0452 -1.765518      1.768496  
1 1 1 9  6  17 o 9.2122 0.7835 78.466   11.490  111.151   27.657  71.648    12.632  10.079 1.3720 8.3457 0.7568 1.733000       1.566907  
1 1 1 9  6  18 o 3.2841 0.8966 9.5919   7.7858  -22.0813  23.487  13.502    8.2524  3.0274 1.4369 3.5409 1.0727 -0.5135622     1.793178  
1 1 1 9  6  19 o 9.6345 0.9599 114.123  13.117  86.534    29.327  121.023   14.666  8.4164 1.7969 10.853 0.6757 -2.436154      1.919760  
1 1 1 9  6  20 o 10.756 0.8019 112.144  13.370  144.131   32.576  105.665   14.661  11.379 1.4314 10.134 0.7234 1.244835       1.603836  
1 1 1 9  6  21 o 9.0284 1.0155 100.296  12.686  77.413    29.912  105.314   14.008  7.9244 1.9098 10.132 0.6912 -2.207949      2.031023  
1 1 1 9  6  22 o 10.310 1.0804 123.244  19.270  114.086   35.212  127.159   23.024  9.6751 1.8875 10.945 1.0518 -1.269867      2.160750  
1 1 1 9  6  23 o 13.253 0.7542 187.248  19.662  178.877   30.211  193.399   25.897  12.919 1.1693 13.587 0.9530 -0.6676846     1.508444  
1 1 1 9  6  24 o 6.4302 1.2185 51.722   16.634  34.556    25.666  64.152    21.841  5.4097 1.9071 7.4506 1.5172 -2.040906      2.436998  
1 1 1 9  6  25 o 7.0201 1.2335 58.686   16.856  67.093    27.473  53.611    21.347  7.3322 1.8681 6.7079 1.6113 0.6242943      2.467043  
1 1 1 9  6  26 o 4.5955 1.2757 21.049   16.722  28.916    27.136  16.232    21.233  4.9976 1.9242 4.1933 1.6755 0.8042831      2.551426  
1 1 1 9  6  27 o 6.8131 1.3131 64.626   18.987  48.789    29.423  75.926    24.854  5.8534 2.0433 7.7727 1.6498 -1.919226      2.626251  
1 1 1 9  6  28 o 3.5748 1.1486 0.0015   17.771  13.124    27.329  -9.6124   23.392  4.0145 1.7642 3.1352 1.4714 0.8793166      2.297284  
1 1 1 9  6  29 o 3.3929 1.1222 -2.4250  18.624  11.731    28.886  -12.4965  24.365  3.7908 1.7272 2.9949 1.4332 0.7958450      2.244403  
1 1 1 9  6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  7  0  o 69.553 1.0641 4879.19  147.820 4709.51   208.085 5052.05   210.027 68.323 1.5245 70.783 1.4851 -0.000000      0.000000  
1 1 1 9  7  1  o 18.775 0.4949 353.778  18.574  342.924   26.347  364.502   26.188  18.488 0.7126 19.063 0.6869 -0.5749855     0.9897222 
1 1 1 9  7  2  o 10.488 0.5505 110.291  11.538  104.823   16.019  116.185   16.631  10.218 0.7839 10.758 0.7730 -0.5401316     1.100930  
1 1 1 9  7  3  o 29.018 0.5157 845.133  29.931  840.486   42.376  849.760   42.282  28.938 0.7322 29.098 0.7265 -0.1600151     1.031485  
1 1 1 9  7  4  o 31.079 0.6391 976.676  37.581  987.815   46.341  955.277   64.231  31.369 0.7387 30.789 1.0431 0.5799160      1.278141  
1 1 1 9  7  5  o 9.9384 0.5749 99.611   11.369  88.229    16.086  110.971   16.070  9.3663 0.8587 10.511 0.7645 -1.144199      1.149709  
1 1 1 9  7  6  o 19.093 0.5029 366.153  19.201  369.471   27.180  362.846   27.130  19.180 0.7086 19.006 0.7137 0.1733227      1.005712  
1 1 1 9  7  7  o 4.6397 0.8945 22.718   8.5326  20.288    12.870  24.623    11.397  4.4447 1.3381 4.8347 1.1874 -0.3899589     1.788942  
1 1 1 9  7  8  o 18.360 0.5140 338.806  18.872  343.760   26.994  334.070   26.395  18.491 0.7299 18.229 0.7240 0.2616768      1.028055  
1 1 1 9  7  9  o 17.628 0.5181 312.810  18.253  327.667   25.913  298.177   25.716  18.046 0.7180 17.211 0.7471 0.8355808      1.036157  
1 1 1 9  7  10 o 7.8302 0.7019 63.181   10.773  77.153    15.202  49.090    15.267  8.7264 0.8711 6.9340 1.1009 1.792488       1.403841  
1 1 1 9  7  11 o 21.133 0.5244 451.468  22.152  471.558   31.520  431.861   31.139  21.601 0.7296 20.664 0.7534 0.9364033      1.048803  
1 1 1 9  7  12 o 11.597 0.5847 137.759  13.507  125.547   19.266  149.564   18.942  11.077 0.8697 12.116 0.7816 -1.039650      1.169318  
1 1 1 9  7  13 f 23.263 0.5285 549.853  24.589  558.442   35.089  541.566   34.466  23.441 0.7485 23.085 0.7465 0.3559532      1.057090  
1 1 1 9  7  14 o 9.7561 0.6525 99.052   12.596  83.565    17.917  114.183   17.710  8.9696 0.9988 10.542 0.8400 -1.572833      1.305016  
1 1 1 9  7  15 o 8.0841 0.6933 68.197   10.964  87.386    15.980  51.129    15.071  9.1957 0.8689 6.9725 1.0807 2.223171       1.386680  
1 1 1 9  7  16 o 5.0230 0.9390 27.605   9.5142  32.911    14.686  23.767    12.490  5.4166 1.3581 4.6295 1.2970 0.7871203      1.878004  
1 1 1 9  7  17 o 2.5535 0.8053 -2.9760  8.1780  -2.2205   12.957  -3.4762   10.543  2.7215 1.2045 2.3854 1.0691 0.3361857      1.610562  
1 1 1 9  7  18 o 5.2209 0.9027 31.601   9.3635  25.598    14.574  35.820    12.219  4.7347 1.4236 5.7071 1.1105 -0.9724169     1.805468  
1 1 1 9  7  19 o 17.141 0.7759 358.878  20.211  239.507   41.986  394.881   23.058  14.610 1.4369 19.673 0.5860 -5.062846      1.551798  
1 1 1 9  7  20 o 7.9883 1.0925 99.419   12.534  34.926    31.435  111.609   13.667  5.5290 2.0848 10.448 0.6541 -4.918709      2.185036  
1 1 1 9  7  21 o 5.9513 1.0865 44.778   10.478  29.540    29.634  46.955    11.202  5.1841 2.0067 6.7184 0.8337 -1.534281      2.172974  
1 1 1 9  7  22 o 4.4740 1.1916 9.5498   9.2085  44.096    30.831  6.1662    9.6490  6.0269 2.0924 2.9210 1.1410 3.105893       2.383260  
1 1 1 9  7  23 o 9.7268 1.0158 110.369  18.035  83.599    28.151  129.007   23.489  8.4126 1.7309 11.041 1.0637 -2.628232      2.031613  
1 1 1 9  7  24 o 5.4368 1.2434 35.078   16.897  14.102    26.269  49.882    22.069  4.4114 1.8253 6.4622 1.6888 -2.050760      2.486707  
1 1 1 9  7  25 o 6.1480 1.2881 48.379   17.022  41.871    27.506  52.418    21.671  5.7308 1.9771 6.5652 1.6518 -0.8344584     2.576285  
1 1 1 9  7  26 o 4.9585 1.2972 29.438   16.787  28.575    27.592  29.945    21.153  4.9543 1.9311 4.9626 1.7325 -0.8360863E-02 2.594399  
1 1 1 9  7  27 o 8.4931 1.2028 96.503   19.510  83.010    30.606  105.738   25.321  7.5405 1.9976 9.4457 1.3403 -1.905181      2.405582  
1 1 1 9  7  28 o 5.7686 1.3939 49.503   19.946  79.708    31.619  29.538    25.707  6.9701 2.0971 4.5672 1.8369 2.402825       2.787864  
1 1 1 9  7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  7  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  8  0  o 8.4434 0.9692 77.497   14.909  72.838    21.891  81.527    20.360  8.1280 1.4961 8.7588 1.2324 -0.000000      0.000000  
1 1 1 9  8  1  o 16.316 0.5045 267.223  16.462  266.203   23.227  268.252   23.334  16.285 0.7131 16.348 0.7137 -0.6252289E-01 1.008918  
1 1 1 9  8  2  f 16.671 0.5071 279.364  16.882  295.341   23.775  263.117   23.975  17.154 0.6930 16.187 0.7406 0.9670277      1.014216  
1 1 1 9  8  3  o 12.130 0.5370 147.921  13.020  152.605   18.325  143.145   18.502  12.326 0.7434 11.935 0.7751 0.3904791      1.073948  
1 1 1 9  8  4  o 20.932 0.5049 440.238  21.130  427.508   29.957  452.841   29.808  20.629 0.7261 21.234 0.7019 -0.6056080     1.009867  
1 1 1 9  8  5  o 26.606 0.5135 711.385  27.325  713.721   38.827  709.093   38.462  26.649 0.7285 26.563 0.7240 0.8574104E-01  1.027048  
1 1 1 9  8  6  o 10.776 0.5768 117.257  12.387  110.984   17.970  122.936   17.097  10.497 0.8560 11.055 0.7733 -0.5580578     1.153531  
1 1 1 9  8  7  o 19.753 0.5106 392.304  20.170  386.509   28.505  398.115   28.543  19.607 0.7269 19.900 0.7172 -0.2936554     1.021147  
1 1 1 9  8  8  o 15.216 0.5330 233.810  16.164  254.206   22.760  213.056   22.959  15.892 0.7161 14.539 0.7896 1.353168       1.065919  
1 1 1 9  8  9  o 22.604 0.5181 515.771  23.420  525.820   33.175  505.789   33.065  22.825 0.7267 22.383 0.7386 0.4423695      1.036206  
1 1 1 9  8  10 o 13.819 0.7301 187.940  18.537  177.838   21.950  213.059   34.612  13.246 0.8286 14.392 1.2025 -1.146080      1.460279  
1 1 1 9  8  11 o 15.135 0.5461 233.019  16.524  225.158   23.279  241.001   23.459  14.874 0.7826 15.395 0.7619 -0.5214128     1.092188  
1 1 1 9  8  12 o 23.630 0.5257 567.636  24.830  593.648   35.539  542.828   34.706  24.163 0.7354 23.097 0.7513 1.065725       1.051325  
1 1 1 9  8  13 o 3.8913 0.9142 15.172   8.6919  8.1574    12.676  21.397    11.941  3.3511 1.3082 4.4316 1.2773 -1.080477      1.828339  
1 1 1 9  8  14 o 15.040 0.5616 231.917  16.891  233.438   24.070  230.442   23.708  15.087 0.7977 14.994 0.7906 0.9381580E-01  1.123108  
1 1 1 9  8  15 o 5.0205 0.9227 27.622   9.4157  34.394    13.977  21.995    12.740  5.5695 1.2814 4.4714 1.3280 1.098124       1.845436  
1 1 1 9  8  16 o 4.3659 0.8912 19.662   8.5109  31.083    13.195  11.526    11.137  5.2641 1.2683 3.4677 1.2525 1.796352       1.782495  
1 1 1 9  8  17 o 12.235 0.5967 155.487  14.585  152.357   21.006  158.400   20.267  12.104 0.8678 12.367 0.8194 -0.2635231     1.193489  
1 1 1 9  8  18 o 4.6852 0.9020 21.088   9.4780  43.048    15.332  7.5062    12.058  6.1723 1.2838 3.1982 1.2674 2.974062       1.804067  
1 1 1 9  8  19 o 12.654 0.6098 165.949  15.386  176.935   22.889  156.891   20.783  13.025 0.8786 12.284 0.8460 0.7415047      1.219679  
1 1 1 9  8  20 o 3.8050 0.9769 14.043   9.3507  15.244    15.434  13.347    11.753  3.9620 1.4674 3.6479 1.2900 0.3141055      1.953789  
1 1 1 9  8  21 o 3.2507 1.0524 -3.7842  7.8454  14.671    29.030  -5.2384   8.1487  4.5314 1.9003 1.9700 0.9050 2.561497       2.104800  
1 1 1 9  8  22 o 8.2862 1.0564 78.117   12.396  76.291    30.777  78.471    13.544  7.8491 1.9650 8.7234 0.7763 -0.8742743     2.112799  
1 1 1 9  8  23 o 4.3388 1.2033 13.572   15.065  29.311    24.915  4.5025    18.914  5.1167 1.8694 3.5609 1.5155 1.555764       2.406527  
1 1 1 9  8  24 o 19.631 0.6714 403.942  26.218  405.381   39.130  402.769   35.319  19.615 0.9974 19.646 0.8989 -0.3077698E-01 1.342706  
1 1 1 9  8  25 o 4.2411 1.2459 12.706   17.099  22.015    27.290  6.6901    21.939  4.6922 1.8907 3.7900 1.6230 0.9021957      2.491801  
1 1 1 9  8  26 o 7.8007 1.2455 76.878   18.720  84.647    29.412  71.588    24.270  8.0278 1.8671 7.5737 1.6490 0.4540448      2.491071  
1 1 1 9  8  27 o 5.4367 1.3860 45.127   19.106  47.721    29.852  43.328    24.865  5.4750 2.0381 5.3984 1.8788 0.7665825E-01  2.771948  
1 1 1 9  8  28 o 3.8964 1.1785 14.724   17.586  -7.0636   28.948  27.470    22.140  3.3896 1.6049 4.4031 1.7261 -1.013479      2.356954  
1 1 1 9  8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  9  0  o 2.9034 1.1770 9.7039   11.212  16.409    16.174  3.5021    15.555  3.3516 1.7831 2.4551 1.5367 -0.000000      0.000000  
1 1 1 9  9  1  o 13.016 0.5290 170.327  13.768  166.140   19.465  174.518   19.475  12.856 0.7571 13.177 0.7390 -0.3217945     1.057941  
1 1 1 9  9  2  o 20.088 0.5043 405.493  20.257  417.070   28.722  394.036   28.573  20.374 0.7049 19.802 0.7215 0.5728321      1.008636  
1 1 1 9  9  3  o 7.1806 0.6949 52.350   9.9094  45.863    14.142  58.609    13.890  6.7362 1.0497 7.6250 0.9108 -0.8887291     1.389745  
1 1 1 9  9  4  o 3.0084 0.7371 0.8917   7.4139  -20.2371  11.102  17.897    9.9602  1.8729 0.9132 4.1438 1.1573 -2.270910      1.474206  
1 1 1 9  9  5  o 27.778 0.5195 775.846  28.854  799.010   40.964  753.038   40.649  28.191 0.7265 27.365 0.7427 0.8263054      1.038991  
1 1 1 9  9  6  o 17.536 0.5190 309.349  18.203  308.795   25.713  309.906   25.773  17.520 0.7338 17.551 0.7342 -0.3143311E-01 1.038072  
1 1 1 9  9  7  o 21.548 0.5180 467.918  22.310  447.645   31.354  488.712   31.753  21.072 0.7440 22.023 0.7209 -0.9508076     1.035947  
1 1 1 9  9  8  o 3.8016 0.9055 13.546   8.3804  18.899    11.908  8.2928    11.796  4.2606 1.2881 3.3425 1.2731 0.9180133      1.811061  
1 1 1 9  9  9  o 5.3091 0.8952 30.043   9.3582  32.924    13.802  27.592    12.731  5.5433 1.2719 5.0750 1.2601 0.4683595      1.790456  
1 1 1 9  9  10 o 14.437 0.5610 212.382  16.189  207.337   23.117  217.237   22.679  14.263 0.8104 14.611 0.7761 -0.3479357     1.122062  
1 1 1 9  9  11 o 9.5873 0.6310 94.262   12.087  93.581    17.450  94.890    16.760  9.5483 0.9138 9.6263 0.8705 -0.7799149E-01 1.262040  
1 1 1 9  9  12 o 5.9898 0.8900 40.098   10.556  24.843    15.351  53.781    14.539  4.7749 1.4664 7.2048 1.0090 -2.429882      1.779987  
1 1 1 9  9  13 o 6.3634 0.8829 44.269   10.925  36.555    15.962  51.068    14.986  5.7304 1.4038 6.9965 1.0710 -1.266086      1.765706  
1 1 1 9  9  14 o 14.770 0.5739 224.487  16.949  221.586   24.146  227.304   23.796  14.670 0.8230 14.869 0.8002 -0.1997805     1.147854  
1 1 1 9  9  15 o 2.7139 0.8322 -2.9101  8.8571  -12.3702  12.754  5.9010    12.309  2.2883 1.0779 3.1395 1.2681 -0.8512168     1.664358  
1 1 1 9  9  16 o 5.2262 0.9239 31.174   9.6228  28.444    14.486  33.329    12.874  4.9874 1.3967 5.4650 1.2098 -0.4776216     1.847803  
1 1 1 9  9  17 o 10.786 0.6584 125.100  13.792  95.226    19.936  152.520   19.099  9.4463 1.0552 12.125 0.7876 -2.678851      1.316743  
1 1 1 9  9  18 o 6.7307 0.8403 52.385   10.567  34.462    15.703  67.219    14.286  5.4500 1.4247 8.0114 0.8916 -2.561401      1.680671  
1 1 1 9  9  19 o 3.6647 0.9139 13.343   8.6959  5.8886    13.776  18.281    11.212  3.2482 1.3305 4.0813 1.2532 -0.8331211     1.827756  
1 1 1 9  9  20 o 9.6849 0.7079 102.391  13.199  81.520    20.067  118.305   17.522  8.6995 1.1533 10.670 0.8211 -1.970708      1.415740  
1 1 1 9  9  21 f 8.6517 0.7969 81.330   13.410  63.960    19.626  96.544    18.367  7.6931 1.2755 9.6104 0.9556 -1.917363      1.593791  
1 1 1 9  9  22 o 4.9644 0.7851 16.360   9.2719  58.903    16.544  -3.1207   11.195  7.4417 1.1116 2.4870 1.1091 4.954661       1.570250  
1 1 1 9  9  23 o 10.551 0.8955 121.193  18.440  121.212   29.328  121.181   23.714  10.454 1.4027 10.648 1.1135 -0.1941833     1.790968  
1 1 1 9  9  24 f 20.207 0.6941 438.596  27.594  392.877   41.381  475.204   37.029  19.122 1.0820 21.293 0.8695 -2.171328      1.388109  
1 1 1 9  9  25 o 6.0467 1.2537 48.536   17.838  23.461    28.106  65.447    23.082  4.7515 1.9173 7.3420 1.6157 -2.590569      2.507342  
1 1 1 9  9  26 o 12.363 0.9173 175.092  22.309  179.661   34.826  171.913   29.052  12.353 1.4096 12.373 1.1741 -0.1949406E-01 1.834501  
1 1 1 9  9  27 o 4.8858 1.2907 34.485   18.646  12.836    30.583  47.294    23.524  4.0819 1.8258 5.6897 1.8249 -1.607838      2.581439  
1 1 1 9  9  28 o 3.2631 1.0894 -4.6324  17.690  2.7382    29.676  -8.6952   22.033  3.5702 1.6698 2.9559 1.3997 0.6143067      2.178859  
1 1 1 9  9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  10 0  o 12.598 0.8006 163.660  19.760  174.254   28.004  153.156   27.885  13.027 1.0925 12.170 1.1705 -0.000000      0.000000  
1 1 1 9  10 1  o 27.716 0.5207 771.906  28.830  823.117   41.311  723.286   40.253  28.614 0.7219 26.817 0.7505 1.797012       1.041304  
1 1 1 9  10 2  o 35.947 0.6679 1287.59  45.198  1352.76   79.391  1256.34   54.977  36.559 1.0858 35.335 0.7779 1.223934       1.335710  
1 1 1 9  10 3  o 19.420 0.5141 379.273  19.966  381.239   28.273  377.317   28.200  19.471 0.7260 19.370 0.7279 0.1006966      1.028122  
1 1 1 9  10 4  o 25.638 0.5164 661.452  26.479  669.324   37.419  653.556   37.476  25.792 0.7254 25.484 0.7353 0.3077526      1.032897  
1 1 1 9  10 5  o 6.2247 0.8026 40.119   9.7802  37.996    13.827  42.245    13.836  6.0027 1.1937 6.4467 1.0731 -0.4439831     1.605156  
1 1 1 9  10 6  o 18.821 0.5286 357.770  19.887  343.940   28.090  371.668   28.159  18.453 0.7611 19.189 0.7337 -0.7361717     1.057216  
1 1 1 9  10 7  o 12.682 0.5777 162.924  14.644  169.768   20.794  156.189   20.627  12.949 0.8029 12.415 0.8307 0.5340548      1.155332  
1 1 1 9  10 8  o 6.7025 0.7662 46.092   10.271  46.418    14.570  45.769    14.481  6.7262 1.0831 6.6789 1.0841 0.4730177E-01  1.532457  
1 1 1 9  10 9  o 12.995 0.5834 172.429  15.002  207.019   21.748  141.027   20.722  14.258 0.7627 11.732 0.8831 2.525951       1.166869  
1 1 1 9  10 10 o 10.584 0.6435 116.212  13.440  97.853    19.405  133.138   18.633  9.7449 0.9956 11.423 0.8156 -1.677612      1.287055  
1 1 1 9  10 11 o 7.6336 0.7337 60.503   11.200  60.761    15.730  60.238    15.951  7.6528 1.0278 7.6144 1.0474 0.3834867E-01  1.467434  
1 1 1 9  10 12 o 7.8516 0.7506 64.496   11.701  72.958    16.531  55.997    16.566  8.3920 0.9849 7.3112 1.1329 1.080785       1.501194  
1 1 1 9  10 13 o 8.1607 0.7424 70.247   12.036  64.884    17.580  74.979    16.513  7.8390 1.1213 8.4823 0.9734 -0.6432657     1.484836  
1 1 1 9  10 14 o 10.747 0.6533 121.753  13.799  99.858    19.953  141.829   19.106  9.7622 1.0219 11.732 0.8142 -1.970253      1.306638  
1 1 1 9  10 15 o 12.790 0.6096 170.610  15.554  159.761   22.214  181.044   21.786  12.369 0.8980 13.211 0.8245 -0.8421497     1.219131  
1 1 1 9  10 16 o 7.2669 0.8488 58.253   11.822  46.023    16.727  70.459    16.710  6.3725 1.3542 8.1613 1.0237 -1.788846      1.697582  
1 1 1 9  10 17 o 5.9256 0.9076 39.829   10.429  37.581    15.269  41.795    14.278  5.7293 1.3540 6.1219 1.2091 -0.3925591     1.815235  
1 1 1 9  10 18 o 14.102 0.5984 206.985  16.824  190.225   23.936  223.348   23.651  13.512 0.8858 14.693 0.8049 -1.180858      1.196820  
1 1 1 9  10 19 o 6.1310 0.9066 43.101   10.886  31.186    16.219  52.868    14.685  5.1954 1.4860 7.0666 1.0390 -1.871186      1.813232  
1 1 1 9  10 20 o 10.740 0.6763 120.813  14.457  125.655   21.693  116.944   19.390  10.912 0.9940 10.568 0.9174 0.3438654      1.352688  
1 1 1 9  10 21 o 3.7717 0.9819 13.413   10.077  5.4744    16.141  18.484    12.900  3.4124 1.4229 4.1311 1.3535 -0.7187505     1.963818  
1 1 1 9  10 22 o 10.069 0.6868 106.606  13.815  105.059   19.930  108.037   19.169  9.9855 0.9979 10.153 0.9440 -0.1677780     1.373648  
1 1 1 9  10 23 o 12.071 1.0475 147.249  20.283  137.283   22.481  190.872   47.034  11.428 0.9836 12.714 1.8497 -1.285830      2.094931  
1 1 1 9  10 24 o 3.6745 1.1436 5.2397   14.103  10.323    15.292  -23.6722  36.470  3.5800 1.4246 3.7689 1.7894 -0.1888950     2.287241  
1 1 1 9  10 25 f 16.390 0.7704 297.087  24.747  270.096   37.684  317.555   32.815  15.564 1.2106 17.217 0.9530 -1.653282      1.540731  
1 1 1 9  10 26 o 5.0943 1.2796 38.462   19.020  8.1449    31.970  55.073    23.664  3.9904 1.8177 6.1983 1.8015 -2.207910      2.559202  
1 1 1 9  10 27 o 5.6057 1.4126 51.016   19.560  59.016    31.732  46.113    24.842  5.7838 2.1102 5.4276 1.8785 0.3561645      2.825192  
1 1 1 9  10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  10 33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  11 0  o 16.992 0.7581 295.098  25.465  281.089   36.661  308.159   35.398  16.582 1.1171 17.401 1.0253 -0.000000      0.000000  
1 1 1 9  11 1  o 12.416 0.5814 156.127  14.383  141.452   20.415  170.591   20.268  11.829 0.8629 13.003 0.7793 -1.174330      1.162757  
1 1 1 9  11 2  o 19.870 0.5236 398.223  20.802  383.857   29.291  412.843   29.547  19.507 0.7508 20.234 0.7301 -0.7278843     1.047268  
1 1 1 9  11 3  o 16.570 0.5399 277.353  17.887  285.673   25.277  269.009   25.315  16.822 0.7513 16.318 0.7757 0.5030975      1.079880  
1 1 1 9  11 4  o 20.158 0.6500 408.317  24.582  425.348   43.355  400.248   29.842  20.412 1.0620 19.903 0.7497 0.5092964      1.299934  
1 1 1 9  11 5  o 3.1137 0.9053 3.5712   9.0905  5.2961    12.568  1.6788    13.164  3.1961 1.2848 3.0313 1.2759 0.1648540      1.810677  
1 1 1 9  11 6  o 19.896 0.5329 400.543  21.196  385.302   29.854  416.034   30.098  19.510 0.7651 20.281 0.7420 -0.7704182     1.065806  
1 1 1 9  11 7  o 12.699 0.5874 164.278  14.919  163.926   21.182  164.624   21.015  12.684 0.8350 12.713 0.8265 -0.2937984E-01 1.174888  
1 1 1 9  11 8  f 7.5057 0.7359 58.404   11.042  56.543    15.645  60.250    15.586  7.3817 1.0597 7.6297 1.0214 -0.2479730     1.471806  
1 1 1 9  11 9  o 15.516 0.7284 243.383  20.500  236.994   24.204  259.596   38.556  15.257 0.7932 15.776 1.2220 -0.5189190     1.456895  
1 1 1 9  11 10 o 10.645 0.6422 116.844  13.670  118.492   19.521  115.259   19.149  10.718 0.9107 10.572 0.9056 0.1454134      1.284324  
1 1 1 9  11 11 o 7.3833 0.8112 59.434   11.289  44.042    16.321  73.553    15.631  6.3256 1.3322 8.4411 0.9259 -2.115528      1.622321  
1 1 1 9  11 12 o 7.6095 0.7639 60.902   11.620  63.501    16.542  58.369    16.325  7.7755 1.0637 7.4435 1.0966 0.3319998      1.527756  
1 1 1 9  11 13 f 4.6937 0.9852 23.937   10.081  31.402    14.894  17.625    13.696  5.2810 1.3908 4.1064 1.3957 1.174629       1.970357  
1 1 1 9  11 14 o 13.748 0.5973 196.341  16.422  196.811   23.133  195.864   23.318  13.768 0.8401 13.729 0.8492 0.3869057E-01  1.194558  
1 1 1 9  11 15 o 2.2880 0.7515 -11.6805 8.6530  -22.1690  12.601  -2.3211   11.903  1.9703 0.9633 2.6057 1.1538 -0.6354746     1.503059  
1 1 1 9  11 16 o 5.4724 0.9801 34.616   10.777  30.889    15.352  38.236    15.132  5.1590 1.4354 5.7858 1.3348 -0.6268048     1.960151  
1 1 1 9  11 17 o 14.900 0.5901 230.924  17.539  210.816   24.623  251.633   24.988  14.219 0.8658 15.581 0.8019 -1.361057      1.180122  
1 1 1 9  11 18 o 16.777 0.5717 291.260  19.176  290.854   27.442  291.648   26.807  16.758 0.8188 16.796 0.7980 -0.3734207E-01 1.143332  
1 1 1 9  11 19 o 5.0148 0.9865 29.501   10.429  22.844    15.929  34.496    13.798  4.5101 1.5053 5.5195 1.2755 -1.009373      1.973033  
1 1 1 9  11 20 o 7.8338 0.7776 64.574   12.097  68.449    18.417  61.634    16.043  8.0195 1.1483 7.6482 1.0488 0.3713136      1.555143  
1 1 1 9  11 21 o 7.6701 0.9080 68.574   12.793  43.781    19.137  88.604    17.201  6.1322 1.5574 9.2081 0.9340 -3.075967      1.816004  
1 1 1 9  11 22 o 8.3086 0.7517 73.437   12.415  72.167    18.485  74.479    16.756  8.2138 1.1252 8.4034 0.9970 -0.1895580     1.503386  
1 1 1 9  11 23 o 4.7756 1.3275 3.2078   15.031  -8.1373   16.365  64.414    38.011  2.7922 1.2826 6.7591 2.3245 -3.966928      2.654930  
1 1 1 9  11 24 o 4.6151 1.0850 26.344   15.157  40.712    16.231  -71.5332  42.364  5.8878 1.3990 3.3424 1.6587 2.545407       2.169944  
1 1 1 9  11 25 f 6.9798 1.4622 69.088   19.478  68.297    21.376  72.957    47.290  7.5075 1.4762 6.4522 2.5245 1.055297       2.924459  
1 1 1 9  11 26 o 4.6288 1.4042 22.118   17.202  18.273    18.411  48.532    48.250  3.9917 1.5711 5.2659 2.3278 -1.274172      2.808437  
1 1 1 9  11 27 o 4.5184 1.3159 26.536   18.924  55.329    31.619  10.466    23.621  5.4134 2.0789 3.6234 1.6138 1.790049       2.631762  
1 1 1 9  11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  12 0  o 13.153 0.8481 180.499  21.740  163.971   31.260  195.978   30.253  12.520 1.2790 13.786 1.1139 -0.000000      0.000000  
1 1 1 9  12 1  o 9.4400 0.6931 90.806   13.080  93.226    18.444  88.356    18.553  9.5695 0.9637 9.3105 0.9964 0.2589664      1.386144  
1 1 1 9  12 2  o 18.037 0.5394 329.023  19.456  325.857   27.311  332.287   27.725  17.949 0.7608 18.124 0.7649 -0.1751232     1.078785  
1 1 1 9  12 3  o 12.899 0.5789 168.588  14.914  181.150   21.372  156.664   20.822  13.372 0.7992 12.427 0.8378 0.9444885      1.157815  
1 1 1 9  12 4  o 9.3225 0.6830 88.839   12.733  86.482    17.912  91.247    18.104  9.1959 0.9739 9.4492 0.9580 -0.2533350     1.366085  
1 1 1 9  12 5  o 16.625 0.5476 281.600  18.109  245.570   25.354  319.119   25.872  15.522 0.8167 17.728 0.7297 -2.206208      1.095196  
1 1 1 9  12 6  o 13.188 0.7173 171.553  17.925  206.383   31.855  155.413   21.684  14.068 1.1322 12.308 0.8809 1.759813       1.434538  
1 1 1 9  12 7  o 14.648 0.5742 218.909  16.823  219.652   23.701  218.155   23.881  14.675 0.8075 14.622 0.8166 0.5333138E-01  1.148477  
1 1 1 9  12 8  o 17.660 0.5487 317.514  19.371  308.238   26.902  327.502   27.915  17.393 0.7733 17.926 0.7786 -0.5330162     1.097379  
1 1 1 9  12 9  o 4.7088 0.9808 24.258   10.040  18.518    14.244  29.926    14.153  4.2225 1.4234 5.1950 1.3499 -0.9724660     1.961662  
1 1 1 9  12 10 o 5.0431 0.9601 27.570   10.158  37.953    15.016  18.808    13.793  5.8594 1.3138 4.2269 1.4003 1.632522       1.920108  
1 1 1 9  12 11 o 3.6838 0.8720 7.2111   9.3409  27.956    13.855  -10.0772  12.648  5.0020 1.3525 2.3656 1.1009 2.636388       1.743911  
1 1 1 9  12 12 o 7.6597 0.7680 61.870   11.751  58.641    16.638  65.083    16.599  7.4490 1.1168 7.8705 1.0545 -0.4214668     1.535964  
1 1 1 9  12 13 o 11.035 0.6475 127.153  14.267  137.112   20.515  117.824   19.855  11.464 0.8948 10.606 0.9360 0.8576250      1.294926  
1 1 1 9  12 14 o 5.1002 1.0332 29.866   11.083  29.169    15.863  30.530    15.492  5.0416 1.4777 5.1587 1.4443 -0.1170454     2.066329  
1 1 1 9  12 15 o 7.7977 0.8340 66.849   12.567  77.315    17.837  56.533    17.709  8.5126 1.0477 7.0827 1.2980 1.429957       1.668058  
1 1 1 9  12 16 o 15.509 0.5842 250.174  18.119  254.464   25.773  245.981   25.478  15.642 0.8238 15.376 0.8285 0.2663002      1.168375  
1 1 1 9  12 17 o 7.9107 0.8322 68.708   12.563  54.583    17.945  82.284    17.593  6.9782 1.3344 8.8432 0.9947 -1.865006      1.664383  
1 1 1 9  12 18 o 16.029 0.5987 268.335  19.129  248.534   27.391  287.188   26.728  15.419 0.8882 16.640 0.8031 -1.221842      1.197464  
1 1 1 9  12 19 o 14.954 0.6012 231.968  17.970  243.024   25.572  221.182   25.258  15.316 0.8348 14.592 0.8654 0.7234249      1.202453  
1 1 1 9  12 20 o 10.407 0.7044 113.857  14.525  134.751   21.016  94.748    20.098  11.356 0.9253 9.4582 1.0625 1.898156       1.408895  
1 1 1 9  12 21 o 3.2731 0.9592 5.5686   10.154  2.0073    16.658  7.6743    12.809  3.2668 1.4069 3.2794 1.3042 -0.1253605E-01 1.918420  
1 1 1 9  12 22 o 13.055 0.8887 177.954  23.205  177.954   23.205  0.0000    0.0000  13.055 0.8887 ?      ?      ?              ?         
1 1 1 9  12 23 o 3.6275 1.1475 2.7036   14.799  8.2711    16.108  -27.4296  37.475  3.5086 1.4381 3.7465 1.7886 -0.2379515     2.295060  
1 1 1 9  12 24 o 5.2124 1.4147 29.321   16.134  26.204    17.419  48.138    42.803  4.6625 1.5740 5.7623 2.3511 -1.099871      2.829328  
1 1 1 9  12 25 o 6.0628 1.4351 56.220   18.468  54.767    20.074  64.221    47.117  6.4513 1.5706 5.6742 2.4024 0.7770925      2.870221  
1 1 1 9  12 26 o 5.0316 1.3794 40.441   19.047  42.113    20.789  31.696    47.538  5.3877 1.7143 4.6756 2.1615 0.7121682      2.758770  
1 1 1 9  12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  13 0  o 13.434 0.8563 189.661  22.198  155.996   31.107  224.593   31.687  12.130 1.3221 14.739 1.0886 -0.000000      0.000000  
1 1 1 9  13 1  o 7.8069 0.7818 63.439   12.140  55.927    17.127  71.024    17.211  7.3242 1.1692 8.2897 1.0381 -0.9654279     1.563524  
1 1 1 9  13 2  o 8.1396 0.7556 68.777   12.226  59.567    17.072  78.474    17.517  7.5627 1.1287 8.7165 1.0048 -1.153752      1.511137  
1 1 1 9  13 3  o 3.0073 0.9074 0.7693   9.6617  -1.7188   13.359  3.4983    13.991  2.8348 1.2399 3.1798 1.3252 -0.3450210     1.814817  
1 1 1 9  13 4  o 13.788 0.5787 193.852  15.931  187.567   21.790  201.071   23.352  13.554 0.8038 14.022 0.8327 -0.4688654     1.157349  
1 1 1 9  13 5  o 5.8602 0.9481 37.550   10.899  32.839    15.485  42.177    15.345  5.4729 1.4069 6.2475 1.2713 -0.7746344     1.896202  
1 1 1 9  13 6  o 12.089 0.6081 149.635  14.692  143.782   20.842  155.416   20.714  11.847 0.8796 12.330 0.8400 -0.4829388     1.216272  
1 1 1 9  13 7  o 8.4413 0.7417 74.796   12.426  66.492    17.914  82.497    17.251  7.9606 1.1252 8.9221 0.9667 -0.9614644     1.483431  
1 1 1 9  13 8  o 6.2828 1.1679 44.387   13.966  45.297    25.959  44.016    16.567  6.2459 1.9049 6.3198 1.3517 -0.7388306E-01 2.335736  
1 1 1 9  13 9  o 17.681 0.5606 321.439  19.813  330.186   27.860  312.489   28.182  17.934 0.7768 17.427 0.8085 0.5061016      1.121201  
1 1 1 9  13 10 o 8.2299 0.7535 71.444   12.307  62.272    17.517  80.384    17.294  7.6771 1.1408 8.7826 0.9846 -1.105445      1.506937  
1 1 1 9  13 11 o 5.0500 1.0347 28.857   11.291  21.715    16.113  35.747    15.828  4.4839 1.5139 5.6161 1.4109 -1.132205      2.069429  
1 1 1 9  13 12 o 8.6562 0.7462 80.025   12.785  91.510    17.954  68.208    18.211  9.3329 0.9619 7.9795 1.1411 1.353345       1.492411  
1 1 1 9  13 13 o 3.8923 1.0208 14.465   10.635  11.681    15.428  16.985    14.681  3.7252 1.4462 4.0594 1.4411 -0.3342638     2.041677  
1 1 1 9  13 14 o 3.1274 0.9282 2.1111   10.118  10.690    14.842  -5.3388   13.831  3.5968 1.4123 2.6579 1.2049 0.9389668      1.856382  
1 1 1 9  13 15 o 9.2839 0.7612 92.308   14.051  103.759   19.963  81.066    19.780  9.8921 1.0091 8.6757 1.1400 1.216379       1.522419  
1 1 1 9  13 16 o 16.302 0.5931 275.625  19.336  273.173   27.463  278.034   27.228  16.225 0.8463 16.380 0.8311 -0.1543102     1.186192  
1 1 1 9  13 17 o 4.1295 1.0255 17.528   10.629  22.908    15.399  12.633    14.689  4.5227 1.4786 3.7364 1.4212 0.7862670      2.050902  
1 1 1 9  13 18 o 12.385 0.6482 160.537  16.002  144.502   22.404  177.234   22.863  11.730 0.9550 13.040 0.8766 -1.309923      1.296326  
1 1 1 9  13 19 o 15.111 0.6082 237.704  18.323  218.862   26.095  256.026   25.733  14.492 0.9003 15.730 0.8180 -1.237741      1.216401  
1 1 1 9  13 20 o 6.1904 0.9980 43.911   12.053  41.681    17.871  45.772    16.325  6.0006 1.4947 6.3801 1.3228 -0.3795071     1.995935  
1 1 1 9  13 21 o 4.3652 1.0620 20.054   11.092  23.848    17.309  17.409    14.449  4.6424 1.5690 4.0880 1.4316 0.5544538      2.124012  
1 1 1 9  13 22 o 6.4913 1.4271 47.425   16.705  42.569    18.299  71.728    40.935  5.9769 1.5256 7.0056 2.4122 -1.028685      2.854111  
1 1 1 9  13 23 o 7.8430 1.3663 79.719   17.792  79.762    19.506  79.511    43.399  8.5382 1.1423 7.1479 2.4824 1.390251       2.732592  
1 1 1 9  13 24 o 5.5690 1.3319 45.141   17.762  49.878    19.577  23.091    42.234  6.2942 1.5624 4.8438 2.1576 1.450418       2.663900  
1 1 1 9  13 25 o 4.6577 1.3893 23.963   16.464  20.888    17.552  46.498    47.515  4.1260 1.5573 5.1895 2.3012 -1.063518      2.778665  
1 1 1 9  13 26 o 4.9318 1.3279 41.376   17.909  43.335    19.200  28.260    49.687  5.4474 1.6331 4.4161 2.0943 1.031273       2.655779  
1 1 1 9  13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  14 0  o 2.5168 1.1559 -1.6549  14.085  6.2715    20.421  -8.8472   19.452  2.8384 1.7695 2.1951 1.4876 -0.000000      0.000000  
1 1 1 9  14 1  o 10.337 0.6838 109.382  14.071  124.855   20.505  95.611    19.345  11.036 0.9291 9.6374 1.0036 1.398238       1.367639  
1 1 1 9  14 2  o 11.452 0.6411 134.356  14.679  129.852   20.506  139.089   21.022  11.254 0.9111 11.650 0.9022 -0.3961639     1.282188  
1 1 1 9  14 3  o 6.0454 0.9631 40.546   11.481  30.301    16.277  50.692    16.198  5.2326 1.4859 6.8582 1.2259 -1.625594      1.926295  
1 1 1 9  14 4  o 13.404 0.6135 184.424  16.294  152.738   22.426  219.853   23.714  12.163 0.9219 14.646 0.8096 -2.482332      1.226916  
1 1 1 9  14 5  o 7.7147 0.7899 62.629   12.102  54.832    17.193  70.286    17.038  7.2122 1.1920 8.2171 1.0367 -1.004880      1.579739  
1 1 1 9  14 6  o 9.9734 0.7029 103.480  13.959  93.531    19.874  113.167   19.611  9.4788 1.0483 10.468 0.9367 -0.9892788     1.405832  
1 1 1 9  14 7  o 5.4570 0.9759 33.390   10.656  32.703    14.926  34.104    15.219  5.4005 1.3775 5.5134 1.3827 -0.1129217     1.951743  
1 1 1 9  14 8  o 3.6149 0.9154 5.5537   10.167  25.602    14.768  -12.5077  14.017  4.7942 1.4311 2.4356 1.1418 2.358557       1.830807  
1 1 1 9  14 9  o 14.631 0.6025 220.932  17.614  233.445   25.144  208.874   24.684  15.047 0.8355 14.216 0.8682 0.8309517      1.204925  
1 1 1 9  14 10 f 12.752 0.6248 168.628  15.907  182.866   23.110  155.810   21.928  13.269 0.8708 12.235 0.8961 1.034324       1.249537  
1 1 1 9  14 11 o 9.4359 0.7337 94.679   13.785  87.731    19.884  101.108   19.128  9.0707 1.0960 9.8011 0.9758 -0.7304125     1.467482  
1 1 1 9  14 12 o 7.8737 1.2177 64.645   16.344  55.760    18.576  95.105    34.395  7.0272 1.3709 8.7202 2.0130 -1.693056      2.435457  
1 1 1 9  14 13 o 4.4370 1.0480 21.925   11.148  16.091    16.100  27.299    15.452  4.0197 1.4967 4.8543 1.4673 -0.8346148     2.095937  
1 1 1 9  14 14 o 4.0934 1.0132 15.621   11.020  4.2272    15.178  28.323    16.026  3.2468 1.3685 4.9400 1.4945 -1.693281      2.026389  
1 1 1 9  14 15 o 2.7226 0.8690 -6.3857  10.260  -13.2649  14.765  0.0380    14.267  2.4765 1.1645 2.9687 1.2902 -0.4922042     1.738007  
1 1 1 9  14 16 o 8.4162 0.7894 75.729   13.278  77.002    18.568  74.397    18.996  8.5002 1.0922 8.3323 1.1399 0.1679068      1.578715  
1 1 1 9  14 17 o 9.2013 0.7564 90.003   13.885  99.003    20.048  81.705    19.250  9.6593 1.0378 8.7434 1.1008 0.9158268      1.512862  
1 1 1 9  14 18 o 5.0225 1.0511 28.657   11.467  34.569    16.223  22.753    16.211  5.4946 1.4537 4.5504 1.5186 0.9442377      2.102223  
1 1 1 9  14 19 o 14.392 0.6205 215.404  17.857  222.255   25.361  208.669   25.146  14.626 0.8670 14.158 0.8880 0.4671125      1.241088  
1 1 1 9  14 20 o 8.8255 0.8142 84.046   14.269  76.065    20.658  91.328    19.733  8.3786 1.2328 9.2724 1.0640 -0.8937998     1.628476  
1 1 1 9  14 21 o 6.0576 1.0097 42.556   11.989  44.784    17.876  40.734    16.163  6.1819 1.4677 5.9333 1.3869 0.2486162      2.019357  
1 1 1 9  14 22 o 5.9518 1.3617 44.656   16.276  44.897    17.849  43.464    39.655  6.1527 1.4705 5.7509 2.2923 0.4017229      2.723468  
1 1 1 9  14 23 o 5.7662 1.4971 35.363   17.355  28.115    18.798  77.192    45.157  4.7748 1.6351 6.7576 2.5085 -1.982879      2.994300  
1 1 1 9  14 24 o 3.9974 1.2719 8.9749   15.912  5.5099    17.279  28.302    40.810  3.2809 1.4229 4.7138 2.1087 -1.432878      2.543869  
1 1 1 9  14 25 o 3.8922 1.3191 -13.8310 16.467  -24.2984  17.488  67.960    48.886  2.3096 1.1303 5.4748 2.3838 -3.165193      2.638254  
1 1 1 9  14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  15 0  o 6.7661 1.6231 62.788   19.677  61.965    28.028  63.588    27.631  6.6856 2.3217 6.8466 2.2687 -0.000000      0.000000  
1 1 1 9  15 1  o 9.8761 0.7430 101.515  14.663  101.747   20.331  101.262   21.168  9.8965 1.0272 9.8557 1.0739 0.4075241E-01  1.486042  
1 1 1 9  15 2  o 4.4208 1.0703 19.684   11.621  13.480    16.272  26.142    16.602  3.9564 1.4980 4.8852 1.5291 -0.9288063     2.140589  
1 1 1 9  15 3  o 3.5557 0.9590 2.5583   11.277  -17.2114  15.823  22.966    16.076  2.4909 1.1815 4.6205 1.5108 -2.129600      1.917928  
1 1 1 9  15 4  o 19.606 0.5542 394.921  21.704  376.291   30.867  413.141   30.525  19.134 0.8066 20.079 0.7601 -0.9454651     1.108349  
1 1 1 9  15 5  o 17.143 0.5781 302.478  19.813  290.417   27.657  315.192   28.396  16.789 0.8237 17.498 0.8114 -0.7091084     1.156230  
1 1 1 9  15 6  o 2.9559 0.8953 -5.7258  10.496  -21.3693  14.669  10.684    15.024  2.2400 1.0821 3.6718 1.4267 -1.431832      1.790680  
1 1 1 9  15 7  o 3.6761 1.0054 10.013   10.892  2.4724    15.793  16.852    15.041  3.2526 1.3845 4.0997 1.4583 -0.8471022     2.010871  
1 1 1 9  15 8  o 6.9019 0.9347 55.598   12.516  26.298    17.834  84.039    17.570  4.8454 1.5916 8.9584 0.9807 -4.113018      1.869463  
1 1 1 9  15 9  o 3.4613 0.9964 7.4512   10.872  5.3425    15.346  9.5761    15.404  3.3360 1.3889 3.5866 1.4290 -0.2505605     1.992785  
1 1 1 9  15 10 o 19.068 0.5694 376.412  21.697  394.612   30.729  358.318   30.639  19.543 0.7862 18.593 0.8239 0.9497871      1.138844  
1 1 1 9  15 11 o 7.8372 0.8678 67.396   13.146  79.859    19.010  55.971    18.200  8.6383 1.1003 7.0360 1.3423 1.602261       1.735665  
1 1 1 9  15 12 o 9.9141 0.7354 104.700  14.538  95.533    20.499  113.974   20.619  9.4509 1.0845 10.377 0.9935 -0.9263315     1.470782  
1 1 1 9  15 13 o 9.4334 0.7682 95.673   14.295  78.293    20.138  113.325   20.295  8.5074 1.1836 10.359 0.9795 -1.851889      1.536330  
1 1 1 9  15 14 o 4.8357 1.0912 28.705   14.028  40.532    15.740  -16.9550  30.927  5.9868 1.3471 3.6846 1.7171 2.302129       2.182430  
1 1 1 9  15 15 o 10.399 0.7159 114.292  14.871  120.879   21.099  107.790   20.962  10.712 0.9849 10.086 1.0391 0.6255474      1.431715  
1 1 1 9  15 16 o 13.799 0.6404 200.014  17.604  214.260   24.527  184.877   25.283  14.341 0.8551 13.257 0.9536 1.084206       1.280869  
1 1 1 9  15 17 o 7.6657 0.9574 67.540   13.813  46.051    20.246  86.254    18.893  6.2839 1.6051 9.0475 1.0441 -2.763645      1.914850  
1 1 1 9  15 18 o 4.2028 1.0727 17.279   11.795  24.298    17.017  10.790    16.362  4.6731 1.5557 3.7324 1.4773 0.9406734      2.145352  
1 1 1 9  15 19 o 7.8170 0.9503 68.787   14.236  53.225    20.124  84.374    20.140  6.7625 1.5244 8.8714 1.1351 -2.108848      1.900601  
1 1 1 9  15 20 o 6.4501 1.1025 52.392   15.187  26.888    24.128  69.125    19.543  4.9289 1.8328 7.9714 1.2259 -3.042428      2.204994  
1 1 1 9  15 21 o 10.682 1.2966 154.160  19.893  163.826   22.227  115.252   44.593  12.469 0.8913 8.8962 2.4352 3.572624       2.593165  
1 1 1 9  15 22 o 6.1248 1.3787 50.891   17.426  52.142    19.185  44.993    41.657  6.5733 1.4933 5.6763 2.3181 0.8969574      2.757402  
1 1 1 9  15 23 o 4.7846 1.3508 30.296   17.093  31.267    18.398  24.174    46.204  4.8484 1.6177 4.7208 2.1636 0.1275625      2.701555  
1 1 1 9  15 24 o 5.1633 1.4468 37.374   18.411  32.784    20.106  61.207    45.816  4.8293 1.6889 5.4974 2.3496 -0.6680574     2.893610  
1 1 1 9  15 25 o 5.9448 1.2728 68.598   19.549  75.270    21.058  26.991    52.584  7.5294 1.4510 4.3601 2.0915 3.169291       2.545529  
1 1 1 9  15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  16 0  o 6.3937 1.6562 58.029   19.466  65.669    29.564  52.182    25.864  6.8147 2.3925 5.9728 2.2908 -0.000000      0.000000  
1 1 1 9  16 1  o 7.1342 1.0276 57.130   14.164  55.849    19.922  58.439    20.141  7.0473 1.4614 7.2211 1.4450 -0.1738596     2.055164  
1 1 1 9  16 2  o 4.6576 1.1361 23.014   12.966  27.196    18.059  18.564    18.628  4.9466 1.6002 4.3687 1.6132 0.5779691      2.272260  
1 1 1 9  16 3  o 12.446 0.6525 160.553  16.227  151.511   22.687  170.026   23.219  12.079 0.9391 12.812 0.9061 -0.7331409     1.304985  
1 1 1 9  16 4  o 12.285 0.6559 156.839  16.093  164.884   22.662  148.654   22.858  12.617 0.8981 11.952 0.9562 0.6645861      1.311839  
1 1 1 9  16 5  o 3.8021 1.0507 9.8190   12.113  19.477    17.126  0.1497    17.136  4.3557 1.5554 3.2486 1.4129 1.107106       2.101324  
1 1 1 9  16 6  o 4.6496 1.0932 23.393   12.345  14.321    17.593  32.192    17.326  4.0179 1.5487 5.2812 1.5433 -1.263276      2.186390  
1 1 1 9  16 7  o 8.8899 0.8155 84.535   14.342  101.531   20.882  69.357    19.732  9.7768 1.0679 8.0031 1.2328 1.773769       1.631014  
1 1 1 9  16 8  o 9.1574 0.7859 89.634   14.262  104.511   20.440  75.518    19.910  9.9410 1.0281 8.3739 1.1888 1.567157       1.571700  
1 1 1 9  16 9  o 10.948 0.7168 126.683  15.651  138.211   22.280  115.449   21.992  11.464 0.9717 10.433 1.0540 1.031580       1.433597  
1 1 1 9  16 10 o 17.671 0.5847 325.371  20.650  311.333   29.079  339.654   29.330  17.273 0.8417 18.068 0.8116 -0.7949715     1.169304  
1 1 1 9  16 11 o 3.9494 1.0657 13.229   12.059  22.164    17.535  5.2126    16.609  4.4894 1.5769 3.4095 1.4340 1.079947       2.131392  
1 1 1 9  16 12 f 5.1548 0.9999 29.334   12.621  4.5631    18.243  52.072    17.478  3.5100 1.4910 6.7997 1.3329 -3.289645      1.999878  
1 1 1 9  16 13 o 5.8763 1.0604 39.935   12.768  29.309    17.837  51.100    18.285  5.0460 1.5859 6.7066 1.4080 -1.660656      2.120716  
1 1 1 9  16 14 o 4.9425 1.0995 28.326   12.249  23.692    18.202  32.160    16.558  4.6252 1.6076 5.2598 1.5005 -0.6345196     2.199015  
1 1 1 9  16 15 o 9.5000 0.8410 97.524   15.673  121.927   22.731  75.407    21.640  10.706 1.0616 8.2938 1.3046 2.412437       1.681951  
1 1 1 9  16 16 o 3.1967 0.9339 -3.9747  11.329  16.521    16.020  -24.4826  16.024  4.0956 1.4986 2.2977 1.1150 1.797906       1.867870  
1 1 1 9  16 17 o 8.2537 0.9322 76.034   14.712  61.730    21.211  89.296    20.423  7.3461 1.4945 9.1612 1.1147 -1.815105      1.864443  
1 1 1 9  16 18 o 10.783 0.7429 123.578  15.991  131.706   22.596  115.425   22.632  11.161 1.0123 10.405 1.0876 0.7559719      1.485754  
1 1 1 9  16 19 f 11.548 0.7424 142.205  16.955  118.666   23.895  166.073   24.061  10.524 1.1352 12.572 0.9569 -2.047776      1.484740  
1 1 1 9  16 20 f 4.7386 1.1015 25.538   12.388  34.518    18.003  17.462    17.073  5.3567 1.5754 4.1205 1.5399 1.236195       2.202966  
1 1 1 9  16 21 o 8.1184 1.3917 90.137   19.024  92.181    20.924  80.392    45.690  9.1692 1.1410 7.0676 2.5388 2.101596       2.783366  
1 1 1 9  16 22 o 6.1061 1.3647 54.799   17.869  57.250    19.632  42.964    43.144  6.8184 1.4819 5.3937 2.2920 1.424752       2.729356  
1 1 1 9  16 23 f 3.3812 1.1240 -2.0686  15.998  3.4563    17.174  -38.3127  43.987  3.1839 1.3989 3.5786 1.7598 -0.3947566     2.248031  
1 1 1 9  16 24 o 3.8207 1.2752 -0.4887  16.886  -8.6834   18.230  49.013    44.805  2.7375 1.2892 4.9039 2.2005 -2.166451      2.550376  
1 1 1 9  16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  16 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  17 0  o 3.3444 1.4482 12.402   18.818  20.320    26.749  4.6430    26.478  3.6894 2.1612 2.9994 1.9284 -0.000000      0.000000  
1 1 1 9  17 1  o 4.2818 1.0999 16.008   12.952  3.7564    17.732  30.019    18.964  3.4507 1.4679 5.1129 1.6384 -1.662249      2.199788  
1 1 1 9  17 2  o 3.2303 0.9944 -0.1607  12.192  -6.4636   18.164  5.0074    16.448  3.0496 1.3818 3.4111 1.4304 -0.3614459     1.988818  
1 1 1 9  17 3  f 11.333 0.7156 135.494  16.211  131.307   22.938  139.672   22.915  11.148 1.0288 11.517 0.9948 -0.3696871     1.431112  
1 1 1 9  17 4  o 4.2930 1.1278 18.206   13.077  23.388    18.445  12.968    18.543  4.6165 1.6175 3.9696 1.5722 0.6468396      2.255671  
1 1 1 9  17 5  o 5.8735 1.0988 40.700   13.169  44.777    18.029  36.035    19.282  6.2239 1.4715 5.5231 1.6322 0.7007828      2.197591  
1 1 1 9  17 6  o 10.527 0.7375 117.166  15.519  115.447   21.527  119.027   22.393  10.454 1.0296 10.600 1.0563 -0.1460419     1.475063  
1 1 1 9  17 7  o 8.1334 0.8425 71.443   13.685  68.417    19.555  74.347    19.158  7.9446 1.2307 8.3222 1.1510 -0.3775954     1.685085  
1 1 1 9  17 8  o 3.7746 1.0394 9.7465   12.042  22.091    17.291  -1.8801   16.780  4.4665 1.5660 3.0827 1.3672 1.383815       2.078863  
1 1 1 9  17 9  o 9.1988 0.8407 91.962   15.375  101.957   21.648  81.788    21.840  9.7503 1.1101 8.6473 1.2628 1.102990       1.681389  
1 1 1 9  17 10 o 3.8666 1.0457 9.0669   12.561  26.182    18.047  -7.0131   17.493  4.7831 1.6022 2.9502 1.3442 1.832818       2.091409  
1 1 1 9  17 11 o 8.2164 0.8750 72.802   14.361  76.544    20.949  69.484    19.726  8.4112 1.2453 8.0216 1.2296 0.3896027      1.750057  
1 1 1 9  17 12 o 9.7427 0.8002 100.890  15.551  110.960   22.915  92.292    21.174  10.195 1.1238 9.2900 1.1396 0.9054565      1.600477  
1 1 1 9  17 13 o 4.1136 1.0560 15.081   12.526  -1.5671   18.735  28.539    16.844  3.2678 1.4473 4.9593 1.5382 -1.691440      2.112029  
1 1 1 9  17 14 o 2.5951 0.8482 -13.5855 10.994  -29.6797  16.499  -0.7295   14.746  2.2195 1.0887 2.9707 1.3009 -0.7511621     1.696344  
1 1 1 9  17 15 o 7.5224 1.0160 63.578   14.922  57.761    21.494  68.991    20.732  7.0701 1.5617 7.9747 1.2999 -0.9045963     2.031915  
1 1 1 9  17 16 o 5.9415 1.1289 40.926   13.624  45.275    20.662  37.579    18.122  6.1979 1.6410 5.6851 1.5508 0.5127244      2.257890  
1 1 1 9  17 17 o 6.0006 1.4171 40.242   17.511  56.360    37.098  35.622    19.863  6.5218 2.2934 5.4795 1.6652 1.042293       2.834170  
1 1 1 9  17 18 o 6.3536 1.1603 47.858   14.839  47.755    21.511  47.951    20.496  6.3295 1.6737 6.3777 1.6074 -0.4818296E-01 2.320565  
1 1 1 9  17 19 o 5.4225 1.1126 33.785   14.122  55.100    20.436  14.307    19.536  6.8084 1.5372 4.0366 1.6090 2.771784       2.225273  
1 1 1 9  17 20 o 3.7692 1.0462 11.080   12.128  0.7282    17.310  21.060    16.997  3.2047 1.4063 4.3337 1.5493 -1.129018      2.092365  
1 1 1 9  17 21 o 3.8972 1.2030 9.6024   16.067  14.119    17.821  -10.0113  37.135  3.8518 1.5363 3.9426 1.8516 -0.9086871E-01 2.405916  
1 1 1 9  17 22 o 4.6023 1.2674 29.201   17.939  37.309    19.710  -9.9180   43.294  5.2223 1.6700 3.9823 1.9069 1.239974       2.534805  
1 1 1 9  17 23 o 5.7098 1.5333 44.480   18.807  33.706    20.460  103.193   47.762  4.8065 1.7018 6.6130 2.5510 -1.806596      3.066519  
1 1 1 9  17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 0  o 3.1512 1.4133 7.7787   19.396  3.6693    27.929  11.607    26.957  3.0208 1.9564 3.2817 2.0402 -0.000000      0.000000  
1 1 1 9  18 1  o 3.4491 1.0360 3.6656   12.602  -1.6237   18.528  8.2189    17.190  3.2662 1.4432 3.6320 1.4868 -0.3657880     2.072095  
1 1 1 9  18 2  o 11.228 0.7275 133.177  16.328  127.581   22.994  138.867   23.188  10.980 1.0471 11.477 1.0102 -0.4972315     1.454996  
1 1 1 9  18 3  o 7.6714 0.9511 65.753   14.140  56.263    20.094  75.061    19.901  6.9945 1.4825 8.3483 1.1919 -1.353882      1.902205  
1 1 1 9  18 4  o 12.781 0.7116 172.919  18.065  148.530   25.166  198.848   25.949  11.808 1.0656 13.754 0.9433 -1.945954      1.423128  
1 1 1 9  18 5  o 3.4856 1.0436 5.2158   12.561  4.8136    18.334  5.5716    17.244  3.5054 1.4919 3.4658 1.4596 0.3961945E-01  2.087176  
1 1 1 9  18 6  o 7.4801 0.9722 63.114   14.191  69.851    20.122  56.446    20.017  7.9882 1.2595 6.9720 1.4813 1.016279       1.944327  
1 1 1 9  18 7  o 9.9068 0.7853 105.395  15.526  98.358    22.004  112.375   21.912  9.5516 1.1518 10.262 1.0676 -0.7104406     1.570515  
1 1 1 9  18 8  o 9.7374 0.8091 102.073  15.753  98.761    22.127  105.477   22.432  9.5701 1.1561 9.9047 1.1324 -0.3346157     1.618261  
1 1 1 9  18 9  o 5.8657 1.1334 40.413   13.713  36.392    19.177  44.620    19.615  5.5634 1.6231 6.1680 1.5823 -0.6046405     2.266759  
1 1 1 9  18 10 f 4.1932 0.9997 10.840   13.104  -21.3299  19.458  37.536    17.725  2.7046 1.2905 5.6817 1.5271 -2.977139      1.999342  
1 1 1 9  18 11 o 6.3488 1.1216 47.226   14.418  59.675    20.912  35.947    19.905  7.1901 1.5026 5.5076 1.6655 1.682404       2.243136  
1 1 1 9  18 12 o 5.7386 1.1639 38.978   14.157  47.379    20.862  31.808    19.273  6.2875 1.6414 5.1898 1.6505 1.097747       2.327731  
1 1 1 9  18 13 o 10.134 0.8025 109.132  16.229  114.327   23.918  104.700   22.093  10.345 1.1560 9.9227 1.1133 0.4220400      1.604934  
1 1 1 9  18 14 o 11.579 0.7582 142.121  17.522  131.343   24.627  153.169   24.935  11.112 1.1082 12.046 1.0350 -0.9340010     1.516340  
1 1 1 9  18 15 o 3.3754 0.9506 -6.1745  12.699  -44.6322  19.467  22.314    16.755  2.2304 1.1098 4.5204 1.5436 -2.289906      1.901190  
1 1 1 9  18 16 o 15.781 0.6616 261.098  20.858  264.353   30.291  258.163   28.763  15.859 0.9550 15.703 0.9158 0.1561117      1.323163  
1 1 1 9  18 17 o 3.4074 1.0458 1.2515   13.211  4.5849    19.395  -1.6338   18.044  3.5948 1.5324 3.2200 1.4235 0.3747904      2.091513  
1 1 1 9  18 18 o 4.9493 1.0225 21.138   13.237  55.925    20.390  -4.1995   17.402  6.8707 1.5238 3.0278 1.3639 3.842879       2.045020  
1 1 1 9  18 19 o 15.366 0.8991 264.229  25.510  259.450   45.053  266.484   30.949  14.940 1.5078 15.792 0.9799 -0.8517027     1.798242  
1 1 1 9  18 20 o 6.1856 1.5416 44.915   19.273  35.943    21.227  87.027    45.988  5.2694 1.7367 7.1017 2.5475 -1.832225      3.083113  
1 1 1 9  18 21 o 4.6967 1.3472 30.449   19.180  33.589    21.791  19.651    40.406  4.9016 1.7541 4.4918 2.0452 0.4097815      2.694335  
1 1 1 9  18 22 o 5.6320 1.2590 55.422   18.550  63.718    20.223  11.421    46.574  6.9871 1.4925 4.2768 2.0281 2.710234       2.518075  
1 1 1 9  18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  18 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  19 0  o 3.6294 1.3884 9.3195   18.189  -24.4318  25.844  42.444    25.603  2.1731 1.5284 5.0857 2.3183 -0.000000      0.000000  
1 1 1 9  19 1  o 17.915 0.6188 335.446  22.158  350.979   31.578  320.381   31.099  18.336 0.8611 17.494 0.8888 0.8415546      1.237538  
1 1 1 9  19 2  o 6.1332 1.1369 44.785   15.228  23.398    21.394  66.744    21.679  4.6622 1.7274 7.6041 1.4787 -2.941881      2.273891  
1 1 1 9  19 3  o 3.0968 0.9879 -7.8507  13.290  -18.2926  18.389  3.5679    19.230  2.6734 1.2696 3.5203 1.5138 -0.8469231     1.975777  
1 1 1 9  19 4  o 6.0114 1.1430 42.448   14.649  26.964    20.047  60.187    21.457  4.8556 1.6871 7.1671 1.5426 -2.311449      2.286036  
1 1 1 9  19 5  o 8.6076 0.9500 84.002   15.493  63.744    22.085  103.629   21.739  7.3830 1.5453 9.8323 1.1055 -2.449336      1.900001  
1 1 1 9  19 6  f 5.2894 1.1439 31.233   13.601  45.336    20.581  20.298    18.122  6.1783 1.6388 4.4005 1.5964 1.777810       2.287766  
1 1 1 9  19 7  o 7.1908 1.0476 59.214   14.811  71.675    20.809  46.419    21.086  8.1226 1.2809 6.2591 1.6580 1.863483       2.095208  
1 1 1 9  19 8  o 10.360 0.8060 114.698  16.697  113.043   23.294  116.447   23.945  10.288 1.1321 10.433 1.1476 -0.1446228     1.612003  
1 1 1 9  19 9  o 4.9738 1.1073 27.761   13.503  10.977    19.849  42.219    18.423  3.9339 1.6026 6.0137 1.5285 -2.079855      2.214622  
1 1 1 9  19 10 o 5.9331 1.1520 41.970   14.062  44.809    20.684  39.530    19.176  6.1063 1.6531 5.7600 1.6048 0.3463187      2.303996  
1 1 1 9  19 11 o 6.2163 1.1018 45.746   14.463  65.182    20.431  26.223    20.477  7.5899 1.3974 4.8427 1.7038 2.747233       2.203583  
1 1 1 9  19 12 o 7.5392 1.0796 64.249   15.683  75.958    23.418  54.725    21.119  8.1958 1.4833 6.8826 1.5691 1.313172       2.159201  
1 1 1 9  19 13 o 4.0441 1.1088 7.2479   14.294  29.906    21.247  -11.4878  19.320  5.1108 1.7383 2.9774 1.3770 2.133411       2.217637  
1 1 1 9  19 14 f 12.248 0.7716 159.487  18.898  159.281   26.559  159.698   26.896  12.244 1.0846 12.251 1.0977 -0.7223129E-02 1.543106  
1 1 1 9  19 15 o 5.3175 1.2195 33.103   14.852  37.676    21.687  29.064    20.382  5.6088 1.7464 5.0262 1.7026 0.5825825      2.438981  
1 1 1 9  19 16 o 4.9401 1.2182 27.853   14.745  27.945    21.982  27.777    19.882  4.9595 1.7631 4.9206 1.6815 0.3890419E-01  2.436425  
1 1 1 9  19 17 o 4.4240 1.1471 17.465   15.006  -3.1418   21.656  36.498    20.812  3.3956 1.5263 5.4523 1.7129 -2.056724      2.294257  
1 1 1 9  19 18 o 3.1164 1.0020 -7.0750  13.993  -17.7428  20.801  1.7445    18.913  2.8646 1.3575 3.3682 1.4742 -0.5036182     2.004040  
1 1 1 9  19 19 f 6.3214 1.1453 51.071   15.057  35.705    21.441  66.025    21.151  5.2518 1.7461 7.3911 1.4824 -2.139326      2.290523  
1 1 1 9  19 20 o 4.5584 1.3709 22.819   18.168  18.065    20.211  42.842    41.476  4.0088 1.6230 5.1079 2.2099 -1.099098      2.741805  
1 1 1 9  19 21 o 6.9496 1.3322 86.407   21.182  94.183    23.401  51.143    49.832  8.7789 1.3328 5.1203 2.3071 3.658631       2.664429  
1 1 1 9  19 22 o 6.7751 1.4699 76.740   19.816  70.203    22.224  102.101   43.773  7.0452 1.6121 6.5051 2.4584 0.5400414      2.939866  
1 1 1 9  19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  19 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  20 0  o 4.2167 1.6547 29.920   20.606  27.415    30.843  31.939    27.693  4.0977 2.3554 4.3356 2.3247 -0.000000      0.000000  
1 1 1 9  20 1  o 21.820 0.5913 494.562  25.759  507.113   35.727  480.971   37.175  22.135 0.8070 21.504 0.8644 0.6315517      1.182553  
1 1 1 9  20 2  o 5.4016 1.1850 34.347   14.188  37.126    19.572  31.270    20.595  5.6123 1.6404 5.1910 1.7106 0.4213018      2.370061  
1 1 1 9  20 3  f 8.2565 0.9356 74.200   15.423  69.721    21.091  79.347    22.612  7.9916 1.3196 8.5215 1.3268 -0.5299096     1.871255  
1 1 1 9  20 4  o 11.093 0.7594 130.651  16.809  140.797   23.824  120.594   23.720  11.547 1.0316 10.639 1.1148 0.9077168      1.518867  
1 1 1 9  20 5  o 4.3427 1.1860 17.134   14.845  23.386    20.727  10.549    21.272  4.6831 1.7060 4.0023 1.6480 0.6807251      2.371953  
1 1 1 9  20 6  o 9.7325 0.8572 102.225  16.685  103.729   23.694  100.745   23.498  9.8059 1.2082 9.6590 1.2164 0.1469269      1.714434  
1 1 1 9  20 7  o 8.0281 1.0174 72.945   15.931  69.456    23.078  76.120    22.017  7.7328 1.5463 8.3233 1.3226 -0.5904717     2.034772  
1 1 1 9  20 8  o 3.1341 0.9949 -5.7960  13.279  -15.0519  19.026  2.9951    18.542  2.8233 1.3257 3.4449 1.4840 -0.6216216     1.989894  
1 1 1 9  20 9  o 5.8849 1.1835 41.138   14.841  50.683    21.242  32.035    20.744  6.5402 1.6298 5.2295 1.7165 1.310774       2.367020  
1 1 1 9  20 10 f 5.7714 1.1917 39.113   14.822  31.571    21.145  46.401    20.784  5.2461 1.7335 6.2966 1.6357 -1.050532      2.383393  
1 1 1 9  20 11 o 10.851 0.7708 124.793  16.580  147.467   24.075  104.337   22.867  11.828 1.0177 9.8746 1.1579 1.953188       1.541589  
1 1 1 9  20 12 o 5.2323 1.2229 31.639   14.974  27.370    21.429  35.712    20.932  4.9565 1.7430 5.5082 1.7158 -0.5517540     2.445822  
1 1 1 9  20 13 o 3.7241 1.1256 5.0208   14.840  4.7144    20.289  5.3734    21.763  3.6614 1.5642 3.7867 1.6189 -0.1252885     2.251125  
1 1 1 9  20 14 o 6.1787 1.2141 45.723   15.675  51.963    21.914  39.185    22.430  6.6293 1.6573 5.7281 1.7748 0.9012108      2.428239  
1 1 1 9  20 15 o 7.0314 1.1837 59.877   16.433  64.429    23.062  55.182    23.423  7.3540 1.6124 6.7088 1.7333 0.6451631      2.367333  
1 1 1 9  20 16 o 11.510 0.8449 145.593  19.277  167.247   27.410  124.398   27.117  12.435 1.1021 10.585 1.2809 1.849745       1.689810  
1 1 1 9  20 17 o 5.9458 1.2800 45.198   16.813  54.486    24.174  36.495    23.400  6.5223 1.7961 5.3692 1.8243 1.153150       2.560092  
1 1 1 9  20 18 o 3.6706 1.0751 1.9878   14.886  -23.7624  21.542  25.519    20.593  2.7404 1.3207 4.6007 1.6967 -1.860308      2.150142  
1 1 1 9  20 19 o 3.8396 1.1855 10.279   18.060  21.619    20.298  -32.8119  39.568  4.2016 1.6510 3.4777 1.7016 0.7238958      2.370916  
1 1 1 9  20 20 o 4.9053 1.3107 38.804   19.599  47.221    21.397  -5.0653   48.848  5.7264 1.7256 4.0842 1.9734 1.642210       2.621455  
1 1 1 9  20 21 o 5.3048 1.4072 52.285   20.219  52.949    22.059  48.799    50.570  5.8669 1.7486 4.7427 2.2053 1.124275       2.814368  
1 1 1 9  20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 0  o 7.7799 1.7611 85.241   24.550  71.949    34.456  98.946    34.987  6.8335 2.6500 8.7263 2.3201 -0.000000      0.000000  
1 1 1 9  21 1  o 13.715 0.7130 198.703  19.547  204.501   27.509  192.790   27.780  13.932 0.9873 13.498 1.0291 0.4344435      1.426061  
1 1 1 9  21 2  o 16.849 0.6472 297.267  21.792  292.360   31.268  301.900   30.387  16.696 0.9364 17.002 0.8936 -0.3055172     1.294366  
1 1 1 9  21 3  o 3.9048 1.1471 8.9091   14.839  4.1289    20.637  14.026    21.352  3.6509 1.5691 4.1588 1.6736 -0.5079489     2.294114  
1 1 1 9  21 4  o 10.135 0.8379 111.178  16.966  105.462   23.921  116.965   24.069  9.8537 1.2138 10.416 1.1554 -0.5623789     1.675745  
1 1 1 9  21 5  o 3.5772 1.0487 2.1360   13.695  18.803    18.539  -17.8821  20.318  4.2975 1.6049 2.8569 1.3502 1.440515       2.097346  
1 1 1 9  21 6  o 4.6485 1.1728 22.760   14.220  13.325    20.098  32.219    20.124  4.0630 1.6277 5.2340 1.6888 -1.171046      2.345545  
1 1 1 9  21 7  o 7.0129 1.1044 57.673   15.166  46.828    21.880  67.705    21.042  6.2732 1.7010 7.7526 1.4090 -1.479427      2.208794  
1 1 1 9  21 8  o 3.4928 1.0780 -0.0440  14.301  -4.8019   20.057  4.8759    20.396  3.2821 1.4726 3.7035 1.5749 -0.4213665     2.156079  
1 1 1 9  21 9  o 8.6989 1.0186 84.669   17.128  100.732   24.764  69.938    23.715  9.6282 1.2860 7.7697 1.5799 1.858572       2.037170  
1 1 1 9  21 10 o 9.2741 0.9381 94.786   16.725  114.406   24.037  76.374    23.286  10.343 1.1620 8.2056 1.4730 2.136996       1.876195  
1 1 1 9  21 11 o 6.5744 1.2079 51.782   16.031  50.375    22.943  53.123    22.410  6.4698 1.7367 6.6790 1.6794 -0.2091513     2.415842  
1 1 1 9  21 12 o 4.1328 1.1849 12.922   15.334  9.1118    21.867  16.608    21.508  3.9567 1.6536 4.3088 1.6974 -0.3520629     2.369707  
1 1 1 9  21 13 o 7.5640 1.1397 67.599   17.133  87.088    24.013  47.387    24.454  8.9035 1.3485 6.2244 1.8377 2.679105       2.279346  
1 1 1 9  21 14 o 4.2864 1.1658 12.443   16.117  34.674    22.294  -11.8979  23.328  5.3283 1.7808 3.2445 1.5049 2.083859       2.331534  
1 1 1 9  21 15 o 6.3298 1.3031 51.314   17.501  50.258    25.251  52.289    24.277  6.2458 1.8729 6.4138 1.8124 -0.1679811     2.606261  
1 1 1 9  21 16 o 2.6201 0.8979 -32.5098 15.137  -56.6915  22.509  -12.5436  20.453  2.2719 1.1398 2.9683 1.3876 -0.6963918     1.795735  
1 1 1 9  21 17 o 4.4359 1.2472 21.841   16.653  26.348    23.550  17.335    23.551  4.6588 1.7929 4.2131 1.7343 0.4456644      2.494463  
1 1 1 9  21 18 o 4.6090 1.2410 28.536   15.902  25.383    22.649  31.602    22.332  4.4376 1.7439 4.7805 1.7661 -0.3428249     2.482010  
1 1 1 9  21 19 o 4.9979 1.2911 41.332   20.570  54.525    22.639  -21.1326  49.260  6.1306 1.7563 3.8652 1.8928 2.265398       2.582124  
1 1 1 9  21 20 o 7.9089 1.2048 131.356  22.884  152.635   25.246  33.306    54.192  11.350 1.1121 4.4674 2.1377 6.883002       2.409678  
1 1 1 9  21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  21 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 0  o 5.6207 1.8167 52.415   22.209  49.274    30.430  55.996    32.486  5.4287 2.5248 5.8128 2.6130 -0.000000      0.000000  
1 1 1 9  22 1  o 9.2134 0.9496 92.412   17.437  84.208    23.554  102.360   25.938  8.7636 1.3439 9.6632 1.3421 -0.8996534     1.899267  
1 1 1 9  22 2  o 17.692 0.6507 326.855  23.021  330.244   32.866  323.590   32.256  17.779 0.9243 17.605 0.9161 0.1733341      1.301366  
1 1 1 9  22 3  o 6.6302 1.2484 52.663   16.863  55.250    23.881  50.090    23.815  6.8037 1.7462 6.4567 1.7847 0.3469672      2.496876  
1 1 1 9  22 4  o 6.3609 1.1724 48.384   15.520  34.184    22.786  60.674    21.198  5.4270 1.7998 7.2948 1.5029 -1.867801      2.344839  
1 1 1 9  22 5  o 10.703 0.8427 122.081  17.998  132.486   26.464  113.128   24.549  11.127 1.1892 10.279 1.1942 0.8477697      1.685327  
1 1 1 9  22 6  o 6.9111 1.1326 54.921   16.566  84.070    24.155  29.034    22.763  8.7444 1.3812 5.0779 1.7953 3.666436       2.265144  
1 1 1 9  22 7  o 5.2475 1.2559 31.342   15.589  36.470    23.710  27.436    20.691  5.5488 1.8358 4.9463 1.7142 0.6025310      2.511707  
1 1 1 9  22 8  o 7.7866 1.1126 69.253   17.009  87.372    24.790  53.134    23.381  8.9103 1.3911 6.6630 1.7368 2.247301       2.225250  
1 1 1 9  22 9  o 7.7463 1.1317 69.856   16.957  80.223    24.590  60.456    23.416  8.3550 1.5279 7.1376 1.6700 1.217368       2.263471  
1 1 1 9  22 10 o 9.7556 0.9754 106.861  18.231  86.559    25.867  126.897   25.697  8.6602 1.5504 10.851 1.1841 -2.190836      1.950855  
1 1 1 9  22 11 o 9.1403 0.9802 91.804   17.903  96.333    25.941  87.685    24.740  9.3550 1.3865 8.9256 1.3859 0.4294291      1.960343  
1 1 1 9  22 12 o 3.6025 1.1245 -0.6136  16.180  -10.2051  23.530  7.9882    22.283  3.3159 1.5287 3.8891 1.6497 -0.5731781     2.249042  
1 1 1 9  22 13 o 11.599 0.9053 149.077  20.972  152.767   30.601  145.809   28.798  11.710 1.3066 11.487 1.2535 0.2228289      1.810621  
1 1 1 9  22 14 o 6.2912 1.2036 43.665   18.823  92.081    28.401  5.7375    25.137  8.6715 1.6984 3.9110 1.7060 4.760483       2.407233  
1 1 1 9  22 15 o 3.9386 1.2105 7.9583   17.880  0.6418    27.614  13.240    23.463  3.8061 1.7160 4.0711 1.7079 -0.2650449     2.421050  
1 1 1 9  22 16 o 3.4072 1.1040 -3.1485  16.976  -4.4848   24.967  -1.9993   23.152  3.4209 1.5762 3.3935 1.5463 0.2740955E-01  2.208005  
1 1 1 9  22 17 o 5.5161 1.1386 38.657   17.582  -3.8138   25.679  76.133    24.122  3.4262 1.5856 7.6060 1.6344 -4.179812      2.277151  
1 1 1 9  22 18 o 4.2784 1.3448 21.600   21.714  25.651    24.021  3.4998    50.779  4.3466 1.7660 4.2102 2.0287 0.1364098      2.689646  
1 1 1 9  22 19 o 3.8336 1.2659 11.032   20.582  11.201    22.728  10.261    48.529  3.5928 1.5925 4.0743 1.9682 -0.4814837     2.531754  
1 1 1 9  22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  22 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 0  o 29.490 0.8548 907.040  50.221  910.221   71.474  903.938   70.582  29.535 1.2146 29.444 1.2031 -0.000000      0.000000  
1 1 1 9  23 1  o 11.407 0.8534 140.788  19.335  153.499   26.826  127.045   27.893  12.003 1.1174 10.810 1.2901 1.193038       1.706770  
1 1 1 9  23 2  o 5.4059 1.0061 26.365   15.863  -24.3369  23.405  69.444    21.574  2.9717 1.4173 7.8402 1.4285 -4.868436      2.012255  
1 1 1 9  23 3  o 8.7228 1.0625 86.742   17.841  72.211    25.656  100.347   24.825  7.8327 1.6876 9.6129 1.2913 -1.780149      2.124901  
1 1 1 9  23 4  o 5.4564 1.2380 34.873   15.375  39.381    21.959  30.538    21.535  5.7522 1.7514 5.1605 1.7501 0.5917068      2.475965  
1 1 1 9  23 5  o 7.2644 1.4415 65.437   20.207  64.519    23.433  68.100    39.911  7.4250 1.6233 7.1038 2.3827 0.3211961      2.883060  
1 1 1 9  23 6  o 3.3875 1.0456 -8.3003  15.145  -36.5645  22.801  14.017    20.261  2.6565 1.2981 4.1185 1.6395 -1.461916      2.091207  
1 1 1 9  23 7  f 4.7196 1.1485 21.913   15.532  -5.7335   24.004  41.826    20.372  3.5192 1.5920 5.9201 1.6558 -2.400890      2.296981  
1 1 1 9  23 8  o 10.276 0.9258 115.336  19.002  110.782   27.136  119.716   26.617  10.050 1.3501 10.502 1.2672 -0.4527531     1.851594  
1 1 1 9  23 9  o 10.375 0.9142 117.610  18.916  110.096   27.059  124.791   26.453  10.011 1.3515 10.740 1.2315 -0.7292290     1.828398  
1 1 1 9  23 10 o 6.6441 1.3025 55.444   17.995  62.521    25.833  48.772    25.082  7.0774 1.8160 6.2108 1.8676 0.8665252      2.604949  
1 1 1 9  23 11 o 6.6280 1.2561 54.309   17.810  77.129    26.072  34.346    24.386  7.9642 1.6892 5.2918 1.8595 2.672425       2.512191  
1 1 1 9  23 12 o 4.0743 1.2542 7.1820   19.014  10.052    28.579  4.9023    25.469  4.2429 1.8350 3.9058 1.7101 0.3371954      2.508310  
1 1 1 9  23 13 f 3.9268 1.2149 1.5973   18.585  20.937    28.007  -13.6184  24.843  4.5945 1.8913 3.2590 1.5253 1.335588       2.429741  
1 1 1 9  23 14 o 3.9094 1.1903 5.8855   17.965  -13.7633  26.628  22.301    24.339  3.3301 1.5652 4.4888 1.7937 -1.158704      2.380581  
1 1 1 9  23 15 o 8.6690 1.2155 102.196  20.517  84.177    29.657  118.736   28.413  7.5512 1.9501 9.7868 1.4516 -2.235594      2.431082  
1 1 1 9  23 16 o 5.1073 1.3475 38.914   18.684  31.985    26.545  45.717    26.303  4.7481 1.8809 5.4665 1.9302 -0.7183943     2.695079  
1 1 1 9  23 17 o 3.9473 1.1871 17.529   16.560  11.826    25.020  21.976    22.092  3.7698 1.6709 4.1249 1.6867 -0.3550515     2.374204  
1 1 1 9  23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  23 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 0  o 2.7589 1.3181 -10.7112 21.474  -23.3388  30.000  2.5564    30.751  2.4237 1.6921 3.0941 2.0216 -0.000000      0.000000  
1 1 1 9  24 1  o 4.3526 1.1092 7.0729   15.384  -23.1572  20.933  42.582    22.687  2.7818 1.3304 5.9235 1.7751 -3.141744      2.218314  
1 1 1 9  24 2  o 9.1499 1.0528 95.050   18.793  91.798    27.249  98.000    25.953  8.8883 1.5913 9.4115 1.3788 -0.5232620     2.105542  
1 1 1 9  24 3  o 5.1260 1.2432 25.623   17.633  -0.0474   24.834  51.722    25.041  3.7703 1.6682 6.4817 1.8438 -2.711395      2.486479  
1 1 1 9  24 4  o 6.7440 1.2505 54.575   17.038  60.544    25.339  49.649    23.018  7.0692 1.7903 6.4187 1.7465 0.6504869      2.501078  
1 1 1 9  24 5  o 13.796 0.7897 202.253  21.741  208.468   32.016  196.936   29.616  13.970 1.1459 13.622 1.0871 0.3483591      1.579497  
1 1 1 9  24 6  o 4.8103 1.2946 21.804   17.573  35.810    26.470  10.766    23.498  5.4947 1.9367 4.1258 1.7183 1.368908       2.589117  
1 1 1 9  24 7  o 5.9793 1.2190 39.025   17.404  74.583    26.532  12.170    23.058  7.8331 1.7390 4.1254 1.7088 3.707696       2.438018  
1 1 1 9  24 8  o 6.2131 1.3311 48.633   18.166  60.010    26.688  38.810    24.798  6.8555 1.8869 5.5706 1.8781 1.284931       2.662251  
1 1 1 9  24 9  o 5.7973 1.3243 40.420   18.487  62.658    27.545  22.191    24.938  6.9598 1.9175 4.6348 1.8272 2.324990       2.648685  
1 1 1 9  24 10 o 3.8442 1.1934 4.1103   17.603  2.0508    26.364  5.7668    23.645  3.8520 1.7109 3.8365 1.6642 0.1550913E-01  2.386727  
1 1 1 9  24 11 o 4.8667 1.3453 27.433   19.119  21.779    29.044  31.757    25.398  4.6630 1.9235 5.0704 1.8814 -0.4073892     2.690640  
1 1 1 9  24 12 o 4.2708 1.2826 15.186   19.126  11.133    28.755  18.401    25.614  4.1847 1.8250 4.3570 1.8026 -0.1723595     2.565134  
1 1 1 9  24 13 o 4.0795 1.2498 13.936   18.997  7.0078    27.583  20.187    26.202  3.8622 1.7303 4.2968 1.8038 -0.4345276     2.499533  
1 1 1 9  24 14 o 4.1861 1.2602 18.367   18.448  18.310    27.596  18.413    24.805  4.2168 1.8134 4.1553 1.7503 0.6146049E-01  2.520330  
1 1 1 9  24 15 o 10.581 1.0810 145.301  21.800  122.446   31.558  166.163   30.150  9.4168 1.7397 11.744 1.2836 -2.327553      2.161983  
1 1 1 9  24 16 o 3.4949 1.1357 3.7161   18.320  -3.7025   27.460  9.6670    24.594  3.3592 1.5821 3.6307 1.6297 -0.2714922     2.271331  
1 1 1 9  24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  24 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 0  o 3.3704 1.5254 6.1396   23.267  22.700    34.955  -7.0347   31.177  3.9131 2.3817 2.8277 1.9066 -0.000000      0.000000  
1 1 1 9  25 1  o 12.984 0.8199 183.113  21.071  212.763   29.964  154.107   29.637  14.107 1.0620 11.860 1.2495 2.247379       1.639828  
1 1 1 9  25 2  o 6.7906 1.2367 55.741   17.867  83.178    26.413  32.595    24.260  8.3581 1.6386 5.2231 1.8527 3.135005       2.473384  
1 1 1 9  25 3  o 12.146 0.8621 161.301  20.861  143.973   28.991  179.909   30.042  11.426 1.2686 12.865 1.1676 -1.438656      1.724139  
1 1 1 9  25 4  o 7.6717 1.2397 72.495   18.605  71.326    26.580  73.617    26.052  7.5842 1.7824 7.7591 1.7236 -0.1749334     2.479484  
1 1 1 9  25 5  o 11.397 0.9045 144.121  20.541  131.189   29.017  157.112   29.082  10.829 1.3397 11.964 1.2154 -1.134570      1.808910  
1 1 1 9  25 6  o 9.3396 1.0180 99.172   18.975  103.558   27.948  95.421    25.845  9.5063 1.4699 9.1729 1.4088 0.3334045      2.036030  
1 1 1 9  25 7  o 9.2382 1.1305 103.237  19.659  139.075   27.944  68.120    27.661  11.204 1.2470 7.2719 1.8860 3.932477       2.260965  
1 1 1 9  25 8  o 2.9550 1.0086 -29.2436 17.919  -23.5615  25.745  -34.5828  24.956  3.0956 1.4791 2.8143 1.3715 0.2813122      2.017113  
1 1 1 9  25 9  o 6.3373 1.3181 51.377   19.443  81.455    28.740  25.992    26.403  7.9143 1.8490 4.7603 1.8790 3.154017       2.636196  
1 1 1 9  25 10 o 4.9750 1.3479 28.697   19.493  47.194    28.827  13.115    26.459  5.7881 2.0224 4.1619 1.7823 1.626199       2.695704  
1 1 1 9  25 11 o 6.8281 1.4196 69.408   20.916  83.142    30.534  57.266    28.709  7.5305 1.9954 6.1258 2.0197 1.404675       2.839155  
1 1 1 9  25 12 o 10.289 1.1287 136.596  22.367  122.130   32.502  149.613   30.829  9.4785 1.7799 11.100 1.3886 -1.621920      2.257482  
1 1 1 9  25 13 o 3.8584 1.1900 7.5866   18.656  -15.4712  27.092  28.379    25.727  3.1754 1.5173 4.5413 1.8337 -1.365948      2.380067  
1 1 1 9  25 14 o 9.2376 1.2029 118.833  21.403  122.163   30.392  115.557   30.145  9.4048 1.6773 9.0703 1.7248 0.3344841      2.405856  
1 1 1 9  25 15 f 3.7963 1.2076 13.970   19.202  13.956    27.897  13.983    26.472  3.8113 1.7209 3.7814 1.6945 0.2987409E-01  2.415135  
1 1 1 9  25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  25 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 0  o 4.2034 1.7534 30.045   25.248  38.297    37.167  22.973    34.406  4.5445 2.5970 3.8623 2.3564 -0.000000      0.000000  
1 1 1 9  26 1  o 10.827 0.9722 133.191  20.823  113.397   29.488  152.879   29.408  9.9133 1.4873 11.740 1.2524 -1.827147      1.944367  
1 1 1 9  26 2  o 6.6559 1.3217 57.242   18.316  57.138    25.751  57.350    26.058  6.6558 1.8616 6.6561 1.8766 -0.3428459E-03 2.643312  
1 1 1 9  26 3  f 5.4945 1.3217 37.773   17.784  27.093    24.787  49.104    25.531  4.8511 1.8460 6.1378 1.8921 -1.286699      2.643416  
1 1 1 9  26 4  o 5.5405 1.4739 39.661   21.609  39.251    26.583  40.461    37.103  5.5091 1.9410 5.5718 2.2185 -0.6272554E-01 2.947722  
1 1 1 9  26 5  o 10.254 1.0313 122.196  21.000  138.252   29.943  106.653   29.460  11.011 1.3597 9.4968 1.5511 1.514294       2.062635  
1 1 1 9  26 6  o 5.7391 1.3764 44.275   18.795  50.492    27.995  39.173    25.361  6.0406 1.9946 5.4377 1.8971 0.6028676      2.752726  
1 1 1 9  26 7  o 3.6082 1.1497 -7.5397  18.462  16.236    26.651  -29.4769  25.600  4.2953 1.8120 2.9210 1.4155 1.374354       2.299377  
1 1 1 9  26 8  f 7.6141 1.3291 79.491   20.138  75.726    29.154  82.927    27.849  7.3405 1.9520 7.8877 1.8045 -0.5472732     2.658280  
1 1 1 9  26 9  f 3.7175 1.1854 3.7849   18.461  16.122    28.466  -5.1706   24.253  4.1368 1.8096 3.2982 1.5315 0.8385339      2.370709  
1 1 1 9  26 10 o 5.5255 1.3645 42.581   20.682  73.926    30.327  15.327    28.279  6.9234 2.0472 4.1276 1.8047 2.795804       2.729073  
1 1 1 9  26 11 o 3.0509 1.0317 -33.7841 18.435  11.314    27.235  -71.9204  25.045  3.8949 1.7339 2.2069 1.1186 1.688050       2.063418  
1 1 1 9  26 12 o 3.7115 1.1622 -4.8317  19.166  36.539    28.105  -40.7974  26.205  4.7903 1.9228 2.6326 1.3062 2.157688       2.324473  
1 1 1 9  26 13 o 4.1294 1.2596 21.581   19.653  6.0284    27.948  36.794    27.641  3.5954 1.6605 4.6634 1.8945 -1.067945      2.519159  
1 1 1 9  26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  26 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 0  o 2.8413 1.3560 -16.2189 23.283  -47.8852  32.317  17.958    33.573  2.1112 1.5220 3.5714 2.2447 -0.000000      0.000000  
1 1 1 9  27 1  o 5.0988 1.3599 33.905   18.913  33.933    26.071  33.875    27.480  5.0998 1.9034 5.0979 1.9427 0.1955509E-02  2.719789  
1 1 1 9  27 2  o 5.7800 1.3610 45.326   19.007  60.676    27.601  31.482    26.213  6.5999 1.9534 4.9602 1.8957 1.639761       2.722040  
1 1 1 9  27 3  o 5.2090 1.3406 35.394   18.798  50.446    27.055  21.345    26.137  5.9657 1.9604 4.4523 1.8292 1.513383       2.681264  
1 1 1 9  27 4  o 6.8948 1.3325 67.201   20.707  99.390    29.824  37.242    28.772  8.6510 1.7830 5.1386 1.9806 3.512366       2.664913  
1 1 1 9  27 5  o 6.3631 1.3217 57.941   20.130  92.564    29.499  27.769    27.538  8.1258 1.8559 4.6003 1.8824 3.525507       2.643405  
1 1 1 9  27 6  o 3.9207 1.2313 10.433   19.408  16.354    27.448  4.5135    27.446  4.1149 1.7890 3.7265 1.6924 0.3883100      2.462641  
1 1 1 9  27 7  o 3.9497 1.1689 3.3708   18.604  37.238    25.271  -36.6976  27.488  5.0650 1.8773 2.8344 1.3933 2.230610       2.337804  
1 1 1 9  27 8  o 4.2402 1.2565 20.790   18.089  14.250    25.551  27.362    25.613  3.9677 1.7255 4.5128 1.8270 -0.5450964     2.513058  
1 1 1 9  27 9  o 5.8226 1.4043 55.198   19.754  47.695    27.489  63.210    28.408  5.4120 1.9657 6.2331 2.0061 -0.8210878     2.808603  
1 1 1 9  27 10 o 4.9767 1.3354 39.932   19.884  57.230    27.019  19.497    29.367  5.8547 1.9604 4.0987 1.8138 1.755970       2.670778  
1 1 1 9  27 11 o 3.5501 1.1496 2.0296   19.313  22.811    26.956  -19.8885  27.683  4.0977 1.7772 3.0026 1.4589 1.095151       2.299294  
1 1 1 9  27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 0  o 2.1528 1.0985 -50.1940 24.302  -79.5328  36.849  -27.6122  32.328  1.9618 1.4385 2.3439 1.6605 -0.000000      0.000000  
1 1 1 9  28 1  o 3.9521 1.1920 8.9336   18.414  -17.6371  27.431  30.728    24.843  3.1818 1.5221 4.7223 1.8347 -1.540453      2.383903  
1 1 1 9  28 2  o 6.2189 1.3958 58.981   19.822  71.508    28.685  47.533    27.421  6.8855 1.9783 5.5523 1.9697 1.333179       2.791655  
1 1 1 9  28 3  o 5.0051 1.2710 32.594   19.009  60.779    26.380  2.1513    27.416  6.3603 1.9159 3.6499 1.6706 2.710389       2.541959  
1 1 1 9  28 4  o 3.8582 1.2095 2.1455   19.682  -23.0326  26.593  32.646    29.269  2.9916 1.4480 4.7247 1.9378 -1.733108      2.419050  
1 1 1 9  28 5  o 2.9569 1.0021 -23.2140 17.548  -47.4684  24.939  0.5666    24.695  2.4766 1.2361 3.4371 1.5777 -0.9605179     2.004247  
1 1 1 9  28 6  o 5.4435 1.2939 44.169   19.630  75.421    27.602  12.191    27.921  7.0039 1.9154 3.8831 1.7402 3.120804       2.587803  
1 1 1 9  28 7  o 3.0694 1.0345 -13.5444 17.625  -0.5354   25.665  -25.1560  24.247  3.3849 1.5730 2.7539 1.3442 0.6310120      2.069070  
1 1 1 9  28 8  o 5.6950 1.3925 56.477   20.334  77.804    29.592  37.403    27.987  6.7048 2.0314 4.6853 1.9052 2.019537       2.784982  
1 1 1 9  28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  28 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 0  o 4.8217 1.8454 54.688   29.542  17.733    44.172  84.595    39.737  3.4344 2.3017 6.2089 2.8853 -0.000000      0.000000  
1 1 1 9  29 1  o 6.5166 1.2948 67.990   19.880  35.994    27.687  102.042   28.563  4.6701 1.8965 8.3631 1.7632 -3.692980      2.589526  
1 1 1 9  29 2  o 3.9063 1.1865 10.197   19.083  39.280    26.055  -23.4546  28.027  4.8430 1.8797 2.9695 1.4485 1.873483       2.373027  
1 1 1 9  29 3  o 3.0662 1.0724 -29.6833 21.288  -37.6464  25.763  -12.5428  37.798  2.6119 1.2958 3.5205 1.7093 -0.9085858     2.144886  
1 1 1 9  29 4  o 4.4417 1.3098 30.773   20.268  44.652    27.715  14.818    29.716  5.0095 1.9402 3.8739 1.7600 1.135672       2.619506  
1 1 1 9  29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  29 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  30 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  31 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  32 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  33 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  34 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  34 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  34 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  34 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 9  34 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 1  0  o 9.3986 0.8963 93.980   15.802  104.218   22.298  83.651    22.396  9.9847 1.1571 8.8125 1.3691 -0.000000      0.000000  
1 1 1 10 1  1  o 11.363 0.5490 129.843  12.474  131.070   17.527  128.583   17.758  11.418 0.7675 11.308 0.7852 0.1102400      1.098025  
1 1 1 10 1  2  o 16.820 0.5119 284.210  17.217  278.532   24.284  289.948   24.413  16.650 0.7292 16.989 0.7185 -0.3389549     1.023716  
1 1 1 10 1  3  o 21.444 0.5761 447.846  21.648  492.297   43.474  433.191   24.963  22.104 0.9834 20.784 0.6005 1.320391       1.152249  
1 1 1 10 1  4  o 21.505 0.5856 462.659  21.870  468.341   43.669  460.758   25.267  21.569 1.0123 21.441 0.5892 0.1279659      1.171298  
1 1 1 10 1  5  o 10.241 0.7208 117.232  11.998  85.423    23.972  127.865   13.859  9.1881 1.3045 11.293 0.6136 -2.104834      1.441622  
1 1 1 10 1  6  o 26.765 0.5906 709.574  27.576  740.833   55.088  699.122   31.855  27.122 1.0155 26.408 0.6031 0.7142754      1.181147  
1 1 1 10 1  7  o 30.641 0.5325 941.977  32.633  938.063   46.013  945.939   46.289  30.577 0.7524 30.705 0.7538 -0.1279106     1.065047  
1 1 1 10 1  8  o 32.950 0.5438 1089.64  35.835  1093.61   50.706  1085.68   50.651  33.010 0.7680 32.890 0.7700 0.1201859      1.087564  
1 1 1 10 1  9  o 17.810 0.5137 318.319  18.294  307.081   25.700  329.864   26.046  17.491 0.7347 18.130 0.7183 -0.6387291     1.027479  
1 1 1 10 1  10 o 19.089 0.5157 366.061  19.684  368.297   27.656  363.765   28.024  19.149 0.7221 19.029 0.7364 0.1198463      1.031361  
1 1 1 10 1  11 o 17.832 0.6542 319.484  21.780  323.907   38.550  317.410   26.396  17.896 1.0771 17.768 0.7428 0.1279240      1.308369  
1 1 1 10 1  12 o 4.1728 0.8483 15.417   8.5537  1.8987    11.644  31.262    12.606  2.8995 1.2088 5.4460 1.1906 -2.546470      1.696659  
1 1 1 10 1  13 o 21.938 0.6426 462.110  26.280  420.694   31.288  561.331   48.427  20.405 0.7667 23.472 1.0316 -3.067287      1.285284  
1 1 1 10 1  14 o 22.162 0.5254 496.846  23.238  454.137   32.398  542.101   33.349  21.174 0.7650 23.151 0.7203 -1.976748      1.050751  
1 1 1 10 1  15 f 2.8267 0.7829 -3.3720  7.6012  -16.2584  9.9301  14.865    11.813  1.8105 0.8783 3.8430 1.2962 -2.032593      1.565787  
1 1 1 10 1  16 o 15.293 0.6521 236.453  19.375  261.704   32.017  221.862   24.338  15.878 1.0082 14.708 0.8274 1.170205       1.304238  
1 1 1 10 1  17 o 11.247 0.6044 130.468  13.590  130.029   18.931  130.934   19.520  11.233 0.8427 11.262 0.8666 -0.2944946E-01 1.208773  
1 1 1 10 1  18 o 12.209 0.6126 154.651  14.896  165.622   20.711  142.894   21.440  12.681 0.8166 11.736 0.9134 0.9449282      1.225244  
1 1 1 10 1  19 o 4.8247 1.0412 26.757   11.086  30.537    15.044  22.266    16.400  5.1567 1.4156 4.4928 1.5272 0.6639104      2.082412  
1 1 1 10 1  20 o 4.4393 1.0254 22.064   10.986  29.654    14.837  12.853    16.344  5.0588 1.4124 3.8198 1.4870 1.239023       2.050885  
1 1 1 10 1  21 o 9.0099 0.7712 87.026   13.826  89.311    18.816  84.345    20.383  9.1726 1.0257 8.8472 1.1519 0.3253984      1.542394  
1 1 1 10 1  22 o 5.0253 1.1197 28.587   12.543  24.379    16.743  33.969    18.935  4.6653 1.5426 5.3853 1.6234 -0.7200055     2.239486  
1 1 1 10 1  23 o 13.295 0.6665 185.211  17.659  180.101   23.867  191.393   26.249  13.114 0.9100 13.475 0.9740 -0.3606958     1.332918  
1 1 1 10 1  24 o 8.7908 0.9297 82.710   15.384  57.072    20.205  118.072   23.730  7.0601 1.4783 10.522 1.1277 -3.461389      1.859331  
1 1 1 10 1  25 o 4.6131 1.0339 21.644   13.387  41.650    17.254  -8.6129   21.219  6.0066 1.4522 3.2196 1.4722 2.786965       2.067896  
1 1 1 10 1  26 o 8.6984 0.9894 88.200   15.520  94.928    19.295  75.872    26.119  9.4503 1.0209 7.9466 1.6951 1.503710       1.978811  
1 1 1 10 1  27 o 2.1562 0.7167 -5.4036  6.5033  -22.3880  16.177  -2.1296   7.1025  2.3320 1.1289 1.9805 0.8833 0.3514965      1.433377  
1 1 1 10 1  28 o 5.1117 0.8796 31.690   8.6823  26.630    14.953  34.264    10.664  4.6732 1.4493 5.5503 0.9973 -0.8770957     1.759287  
1 1 1 10 1  29 o 8.4693 0.6661 82.601   10.516  65.864    17.045  92.886    13.362  7.5751 1.1251 9.3635 0.7135 -1.788342      1.332240  
1 1 1 10 1  30 o 5.9592 0.8548 48.444   9.6009  29.343    15.831  59.556    12.075  4.5660 1.4995 7.3524 0.8212 -2.786394      1.709654  
1 1 1 10 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 1  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 2  0  o 2.2782 1.0082 1.1890   9.9350  -6.6237   14.429  8.2318    13.700  1.9183 1.2945 2.6381 1.5461 -0.000000      0.000000  
1 1 1 10 2  1  o 25.242 0.5149 639.578  25.992  651.501   36.836  627.756   36.680  25.477 0.7229 25.007 0.7334 0.4699440      1.029827  
1 1 1 10 2  2  o 15.690 0.5181 247.009  16.247  234.572   22.802  259.833   23.155  15.288 0.7458 16.092 0.7195 -0.8041744     1.036243  
1 1 1 10 2  3  o 11.505 0.5525 132.880  12.712  131.997   17.847  133.788   18.112  11.466 0.7782 11.544 0.7845 -0.7713604E-01 1.105028  
1 1 1 10 2  4  o 29.288 0.5269 861.121  30.864  851.158   43.578  871.148   43.718  29.117 0.7483 29.458 0.7420 -0.3409004     1.053859  
1 1 1 10 2  5  o 16.823 0.5157 284.096  17.348  288.101   24.422  280.018   24.646  16.943 0.7207 16.702 0.7378 0.2407932      1.031381  
1 1 1 10 2  6  o 13.226 0.6365 181.353  14.344  165.104   28.649  186.790   16.571  12.800 1.1191 13.652 0.6069 -0.8514462     1.273058  
1 1 1 10 2  7  o 22.161 0.5852 486.969  22.667  505.765   45.100  480.616   26.220  22.423 1.0057 21.900 0.5986 0.5229168      1.170343  
1 1 1 10 2  8  o 12.408 0.6443 151.270  13.611  161.656   28.348  148.158   15.517  12.661 1.1195 12.155 0.6383 0.5055914      1.288688  
1 1 1 10 2  9  o 21.452 0.5957 461.430  25.559  0.0000    0.0000  461.430   25.559  ?      ?      21.452 0.5957 ?              ?         
1 1 1 10 2  10 o 30.764 0.6152 947.582  33.011  964.410   65.540  941.862   38.212  30.894 1.0607 30.634 0.6237 0.2594147      1.230498  
1 1 1 10 2  11 o 21.315 0.6452 466.324  25.542  435.435   44.668  481.331   31.135  20.746 1.0765 21.883 0.7114 -1.137396      1.290354  
1 1 1 10 2  12 o 6.0206 0.9495 39.621   9.4648  33.675    20.938  41.148    10.611  5.6566 1.7076 6.3847 0.8310 -0.7280107     1.899023  
1 1 1 10 2  13 o 4.6417 0.9956 22.937   8.9781  16.851    20.317  24.414    10.008  4.4860 1.6791 4.7975 1.0703 -0.3115563     1.991227  
1 1 1 10 2  14 o 4.8840 0.8312 26.523   8.4721  34.931    11.147  15.023    13.037  5.8370 0.9548 3.9311 1.3608 1.905935       1.662391  
1 1 1 10 2  15 o 13.561 0.5616 186.976  15.159  163.049   20.966  213.185   21.943  12.643 0.8292 14.480 0.7577 -1.837190      1.123242  
1 1 1 10 2  16 o 4.1449 0.9708 17.920   9.4617  20.784    12.895  14.580    13.926  4.3854 1.3435 3.9044 1.4017 0.4809771      1.941593  
1 1 1 10 2  17 o 2.4637 0.7937 -6.6462  8.6095  -8.9621   11.706  -3.9178   12.706  2.2942 1.0648 2.6333 1.1774 -0.3390794     1.587497  
1 1 1 10 2  18 o 8.3988 0.7564 74.235   12.673  67.273    17.491  81.928    18.387  7.9741 1.0968 8.8235 1.0419 -0.8493857     1.512776  
1 1 1 10 2  19 o 4.2170 1.0155 18.406   10.452  12.368    14.256  25.426    15.371  3.7009 1.4019 4.7332 1.4696 -1.032275      2.031072  
1 1 1 10 2  20 o 6.0754 0.9313 41.802   11.616  21.748    16.023  64.016    16.864  4.4221 1.5096 7.7287 1.0910 -3.306526      1.862532  
1 1 1 10 2  21 o 14.945 0.6104 232.462  18.238  234.954   25.570  229.880   26.021  15.035 0.8504 14.855 0.8759 0.1803617      1.220754  
1 1 1 10 2  22 o 4.2694 1.0150 15.806   12.299  35.174    16.863  -6.2039   17.977  5.5044 1.4937 3.0345 1.3748 2.469830       2.030083  
1 1 1 10 2  23 o 4.6262 1.0917 22.197   12.984  36.398    18.048  6.9622    18.693  5.5849 1.5572 3.6675 1.5305 1.917318       2.183397  
1 1 1 10 2  24 o 7.9247 0.9814 69.314   15.161  60.698    20.540  79.625    22.471  7.3016 1.4576 8.5479 1.3144 -1.246300      1.962724  
1 1 1 10 2  25 o 4.3149 1.1675 16.960   14.121  10.930    18.828  24.712    21.348  3.8685 1.5664 4.7614 1.7318 -0.8928711     2.335088  
1 1 1 10 2  26 f 8.5961 0.6937 77.223   11.450  82.923    19.317  74.135    14.217  8.7720 1.1011 8.4202 0.8442 0.3518620      1.387462  
1 1 1 10 2  27 o 5.1294 0.9159 33.670   9.4637  17.878    18.510  39.258    11.012  4.1697 1.5932 6.0892 0.9042 -1.919456      1.831869  
1 1 1 10 2  28 o 4.1717 0.9785 20.922   8.8867  17.794    18.699  21.835    10.100  4.0269 1.5839 4.3164 1.1495 -0.2894173     1.957052  
1 1 1 10 2  29 o 4.1470 0.9252 23.351   9.1993  6.8157    19.286  28.221    10.467  3.4061 1.4898 4.8880 1.0975 -1.481952      1.850404  
1 1 1 10 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 2  35 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 3  0  o 21.288 0.7192 457.703  30.454  470.216   43.428  445.596   42.718  21.577 1.0114 20.998 1.0227 -0.000000      0.000000  
1 1 1 10 3  1  o 19.000 0.5062 362.284  19.236  360.754   27.247  363.803   27.160  18.960 0.7186 19.040 0.7132 -0.8043289E-01 1.012422  
1 1 1 10 3  2  o 11.467 0.5506 132.342  12.592  142.764   17.733  121.743   17.883  11.925 0.7435 11.008 0.8123 0.9170685      1.101179  
1 1 1 10 3  3  o 13.294 0.5284 177.520  14.031  166.210   19.758  189.025   19.928  12.865 0.7679 13.723 0.7261 -0.8576622     1.056837  
1 1 1 10 3  4  o 14.060 0.5231 198.512  14.695  209.229   20.795  187.824   20.768  14.440 0.7200 13.679 0.7591 0.7611465      1.046284  
1 1 1 10 3  5  o 25.463 0.5148 650.430  26.218  652.079   37.103  648.785   37.053  25.495 0.7276 25.431 0.7285 0.6458473E-01  1.029646  
1 1 1 10 3  6  o 11.294 0.5618 128.373  12.633  114.331   17.843  142.487   17.888  10.671 0.8360 11.917 0.7505 -1.246369      1.123504  
1 1 1 10 3  7  o 34.524 0.5480 1196.67  37.841  1188.29   53.483  1205.08   53.547  34.403 0.7773 34.646 0.7728 -0.2429657     1.096082  
1 1 1 10 3  8  o 13.382 0.5439 180.129  14.512  163.199   20.450  197.304   20.597  12.745 0.8023 14.019 0.7346 -1.273890      1.087790  
1 1 1 10 3  9  o 20.076 0.6389 409.524  23.861  395.941   42.014  415.991   28.991  19.801 1.0609 20.351 0.7123 -0.5499859     1.277853  
1 1 1 10 3  10 o 44.109 0.7361 1977.91  61.307  1930.79   105.111 2002.20   75.474  43.629 1.2046 44.589 0.8463 -0.9592400     1.472180  
1 1 1 10 3  11 o 11.196 0.6727 121.813  12.890  136.003   26.888  117.579   14.688  11.576 1.1614 10.816 0.6790 0.7601528      1.345302  
1 1 1 10 3  12 o 9.5718 0.8761 109.286  12.290  73.156    25.926  119.759   13.958  8.2384 1.6312 10.905 0.6400 -2.666732      1.752220  
1 1 1 10 3  13 o 9.4153 0.8652 99.441   12.420  80.698    26.420  104.758   14.072  8.6453 1.5865 10.185 0.6908 -1.540011      1.730364  
1 1 1 10 3  14 o 6.7403 0.8802 44.682   10.067  56.950    20.918  40.984    11.484  7.1654 1.5074 6.3152 0.9093 0.8502684      1.760400  
1 1 1 10 3  15 o 5.2541 0.9625 20.979   9.1513  53.309    20.187  12.616    10.267  6.9392 1.4984 3.5689 1.2084 3.370241       1.924976  
1 1 1 10 3  16 o 5.1102 1.0411 28.136   9.7023  28.111    22.149  28.141    10.793  5.1185 1.7737 5.1019 1.0908 0.1657438E-01  2.082219  
1 1 1 10 3  17 o 5.5692 1.0359 37.344   10.624  23.918    24.571  40.431    11.782  4.8996 1.8441 6.2387 0.9443 -1.339141      2.071800  
1 1 1 10 3  18 o 11.563 0.7142 134.940  13.953  152.609   29.527  129.860   15.833  11.877 1.2430 11.249 0.7037 0.6282377      1.428393  
1 1 1 10 3  19 f 13.966 0.6950 198.113  16.376  218.900   34.542  192.087   18.599  14.242 1.2127 13.690 0.6793 0.5514536      1.389974  
1 1 1 10 3  20 o 3.9149 0.9986 16.546   9.9164  -12.2692  26.185  21.371    10.714  3.4620 1.6018 4.3679 1.1929 -0.9058933     1.997159  
1 1 1 10 3  21 o 4.1983 1.1098 16.215   9.9277  16.130    26.487  16.229    10.708  4.5208 1.8475 3.8759 1.2300 0.6448255      2.219525  
1 1 1 10 3  22 o 10.179 0.8729 108.364  14.662  120.666   31.737  105.026   16.532  10.304 1.5400 10.054 0.8221 0.2493782      1.745728  
1 1 1 10 3  23 o 5.4917 1.3193 35.357   16.974  29.464    30.224  38.071    20.514  5.2860 2.0319 5.6975 1.6834 -0.4114876     2.638693  
1 1 1 10 3  24 o 8.1967 1.2439 78.026   18.620  81.827    34.199  76.425    22.199  8.0233 2.1049 8.3701 1.3261 -0.3468046     2.487812  
1 1 1 10 3  25 o 2.8803 0.9800 -24.4870 15.650  -45.4058  29.293  -16.1306  18.514  2.9997 1.4670 2.7608 1.2999 0.2389410      1.960081  
1 1 1 10 3  26 o 4.3004 1.2400 14.304   16.846  24.602    25.720  6.5669    22.294  4.7865 1.8648 3.8143 1.6348 0.9721184      2.479967  
1 1 1 10 3  27 o 4.1336 1.1998 12.804   16.941  -5.3553   26.409  25.502    22.084  3.5869 1.6409 4.6804 1.7509 -1.093418      2.399644  
1 1 1 10 3  28 o 4.8023 1.2884 32.406   18.458  13.401    29.204  45.048    23.818  4.0662 1.8036 5.5385 1.8403 -1.472373      2.576748  
1 1 1 10 3  29 o 4.8419 1.3155 35.392   19.216  17.284    28.458  50.568    26.052  4.0691 1.7938 5.6146 1.9248 -1.545527      2.631098  
1 1 1 10 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 4  0  o 15.299 0.7395 238.344  22.360  226.991   31.665  249.636   31.579  14.923 1.0737 15.675 1.0171 -0.000000      0.000000  
1 1 1 10 4  1  o 36.598 0.5504 1344.87  40.288  1356.70   57.052  1333.09   56.901  36.760 0.7760 36.437 0.7808 0.3222198      1.100847  
1 1 1 10 4  2  o 22.863 0.5061 524.438  23.141  520.735   32.662  528.171   32.792  22.782 0.7168 22.944 0.7146 -0.1623249     1.012183  
1 1 1 10 4  3  o 29.001 0.5217 843.880  30.262  849.595   42.874  838.206   42.720  29.099 0.7367 28.903 0.7390 0.1960068      1.043480  
1 1 1 10 4  4  o 26.009 0.5143 678.504  26.752  676.524   37.844  680.481   37.821  25.970 0.7286 26.047 0.7260 -0.7610703E-01 1.028579  
1 1 1 10 4  5  o 36.244 0.5509 1318.40  39.935  1308.56   56.474  1328.25   56.480  36.108 0.7820 36.380 0.7762 -0.2716064     1.101863  
1 1 1 10 4  6  o 26.268 0.6321 690.500  31.238  703.041   54.557  684.383   38.102  26.421 1.0325 26.114 0.7295 0.3066769      1.264181  
1 1 1 10 4  7  o 9.4953 0.5985 90.629   11.365  92.129    16.095  89.137    16.049  9.5740 0.8406 9.4166 0.8522 0.1574345      1.196992  
1 1 1 10 4  8  o 5.1354 0.8427 27.409   9.0284  14.796    12.737  40.147    12.799  3.9625 1.3459 6.3083 1.0145 -2.345856      1.685434  
1 1 1 10 4  9  o 19.458 0.5170 380.545  20.120  385.830   28.632  375.389   28.278  19.592 0.7307 19.325 0.7317 0.2670212      1.034051  
1 1 1 10 4  10 o 17.870 0.5276 321.243  18.852  317.057   26.873  325.299   26.453  17.754 0.7568 17.986 0.7354 -0.2322426     1.055261  
1 1 1 10 4  11 o 13.355 0.7160 176.267  17.602  169.179   20.928  193.406   32.544  12.945 0.8084 13.766 1.1821 -0.8210888     1.432051  
1 1 1 10 4  12 o 18.466 0.6365 353.333  20.069  332.586   40.225  360.209   23.158  18.021 1.1161 18.911 0.6123 -0.8896408     1.272989  
1 1 1 10 4  13 o 8.6830 0.7662 70.700   11.472  92.562    24.399  64.495    12.998  9.4073 1.2968 7.9588 0.8166 1.448547       1.532466  
1 1 1 10 4  14 o 3.8876 1.0147 7.6339   8.4036  26.830    20.482  3.7483    9.2150  5.0548 1.7068 2.7204 1.0978 2.334368       2.029373  
1 1 1 10 4  15 o 8.5650 0.9672 88.020   12.148  66.212    26.764  93.679    13.634  7.5452 1.7989 9.5848 0.7112 -2.039606      1.934426  
1 1 1 10 4  16 f 10.100 0.9088 125.997  13.586  83.510    27.764  139.374   15.579  8.5083 1.6911 11.691 0.6663 -3.182848      1.817663  
1 1 1 10 4  17 o 19.976 0.6262 406.124  25.018  0.0000    0.0000  406.124   25.018  ?      ?      19.976 0.6262 ?              ?         
1 1 1 10 4  18 o 2.6379 0.8539 -2.9496  8.4771  -32.0477  23.013  1.6185    9.1182  2.7606 1.3388 2.5152 1.0604 0.2453783      1.707885  
1 1 1 10 4  19 o 7.2508 1.0472 65.096   11.775  52.053    26.799  68.217    13.108  6.4009 1.9317 8.1007 0.8091 -1.699795      2.094315  
1 1 1 10 4  20 o 9.0263 0.9532 86.148   12.778  98.954    30.406  83.402    14.082  9.0822 1.7372 8.9703 0.7849 0.1119413      1.906312  
1 1 1 10 4  21 o 12.864 0.8319 182.624  16.340  168.516   37.266  185.983   18.181  12.251 1.5209 13.476 0.6746 -1.224514      1.663787  
1 1 1 10 4  22 o 6.3116 1.0955 47.939   11.049  41.364    28.435  49.109    11.991  5.7675 2.0090 6.8557 0.8745 -1.088192      2.191092  
1 1 1 10 4  23 o 7.9348 1.2441 81.176   18.700  54.018    33.223  93.771    22.625  6.5257 2.1737 9.3440 1.2107 -2.818288      2.488149  
1 1 1 10 4  24 o 3.8840 1.1976 -11.0624 16.953  26.837    30.843  -27.4697  20.293  5.1372 2.0299 2.6308 1.2713 2.506350       2.395122  
1 1 1 10 4  25 o 9.0910 1.1913 84.145   20.259  150.456   36.050  53.538    24.492  11.540 1.5619 6.6417 1.7992 4.898516       2.382601  
1 1 1 10 4  26 o 7.2163 1.2620 63.745   18.075  79.619    27.817  52.144    23.780  7.9998 1.7840 6.4328 1.7853 1.567032       2.523904  
1 1 1 10 4  27 o 6.5569 1.3119 59.365   18.641  44.018    29.004  70.164    24.331  5.6445 2.0233 7.4692 1.6706 -1.824697      2.623840  
1 1 1 10 4  28 o 5.5852 1.3191 41.270   18.873  75.167    29.256  17.110    24.700  7.0764 1.9860 4.0941 1.7367 2.982346       2.638289  
1 1 1 10 4  29 o 3.0078 1.0141 -16.3110 17.645  -39.4461  26.913  1.1323    23.369  2.6792 1.3283 3.3363 1.5326 -0.6570814     2.028156  
1 1 1 10 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 5  0  o 12.463 0.7812 160.043  19.013  143.719   26.985  176.136   26.793  11.795 1.1703 13.131 1.0350 -0.000000      0.000000  
1 1 1 10 5  1  o 29.922 0.5220 898.176  31.239  904.609   44.146  891.722   44.212  30.030 0.7350 29.815 0.7414 0.2154770      1.044029  
1 1 1 10 5  2  o 28.060 0.5166 789.811  28.992  796.377   41.025  783.260   40.976  28.177 0.7280 27.944 0.7332 0.2336311      1.033212  
1 1 1 10 5  3  o 29.538 0.5206 875.327  30.753  861.346   43.448  889.364   43.536  29.301 0.7414 29.775 0.7311 -0.4740734     1.041236  
1 1 1 10 5  4  o 31.688 0.6489 1002.19  38.748  1031.74   67.630  987.756   47.277  32.005 1.0566 31.371 0.7535 0.6341400      1.297730  
1 1 1 10 5  5  o 21.498 0.5076 463.730  21.821  468.819   31.074  458.778   30.650  21.614 0.7188 21.382 0.7167 0.2325115      1.015118  
1 1 1 10 5  6  o 10.752 0.5691 116.190  12.236  114.944   17.429  117.401   17.184  10.695 0.8148 10.810 0.7948 -0.1149540     1.138279  
1 1 1 10 5  7  o 18.418 0.5131 340.819  18.898  336.186   26.826  345.383   26.626  18.293 0.7332 18.543 0.7179 -0.2503033     1.026188  
1 1 1 10 5  8  o 8.8929 0.6326 80.182   11.170  70.147    15.949  89.843    15.648  8.3386 0.9563 9.4472 0.8282 -1.108663      1.265104  
1 1 1 10 5  9  o 3.4673 0.9159 9.2043   8.6190  6.0760    12.725  11.856    11.715  3.2884 1.3024 3.6463 1.2881 -0.3579073     1.831797  
1 1 1 10 5  10 o 14.802 0.5481 220.940  16.220  216.333   23.128  225.399   22.754  14.648 0.7894 14.957 0.7607 -0.3081408     1.096270  
1 1 1 10 5  11 o 29.941 0.5432 906.130  32.505  953.759   46.387  860.179   45.563  30.719 0.7550 29.162 0.7812 1.556816       1.086414  
1 1 1 10 5  12 o 14.601 0.5579 216.275  16.266  231.826   23.141  201.088   22.869  15.126 0.7649 14.076 0.8123 1.050179       1.115788  
1 1 1 10 5  13 o 16.454 0.5581 276.376  18.365  276.618   26.103  276.139   25.843  16.459 0.7930 16.448 0.7856 0.1111984E-01  1.116225  
1 1 1 10 5  14 o 13.676 0.7086 195.835  15.951  188.170   33.721  198.044   18.104  13.375 1.2607 13.977 0.6476 -0.6027985     1.417276  
1 1 1 10 5  15 o 11.102 0.7382 128.270  13.689  128.278   28.613  128.268   15.588  10.980 1.3029 11.224 0.6944 -0.2437277     1.476417  
1 1 1 10 5  16 o 9.4502 0.9054 101.680  12.751  87.692    28.121  105.300   14.306  8.7479 1.6682 10.153 0.7046 -1.404716      1.810851  
1 1 1 10 5  17 o 5.7516 1.0188 39.405   10.113  30.659    23.765  41.339    11.175  5.1990 1.8348 6.3042 0.8863 -1.105144      2.037663  
1 1 1 10 5  18 o 5.7738 1.0088 44.957   10.589  18.060    25.707  50.453    11.621  4.5718 1.8376 6.9757 0.8329 -2.403810      2.017565  
1 1 1 10 5  19 o 14.504 0.7316 223.017  17.159  224.519   37.348  222.615   19.319  14.276 1.3081 14.733 0.6556 -0.4577618     1.463231  
1 1 1 10 5  20 o 10.786 0.8619 124.481  14.497  127.248   33.061  123.822   16.131  10.603 1.5590 10.968 0.7354 -0.3645258     1.723709  
1 1 1 10 5  21 f 10.822 0.8737 120.445  14.265  137.004   34.822  117.106   15.638  10.977 1.5862 10.667 0.7330 0.3100157      1.747409  
1 1 1 10 5  22 o 16.011 0.7516 271.371  19.053  272.736   42.620  271.030   21.300  15.747 1.3533 16.274 0.6544 -0.5269423     1.503199  
1 1 1 10 5  23 o 1.9696 0.7558 -6.0715  3.2511  -48.4623  28.595  -5.5164   3.2724  2.9014 1.4252 1.0377 0.5036 1.863698       1.511544  
1 1 1 10 5  24 o 6.9776 1.3880 58.944   19.099  68.690    34.456  54.622    22.946  7.2103 2.1936 6.7449 1.7012 0.4653797      2.776013  
1 1 1 10 5  25 o 6.0654 1.2868 46.406   17.342  34.733    25.912  55.876    23.340  5.3661 1.9135 6.7648 1.7210 -1.398650      2.573576  
1 1 1 10 5  26 o 3.5455 1.1103 -4.4147  16.937  -31.0234  26.828  13.217    21.839  3.0249 1.4618 4.0662 1.6715 -1.041364      2.220514  
1 1 1 10 5  27 o 3.5151 1.1139 -1.1835  16.793  -19.3625  27.153  10.078    21.371  3.2240 1.5345 3.8063 1.6151 -0.5823464     2.227847  
1 1 1 10 5  28 o 4.5719 1.3255 26.865   19.077  35.650    29.898  20.832    24.775  4.9075 1.9785 4.2364 1.7644 0.6711216      2.650915  
1 1 1 10 5  29 o 5.5100 1.4036 50.255   20.201  80.919    32.256  30.468    25.912  6.6061 2.1388 4.4138 1.8183 2.192279       2.807289  
1 1 1 10 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 6  0  o 44.985 0.8408 2036.82  75.518  2083.24   107.575 1991.71   106.040 45.492 1.1842 44.477 1.1940 -0.000000      0.000000  
1 1 1 10 6  1  o 9.5875 0.5941 92.725   11.326  81.429    16.044  103.946   15.991  9.0003 0.8913 10.175 0.7858 -1.174459      1.188263  
1 1 1 10 6  2  o 5.5390 0.7953 31.587   8.6575  37.776    12.429  25.755    12.066  6.1250 1.0146 4.9531 1.2249 1.171922       1.590531  
1 1 1 10 6  3  o 19.894 0.5050 397.250  20.085  384.000   28.384  410.537   28.425  19.561 0.7255 20.227 0.7026 -0.6668510     1.010005  
1 1 1 10 6  4  o 32.467 0.6484 1059.25  39.884  1056.54   49.074  1064.52   68.454  32.437 0.7564 32.497 1.0532 -0.5955505E-01 1.296729  
1 1 1 10 6  5  o 30.803 0.5290 953.094  32.588  960.041   46.098  946.155   46.074  30.916 0.7455 30.690 0.7506 0.2253151      1.057951  
1 1 1 10 6  6  o 17.025 0.5189 291.251  17.667  291.968   25.130  290.550   24.842  17.046 0.7372 17.005 0.7304 0.4069519E-01  1.037760  
1 1 1 10 6  7  o 9.6274 0.6017 93.394   11.561  92.512    16.866  94.175    15.879  9.5821 0.8801 9.6726 0.8208 -0.9046173E-01 1.203455  
1 1 1 10 6  8  o 22.913 0.5151 527.659  23.590  556.239   33.708  500.223   33.026  23.523 0.7165 22.303 0.7404 1.219830       1.030293  
1 1 1 10 6  9  o 5.1701 0.9309 28.416   9.7740  22.152    13.907  34.530    13.740  4.6249 1.3906 5.7152 1.2378 -1.090303      1.861758  
1 1 1 10 6  10 o 15.229 0.5482 234.701  16.665  251.679   23.580  217.761   23.555  15.785 0.7469 14.672 0.8027 1.113451       1.096453  
1 1 1 10 6  11 o 21.544 0.5294 469.072  22.795  495.042   32.693  444.504   31.799  22.127 0.7388 20.961 0.7585 1.166088       1.058831  
1 1 1 10 6  12 o 9.9757 0.6515 102.237  12.996  101.125   18.481  103.326   18.279  9.9190 0.9316 10.032 0.9110 -0.1133108     1.303017  
1 1 1 10 6  13 o 9.9922 0.6599 102.688  12.989  125.783   18.716  81.231    18.040  11.102 0.8429 8.8820 1.0155 2.220390       1.319756  
1 1 1 10 6  14 o 11.409 0.6234 133.950  14.205  143.590   20.338  124.766   19.850  11.818 0.8605 11.001 0.9022 0.8167953      1.246738  
1 1 1 10 6  15 o 8.7905 0.6868 80.539   12.071  80.093    17.282  80.964    16.867  8.7612 0.9863 8.8198 0.9562 -0.5853844E-01 1.373694  
1 1 1 10 6  16 o 5.4732 1.1600 28.867   11.980  48.436    25.362  23.246    13.592  6.3656 1.8692 4.5808 1.3742 1.784801       2.320024  
1 1 1 10 6  17 o 4.8264 1.0119 29.404   9.8896  8.1486    25.471  33.178    10.732  4.1182 1.7558 5.5346 1.0066 -1.416412      2.023853  
1 1 1 10 6  18 o 8.0035 1.0185 71.334   11.930  74.623    28.770  70.651    13.110  7.7524 1.8759 8.2546 0.7941 -0.5021520     2.037015  
1 1 1 10 6  19 o 13.266 0.8041 197.534  16.316  175.143   36.677  203.058   18.218  12.456 1.4723 14.076 0.6471 -1.619637      1.608208  
1 1 1 10 6  20 o 7.7228 1.0944 67.506   12.015  68.770    30.992  67.282    13.035  7.3806 2.0342 8.0651 0.8081 -0.6844854     2.188809  
1 1 1 10 6  21 o 11.255 0.8283 122.914  14.446  160.883   35.294  115.273   15.833  11.945 1.4774 10.564 0.7493 1.380083       1.656571  
1 1 1 10 6  22 o 6.3359 1.1135 42.476   10.544  49.922    29.377  41.375    11.296  6.3618 2.0392 6.3101 0.8951 0.5165768E-01  2.227029  
1 1 1 10 6  23 o 10.384 1.0179 118.710  14.557  121.744   36.722  118.144   15.856  10.049 1.8968 10.719 0.7396 -0.6702261     2.035859  
1 1 1 10 6  24 o 3.9285 1.1453 4.9131   16.802  -42.6553  32.070  22.908    19.725  3.2327 1.5706 4.6243 1.6673 -1.391634      2.290602  
1 1 1 10 6  25 o 5.6506 1.2980 40.725   17.585  26.286    27.593  50.601    22.820  4.9150 1.9269 6.3862 1.7395 -1.471185      2.595942  
1 1 1 10 6  26 o 5.1547 1.1823 31.341   17.377  -6.9113   28.057  55.146    22.133  3.6507 1.6779 6.6586 1.6661 -3.007944      2.364567  
1 1 1 10 6  27 o 5.7589 1.4077 49.567   19.457  56.553    30.558  44.803    25.234  5.9830 2.0827 5.5349 1.8944 0.4481049      2.815373  
1 1 1 10 6  28 o 4.6633 1.3576 31.222   20.004  38.761    32.015  26.393    25.622  4.9117 2.0220 4.4149 1.8122 0.4968390      2.715231  
1 1 1 10 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 6  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 7  0  o 28.721 0.7375 831.683  42.227  819.616   60.079  843.465   59.364  28.511 1.0569 28.931 1.0289 -0.000000      0.000000  
1 1 1 10 7  1  o 14.761 0.5217 218.762  15.401  217.705   21.575  219.860   21.990  14.725 0.7326 14.797 0.7431 -0.7184505E-01 1.043477  
1 1 1 10 7  2  o 16.394 0.6186 268.598  19.350  264.523   23.920  276.315   32.916  16.230 0.7369 16.559 0.9939 -0.3292179     1.237297  
1 1 1 10 7  3  o 42.003 0.5774 1774.07  48.501  1761.95   68.588  1786.18   68.594  41.859 0.8193 42.147 0.8137 -0.2883377     1.154726  
1 1 1 10 7  4  o 20.387 0.5090 417.701  20.743  405.030   29.406  430.252   29.265  20.078 0.7323 20.697 0.7070 -0.6190376     1.017903  
1 1 1 10 7  5  f 24.967 0.5138 626.493  25.655  631.460   36.419  621.601   36.145  25.066 0.7265 24.869 0.7267 0.1964817      1.027553  
1 1 1 10 7  6  o 9.9740 0.6060 100.110  12.071  107.982   17.345  92.717    16.809  10.356 0.8375 9.5925 0.8761 0.7629604      1.212012  
1 1 1 10 7  7  f 8.2891 0.6808 69.318   11.185  82.372    16.217  57.476    15.446  9.0380 0.8972 7.5401 1.0243 1.497920       1.361641  
1 1 1 10 7  8  o 20.095 0.5197 406.649  20.881  392.735   29.357  420.896   29.706  19.745 0.7434 20.444 0.7265 -0.6990032     1.039443  
1 1 1 10 7  9  o 5.0595 0.9007 27.293   9.3461  36.244    13.303  18.570    13.133  5.8491 1.1779 4.2699 1.3629 1.579165       1.801430  
1 1 1 10 7  10 o 11.386 0.8356 132.949  16.985  132.569   19.961  133.946   32.330  11.427 0.8734 11.345 1.4248 0.8173752E-01  1.671240  
1 1 1 10 7  11 o 14.909 0.5581 227.173  16.571  248.604   23.298  205.234   23.573  15.638 0.7449 14.181 0.8312 1.457632       1.116133  
1 1 1 10 7  12 o 4.1958 0.9770 16.875   9.7864  25.727    14.660  9.7601    13.144  4.8675 1.4188 3.5240 1.3434 1.343485       1.953953  
1 1 1 10 7  13 o 7.5580 0.8115 62.756   11.399  42.498    16.338  81.972    15.912  6.1980 1.3557 8.9180 0.8921 -2.719968      1.622912  
1 1 1 10 7  14 o 4.2766 0.9944 18.880   9.9668  24.711    14.672  13.884    13.582  4.7316 1.4296 3.8217 1.3827 0.9099598      1.988868  
1 1 1 10 7  15 f 16.679 0.5693 286.038  18.986  287.067   27.208  285.062   26.505  16.703 0.8145 16.656 0.7957 0.4776382E-01  1.138612  
1 1 1 10 7  16 o 3.6362 0.9090 12.971   8.6283  5.6111    13.455  18.112    11.245  3.2058 1.3142 4.0665 1.2561 -0.8606842     1.817945  
1 1 1 10 7  17 o 4.5318 0.9200 23.314   9.9909  6.1213    15.449  35.673    13.099  3.3913 1.4012 5.6724 1.1925 -2.281088      1.839936  
1 1 1 10 7  18 o 3.5049 0.9078 7.2396   9.0949  22.695    14.244  -3.3986   11.817  4.4781 1.4184 2.5318 1.1335 1.946382       1.815639  
1 1 1 10 7  19 o 4.8077 1.1663 17.467   10.030  45.051    27.528  13.245    10.770  6.0233 1.9774 3.5920 1.2373 2.431374       2.332560  
1 1 1 10 7  20 o 9.6551 1.0220 106.478  13.785  100.789   33.516  107.637   15.123  9.0850 1.9054 10.225 0.7395 -1.140329      2.043900  
1 1 1 10 7  21 f 7.1747 1.1132 56.120   11.441  64.904    30.921  54.726    12.315  7.0983 2.0582 7.2510 0.8492 -0.1527252     2.226480  
1 1 1 10 7  22 o 4.3021 1.1822 12.333   9.3887  30.071    30.872  10.525    9.8555  5.2981 2.0489 3.3061 1.1800 1.992020       2.364401  
1 1 1 10 7  23 f 3.3523 0.9769 8.7250   7.3280  -24.2844  30.843  10.700    7.5440  3.5019 1.6577 3.2027 1.0341 0.2991917      1.953767  
1 1 1 10 7  24 o 5.1644 1.2468 21.069   10.060  50.330    33.506  18.169    10.547  6.2704 2.1810 4.0583 1.2090 2.212128       2.493657  
1 1 1 10 7  25 o 3.9637 1.1849 9.0579   16.529  -5.8375   27.885  17.126    20.523  3.7052 1.6916 4.2221 1.6598 -0.5169697     2.369895  
1 1 1 10 7  26 o 4.7421 1.2676 26.815   17.310  11.972    27.794  36.220    22.124  4.1908 1.8110 5.2935 1.7740 -1.102695      2.535121  
1 1 1 10 7  27 o 5.2302 1.3134 28.670   18.670  76.914    31.735  3.1342    23.088  6.9598 2.1025 3.5006 1.5745 3.459141       2.626707  
1 1 1 10 7  28 o 4.4146 1.2978 27.361   18.501  33.460    29.802  23.537    23.598  4.6253 1.9315 4.2040 1.7339 0.4213176      2.595598  
1 1 1 10 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 8  0  o 6.5238 1.7120 50.851   19.300  0.0000    0.0000  50.851    19.300  6.5238 1.7120 6.5238 1.7120 -0.000000      0.000000  
1 1 1 10 8  1  o 11.630 0.5550 136.044  12.877  148.988   18.410  123.647   18.017  12.174 0.7561 11.086 0.8126 1.088074       1.109991  
1 1 1 10 8  2  o 22.883 0.5089 526.305  23.286  511.927   32.891  540.756   32.973  22.569 0.7287 23.198 0.7107 -0.6296349     1.017863  
1 1 1 10 8  3  o 26.214 0.5165 690.637  27.078  701.223   38.564  680.342   38.029  26.412 0.7300 26.016 0.7309 0.3963871      1.033028  
1 1 1 10 8  4  o 3.1774 0.8486 4.7444   8.3065  -7.3953   12.444  14.499    11.155  2.5059 1.1387 3.8489 1.2585 -1.342920      1.697174  
1 1 1 10 8  5  o 21.790 0.5178 477.613  22.553  460.076   31.917  495.100   31.872  21.389 0.7461 22.192 0.7181 -0.8038101     1.035540  
1 1 1 10 8  6  o 19.452 0.5265 380.742  20.484  384.044   29.048  377.476   28.889  19.536 0.7434 19.368 0.7458 0.1681557      1.053050  
1 1 1 10 8  7  o 14.388 0.5517 208.819  15.866  198.301   22.201  219.797   22.682  14.016 0.7920 14.760 0.7684 -0.7441893     1.103471  
1 1 1 10 8  8  o 9.2826 0.6437 87.522   11.947  84.897    16.893  90.149    16.899  9.1411 0.9240 9.4240 0.8966 -0.2828646     1.287488  
1 1 1 10 8  9  o 3.1248 0.8890 4.2099   8.6001  8.9622    12.810  0.3101    11.604  3.4705 1.3255 2.7790 1.1850 0.6914899      1.777950  
1 1 1 10 8  10 o 18.448 0.5449 346.115  20.073  373.549   28.770  320.092   28.020  19.168 0.7505 17.728 0.7903 1.440292       1.089850  
1 1 1 10 8  11 o 8.5933 0.6987 76.321   11.971  71.786    17.245  80.540    16.631  8.3339 1.0346 8.8528 0.9393 -0.5188751     1.397409  
1 1 1 10 8  12 o 8.6013 0.7117 77.422   12.111  68.713    17.732  85.038    16.582  8.1165 1.0924 9.0861 0.9125 -0.9696417     1.423322  
1 1 1 10 8  13 o 3.5059 0.8846 7.0030   9.3873  -9.7736   13.617  22.197    12.959  2.4999 1.1561 4.5120 1.3392 -2.012019      1.769186  
1 1 1 10 8  14 o 3.8863 0.9795 14.795   9.6752  11.804    14.148  17.423    13.260  3.6914 1.3970 4.0812 1.3734 -0.3897970     1.959046  
1 1 1 10 8  15 o 3.6986 0.9721 11.236   9.9664  19.340    14.476  3.9342    13.742  4.2555 1.4349 3.1416 1.3117 1.113895       1.944113  
1 1 1 10 8  16 o 4.0334 0.8875 12.345   9.4150  33.905    14.526  -3.2739   12.364  5.4602 1.3401 2.6067 1.1638 2.853536       1.774904  
1 1 1 10 8  17 o 7.9089 0.7501 66.157   11.797  73.183    17.891  60.753    15.692  8.2664 1.0821 7.5513 1.0390 0.7150631      1.500178  
1 1 1 10 8  18 o 9.8595 0.7194 104.884  13.893  90.901    20.851  116.047   18.630  9.1888 1.1346 10.530 0.8846 -1.341381      1.438700  
1 1 1 10 8  19 o 17.013 0.5810 300.232  19.720  290.849   28.629  308.703   27.202  16.735 0.8554 17.290 0.7866 -0.5555954     1.162096  
1 1 1 10 8  20 o 6.8013 0.8628 52.249   10.974  45.580    17.647  56.453    14.012  6.2816 1.4360 7.3209 0.9570 -1.039279      1.725659  
1 1 1 10 8  21 o 6.1753 1.1791 37.618   11.874  58.150    29.654  33.698    12.959  6.8343 2.0252 5.5163 1.2080 1.317971       2.358129  
1 1 1 10 8  22 o 4.3590 1.1973 15.774   10.303  18.506    33.523  15.489    10.827  4.9068 2.0487 3.8112 1.2396 1.095577       2.394529  
1 1 1 10 8  23 o 8.1221 1.1455 81.300   13.407  68.636    33.202  83.767    14.655  7.2555 2.1411 8.9886 0.8152 -1.733093      2.291007  
1 1 1 10 8  24 o 4.0824 1.0766 16.916   8.4854  -4.2653   33.994  18.323    8.7627  4.1032 1.8712 4.0616 1.0655 0.4155827E-01  2.153250  
1 1 1 10 8  25 o 4.5008 1.2792 18.363   17.244  29.139    27.953  11.744    21.910  5.0073 1.9460 3.9943 1.6610 1.012938       2.558464  
1 1 1 10 8  26 f 6.0881 1.2537 53.638   19.060  17.945    31.192  74.907    24.078  4.4533 1.9215 7.7229 1.6110 -3.269642      2.507490  
1 1 1 10 8  27 o 4.3687 1.2701 21.791   19.379  -0.5475   30.045  37.705    25.358  3.6877 1.7096 5.0497 1.8787 -1.362022      2.540150  
1 1 1 10 8  28 o 5.2344 1.3817 49.535   19.890  42.959    32.758  53.375    25.032  4.8146 2.0188 5.6542 1.8870 -0.8395958     2.763428  
1 1 1 10 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 9  0  o 3.7918 1.2270 19.977   12.539  1.6439    19.376  33.187    16.447  2.6100 1.6667 4.9736 1.8012 -0.000000      0.000000  
1 1 1 10 9  1  o 28.800 0.5230 834.030  30.122  850.551   42.752  817.746   42.446  29.085 0.7350 28.516 0.7442 0.5683765      1.045983  
1 1 1 10 9  2  o 8.9613 0.6575 80.688   11.737  91.638    17.152  71.046    16.095  9.5333 0.8996 8.3893 0.9592 1.143902       1.315049  
1 1 1 10 9  3  o 25.604 0.5199 659.387  26.619  668.304   37.662  650.486   37.628  25.778 0.7305 25.430 0.7398 0.3478203      1.039703  
1 1 1 10 9  4  o 14.889 0.5476 223.241  16.294  211.939   22.893  234.844   23.196  14.505 0.7891 15.273 0.7594 -0.7678099     1.095173  
1 1 1 10 9  5  o 29.200 0.5315 859.573  31.028  830.107   43.709  889.501   44.052  28.693 0.7617 29.708 0.7414 -1.015167      1.062946  
1 1 1 10 9  6  o 20.037 0.5300 405.766  21.177  366.755   29.727  445.959   30.174  19.050 0.7802 21.023 0.7176 -1.973551      1.060081  
1 1 1 10 9  7  o 20.683 0.5303 432.513  21.931  425.570   31.111  439.371   30.920  20.516 0.7582 20.851 0.7415 -0.3350239     1.060502  
1 1 1 10 9  8  o 15.567 0.5514 245.590  17.166  246.228   24.326  244.957   24.226  15.587 0.7803 15.547 0.7791 0.3996658E-01  1.102704  
1 1 1 10 9  9  o 10.079 0.6451 104.303  12.992  109.808   18.410  98.842    18.337  10.351 0.8893 9.8075 0.9349 0.5429773      1.290293  
1 1 1 10 9  10 o 11.288 0.6222 130.433  14.045  131.303   19.956  129.579   19.771  11.325 0.8811 11.251 0.8787 0.7388401E-01  1.244323  
1 1 1 10 9  11 o 4.3364 0.9771 19.615   9.6236  24.454    14.144  15.444    13.132  4.7301 1.3979 3.9426 1.3657 0.7874811      1.954298  
1 1 1 10 9  12 o 5.5397 0.8731 35.215   10.310  12.906    15.262  53.944    13.984  3.8591 1.4532 7.2202 0.9684 -3.361084      1.746289  
1 1 1 10 9  13 o 7.1898 0.8393 55.852   11.706  48.907    16.629  62.674    16.481  6.6559 1.2958 7.7238 1.0669 -1.067835      1.678540  
1 1 1 10 9  14 o 5.5076 0.9797 34.044   10.779  37.215    15.744  31.248    14.787  5.7484 1.3857 5.2669 1.3853 0.4814258      1.959354  
1 1 1 10 9  15 o 6.7033 0.9126 51.814   11.755  33.630    17.098  68.111    16.187  5.3746 1.5218 8.0319 1.0077 -2.657294      1.825143  
1 1 1 10 9  16 o 3.5042 0.9615 10.113   9.6032  10.458    14.291  9.8285    12.967  3.5687 1.3902 3.4398 1.3285 0.1288910      1.922900  
1 1 1 10 9  17 o 6.2375 0.9345 44.388   11.297  39.154    16.242  49.293    15.722  5.8232 1.4097 6.6518 1.2270 -0.8285384     1.868905  
1 1 1 10 9  18 o 15.025 0.6052 234.500  18.149  236.273   26.556  232.946   24.861  15.061 0.8816 14.989 0.8293 0.7195377E-01  1.210339  
1 1 1 10 9  19 o 7.2236 0.8793 59.419   11.897  46.380    18.260  69.035    15.682  6.3422 1.4685 8.1051 0.9674 -1.762903      1.758523  
1 1 1 10 9  20 o 8.6263 0.7772 81.409   12.914  69.907    20.211  89.345    16.788  8.0116 1.2613 9.2410 0.9083 -1.229428      1.554378  
1 1 1 10 9  21 o 7.1464 0.9390 60.193   12.435  42.619    19.765  71.707    15.998  6.0236 1.6098 8.2691 0.9673 -2.245520      1.878092  
1 1 1 10 9  22 o 4.0632 0.9397 16.681   10.663  -7.2318   17.962  29.693    13.250  2.9980 1.3645 5.1284 1.2924 -2.130385      1.879351  
1 1 1 10 9  23 o 16.476 0.8635 322.470  21.187  243.320   46.865  342.804   23.753  14.639 1.6007 18.313 0.6486 -3.673321      1.727058  
1 1 1 10 9  24 o 9.8112 1.0332 95.875   14.631  135.847   37.709  88.790    15.875  10.426 1.8774 9.1964 0.8631 1.229720       2.066319  
1 1 1 10 9  25 o 3.1789 1.0552 -14.6148 17.109  -29.4941  27.897  -5.6449   21.660  3.0952 1.4945 3.2627 1.4901 -0.1674860     2.110442  
1 1 1 10 9  26 f 10.037 1.2290 143.291  22.221  95.188    34.665  176.847   28.953  7.7056 2.1616 12.369 1.1704 -4.663183      2.458069  
1 1 1 10 9  27 o 5.9151 1.4038 58.711   20.141  50.144    32.524  64.039    25.651  5.3379 2.0922 6.4923 1.8723 -1.154369      2.807652  
1 1 1 10 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 9  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 10 0  o 2.5528 1.0801 -16.6226 12.720  -51.0818  17.518  21.808    18.500  1.2998 0.9567 3.8057 1.9368 -0.000000      0.000000  
1 1 1 10 10 1  o 12.146 0.6029 149.351  14.605  161.731   20.614  136.872   20.695  12.658 0.8143 11.634 0.8894 1.023839       1.205893  
1 1 1 10 10 2  o 8.6607 0.7065 76.457   12.189  81.692    16.930  70.823    17.564  8.9769 0.9430 8.3445 1.0524 0.6323957      1.413096  
1 1 1 10 10 3  o 4.1321 0.9889 16.559   9.7211  17.228    13.895  15.917    13.605  4.1924 1.4059 4.0718 1.3910 0.1205649      1.977710  
1 1 1 10 10 4  o 23.851 0.5244 574.722  25.007  589.750   35.336  559.645   35.394  24.167 0.7311 23.535 0.7520 0.6315117      1.048780  
1 1 1 10 10 5  o 5.4221 0.9895 31.558   10.941  38.672    15.602  24.676    15.346  6.0054 1.3337 4.8388 1.4621 1.166602       1.979024  
1 1 1 10 10 6  o 3.5223 0.9558 8.9648   9.4825  11.061    13.464  6.9015    13.357  3.6728 1.3685 3.3718 1.3347 0.3010266      1.911575  
1 1 1 10 10 7  o 9.0372 0.7030 83.902   12.687  78.486    17.921  89.344    17.962  8.7371 1.0256 9.3373 0.9619 -0.6002131     1.406042  
1 1 1 10 10 8  o 9.2880 0.6889 89.108   12.756  80.656    17.938  97.753    18.142  8.8295 1.0158 9.7465 0.9307 -0.9170465     1.377705  
1 1 1 10 10 9  o 18.160 0.5416 335.406  19.669  332.208   27.806  338.608   27.827  18.072 0.7693 18.248 0.7625 -0.1760025     1.083128  
1 1 1 10 10 10 o 3.0390 0.8777 1.6746   9.2124  -9.9452   13.637  11.430    12.495  2.4966 1.1554 3.5815 1.3215 -1.084877      1.755346  
1 1 1 10 10 11 o 10.214 0.6770 108.223  13.768  103.601   20.159  112.264   18.849  9.9906 1.0089 10.438 0.9029 -0.4473629     1.353935  
1 1 1 10 10 12 o 14.445 0.5995 215.031  17.288  233.702   24.917  197.698   24.007  15.059 0.8273 13.830 0.8679 1.229077       1.199031  
1 1 1 10 10 13 o 10.371 0.6755 111.543  13.883  133.294   20.301  92.435    19.027  11.343 0.8949 9.4000 1.0121 1.942654       1.350993  
1 1 1 10 10 14 f 6.3756 0.9504 45.605   11.727  52.275    17.286  39.917    15.961  6.8302 1.3131 5.9209 1.3743 0.9093170      1.900779  
1 1 1 10 10 15 o 9.4795 0.7234 95.220   13.654  87.766    19.639  102.195   18.997  9.0903 1.0802 9.8688 0.9625 -0.7784739     1.446795  
1 1 1 10 10 16 o 3.2564 0.9297 5.6957   9.8634  -3.5724   14.819  13.068    13.216  2.8357 1.2695 3.6770 1.3586 -0.8413155     1.859410  
1 1 1 10 10 17 o 8.3743 0.7754 74.725   12.936  84.210    18.801  66.197    17.827  8.8968 1.0566 7.8518 1.1352 1.045007       1.550843  
1 1 1 10 10 18 o 2.4849 0.7890 -6.8656  8.7425  -19.5875  13.438  2.4709    11.512  2.1366 1.0330 2.8332 1.1928 -0.6965730     1.577957  
1 1 1 10 10 19 o 2.7633 0.8772 -4.0217  10.085  -8.8596   15.754  -0.6628   13.127  2.7186 1.2524 2.8080 1.2286 -0.8938813E-01 1.754417  
1 1 1 10 10 20 o 4.4434 1.0398 20.272   10.578  27.994    17.203  15.578    13.413  4.9688 1.5567 3.9180 1.3789 1.050781       2.079591  
1 1 1 10 10 21 o 7.2806 0.9449 60.536   12.884  50.922    20.580  66.731    16.522  6.6105 1.5784 7.9507 1.0390 -1.340249      1.889715  
1 1 1 10 10 22 o 10.675 0.7316 117.946  15.431  139.810   24.209  102.985   20.025  11.477 1.0547 9.8719 1.0143 1.605351       1.463236  
1 1 1 10 10 23 o 3.2659 0.9444 1.7865   9.1125  17.879    17.542  -4.1606   10.664  4.1783 1.5610 2.3536 1.0632 1.824696       1.888710  
1 1 1 10 10 24 o 6.2061 0.9327 50.677   11.509  21.675    19.022  67.425    14.455  4.4277 1.6310 7.9845 0.9052 -3.556758      1.865399  
1 1 1 10 10 25 o 14.728 0.8503 247.718  24.384  220.015   37.369  268.258   32.178  13.777 1.3562 15.680 1.0261 -1.903010      1.700662  
1 1 1 10 10 26 o 5.1795 1.2606 38.161   19.505  -1.1373   31.879  61.676    24.660  3.7668 1.7513 6.5922 1.8135 -2.825426      2.521107  
1 1 1 10 10 27 f 3.6001 1.1677 4.2477   19.950  -18.2828  32.849  17.414    25.111  3.2838 1.5941 3.9165 1.7068 -0.6326463     2.335481  
1 1 1 10 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 11 0  o 3.4078 1.3806 15.283   15.190  20.429    21.019  9.6572    21.977  3.7105 2.0138 3.1052 1.8893 -0.000000      0.000000  
1 1 1 10 11 1  o 8.2293 0.7301 69.137   12.002  68.779    17.361  69.465    16.612  8.2047 1.0580 8.2539 1.0063 -0.4917049E-01 1.460129  
1 1 1 10 11 2  o 13.046 0.5967 173.364  15.354  138.693   21.418  210.020   22.023  11.681 0.9168 14.410 0.7641 -2.728810      1.193481  
1 1 1 10 11 3  o 12.905 0.5967 168.819  15.395  162.397   21.502  175.575   22.052  12.652 0.8498 13.158 0.8380 -0.5059137     1.193444  
1 1 1 10 11 4  o 7.8092 0.7842 62.757   12.238  64.536    17.131  60.903    17.488  7.9277 1.0805 7.6906 1.1370 0.2371016      1.568468  
1 1 1 10 11 5  o 18.655 0.5430 354.366  20.205  326.107   28.654  382.311   28.496  17.901 0.8004 19.409 0.7341 -1.508078      1.086012  
1 1 1 10 11 6  o 17.924 0.5499 327.332  19.695  347.414   28.350  308.603   27.380  18.459 0.7679 17.389 0.7873 1.070129       1.099756  
1 1 1 10 11 7  o 16.418 0.5662 275.394  18.558  260.616   26.469  289.682   26.026  15.972 0.8286 16.863 0.7717 -0.8907738     1.132303  
1 1 1 10 11 8  o 11.951 0.6195 146.398  14.783  138.700   21.072  153.861   20.746  11.632 0.9058 12.270 0.8454 -0.6386747     1.238993  
1 1 1 10 11 9  o 6.3043 0.9257 43.806   11.288  40.460    16.103  47.038    15.828  6.0394 1.3653 6.5691 1.2504 -0.5297375     1.851344  
1 1 1 10 11 10 o 3.3456 0.9299 6.5760   9.4020  13.543    13.634  0.2580    12.983  3.8055 1.3840 2.8858 1.2424 0.9197025      1.859867  
1 1 1 10 11 11 o 6.6905 0.9156 49.361   11.806  52.314    16.847  46.511    16.551  6.9043 1.2667 6.4766 1.3224 0.4276710      1.831228  
1 1 1 10 11 12 o 10.818 0.6634 121.574  14.211  144.906   20.595  100.371   19.633  11.837 0.8699 9.7990 1.0018 2.038146       1.326789  
1 1 1 10 11 13 o 13.010 0.6354 176.797  16.515  171.090   23.651  182.228   23.072  12.789 0.9246 13.231 0.8719 -0.4420414     1.270883  
1 1 1 10 11 14 o 5.0702 1.0698 29.460   11.669  32.102    17.025  27.118    16.027  5.2654 1.5273 4.8749 1.4985 0.3904219      2.139675  
1 1 1 10 11 15 o 11.075 0.6783 129.484  14.996  140.160   21.488  119.346   20.939  11.537 0.9313 10.613 0.9864 0.9235935      1.356619  
1 1 1 10 11 16 o 14.087 0.6091 207.289  17.148  201.464   24.454  212.924   24.053  13.879 0.8810 14.296 0.8413 -0.4169426     1.218145  
1 1 1 10 11 17 o 6.0567 0.9457 40.823   11.905  64.004    17.395  20.399    16.328  7.7472 1.1227 4.3662 1.5223 3.380960       1.891471  
1 1 1 10 11 18 f 6.0307 0.9664 42.293   11.394  35.110    17.087  48.043    15.289  5.4792 1.5106 6.5822 1.2058 -1.103018      1.932832  
1 1 1 10 11 19 o 5.6304 0.9489 37.665   11.844  13.698    17.981  56.033    15.741  3.9947 1.5584 7.2662 1.0832 -3.271514      1.897882  
1 1 1 10 11 20 o 9.7241 0.7618 101.205  14.628  92.750    21.846  108.077   19.695  9.3000 1.1745 10.148 0.9704 -0.8483601     1.523534  
1 1 1 10 11 21 o 5.9854 0.9934 44.209   12.238  23.852    19.980  56.435    15.483  4.6811 1.6791 7.2898 1.0620 -2.608756      1.986748  
1 1 1 10 11 22 o 9.4306 0.7966 95.243   14.985  93.529    21.860  96.763    20.582  9.3252 1.1721 9.5361 1.0792 -0.2109938     1.593232  
1 1 1 10 11 23 o 2.9100 0.8996 -1.4525  10.450  -20.3239  18.810  6.9729    12.569  2.6380 1.2615 3.1819 1.2828 -0.5439253     1.799182  
1 1 1 10 11 24 o 3.7438 1.2153 0.4864   16.389  1.8606    17.934  -6.4778   40.371  3.2778 1.4351 4.2097 1.9618 -0.9319007     2.430617  
1 1 1 10 11 25 o 8.0104 1.4749 94.390   20.314  90.541    22.175  114.473   50.658  8.7535 1.2666 7.2673 2.6640 1.486260       2.949786  
1 1 1 10 11 26 f 5.5836 1.6225 57.163   27.849  40.609    34.386  88.718    47.476  4.9386 2.0695 6.2286 2.4994 -1.289967      3.244994  
1 1 1 10 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 12 0  f 5.9223 1.4480 48.090   16.112  59.860    22.847  36.445    22.726  6.9522 1.9005 4.8924 2.1853 -0.000000      0.000000  
1 1 1 10 12 1  o 7.2083 0.8279 54.644   11.671  59.117    16.836  50.507    16.193  7.5509 1.1148 6.8657 1.2241 0.6852393      1.655705  
1 1 1 10 12 2  o 5.8826 0.9312 37.550   11.402  57.358    16.335  18.728    15.923  7.4337 1.0987 4.3315 1.5037 3.102253       1.862314  
1 1 1 10 12 3  o 6.2409 0.9673 42.803   11.739  44.134    16.415  41.410    16.795  6.3535 1.3343 6.1283 1.4008 0.2252040      1.934590  
1 1 1 10 12 4  o 17.704 0.5443 319.878  19.255  304.818   27.311  334.762   27.150  17.281 0.7902 18.128 0.7488 -0.8477306     1.088678  
1 1 1 10 12 5  o 11.321 0.6489 131.273  14.686  127.953   20.440  134.816   21.116  11.174 0.9146 11.468 0.9206 -0.2939310     1.297732  
1 1 1 10 12 6  o 9.2784 0.7178 88.771   13.297  95.580    18.986  82.217    18.629  9.6357 0.9852 8.9211 1.0441 0.7146292      1.435507  
1 1 1 10 12 7  o 3.2638 0.9336 3.9828   9.8670  12.681    14.283  -3.9572   13.647  3.7807 1.4093 2.7468 1.2248 1.033840       1.867148  
1 1 1 10 12 8  o 9.0379 0.9819 81.972   16.475  103.031   30.672  73.432    19.532  9.7142 1.5787 8.3617 1.1680 1.352523       1.963786  
1 1 1 10 12 9  o 9.8223 0.6982 100.549  13.711  103.914   19.465  97.235    19.316  9.9907 0.9742 9.6539 1.0004 0.3367672      1.396387  
1 1 1 10 12 10 o 9.5574 0.7044 95.822   13.369  84.694    19.138  106.429   18.684  8.9840 1.0651 10.131 0.9221 -1.146868      1.408837  
1 1 1 10 12 11 o 6.5288 0.9414 46.866   12.092  62.424    17.647  33.097    16.601  7.6690 1.1506 5.3886 1.4903 2.280390       1.882753  
1 1 1 10 12 12 o 5.4711 0.9714 33.039   11.466  53.793    16.955  15.554    15.563  6.9553 1.2655 3.9868 1.4741 2.968483       1.942791  
1 1 1 10 12 13 o 6.3567 0.9589 45.981   11.791  41.976    17.384  49.393    16.045  6.0410 1.4560 6.6725 1.2482 -0.6314888     1.917773  
1 1 1 10 12 14 o 3.3092 0.9578 6.3892   10.227  1.7515    15.158  10.265    13.856  3.1106 1.3408 3.5079 1.3682 -0.3973176     1.915653  
1 1 1 10 12 15 o 4.6496 1.0464 24.401   11.529  14.186    16.776  33.545    15.872  3.9300 1.5130 5.3692 1.4458 -1.439153      2.092743  
1 1 1 10 12 16 o 11.092 0.7142 130.539  15.670  110.126   22.277  150.533   22.047  10.179 1.0943 12.006 0.9182 -1.827444      1.428465  
1 1 1 10 12 17 o 8.6732 0.7843 80.109   13.526  92.140    19.654  69.283    18.644  9.3166 1.0548 8.0297 1.1609 1.286852       1.568544  
1 1 1 10 12 18 o 15.806 0.6092 260.287  19.237  245.670   27.117  275.096   27.295  15.343 0.8837 16.270 0.8388 -0.9265738     1.218417  
1 1 1 10 12 19 o 8.7872 0.8072 83.307   13.992  73.433    20.620  91.734    19.050  8.2437 1.2507 9.3307 1.0208 -1.086989      1.614379  
1 1 1 10 12 20 o 6.6050 0.9785 51.415   12.571  35.550    19.337  63.030    16.545  5.5019 1.6365 7.7081 1.0732 -2.206255      1.957039  
1 1 1 10 12 21 o 5.0118 1.0733 27.977   11.452  33.364    18.487  24.623    14.588  5.3512 1.6021 4.6724 1.4286 0.6788297      2.146507  
1 1 1 10 12 22 o 5.0487 1.0866 29.927   11.750  31.133    18.977  29.176    14.963  5.1016 1.6394 4.9958 1.4267 0.1057663      2.173263  
1 1 1 10 12 23 o 6.3613 1.0009 42.005   13.537  83.380    22.125  17.248    17.114  8.6386 1.2806 4.0839 1.5387 4.554693       2.001838  
1 1 1 10 12 24 o 3.7529 1.2624 -8.3301  15.700  -12.3376  16.726  21.368    45.532  2.6267 1.2364 4.8792 2.2013 -2.252502      2.524742  
1 1 1 10 12 25 o 3.8542 1.2896 -7.8265  16.730  -15.6684  17.982  42.672    45.632  2.5904 1.2373 5.1181 2.2631 -2.527785      2.579233  
1 1 1 10 12 26 o 6.2648 1.6269 64.675   21.596  52.744    23.475  130.388   55.091  5.7849 1.8195 6.7447 2.6974 -0.9598145     3.253699  
1 1 1 10 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 12 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 13 0  o 14.588 0.8586 222.624  24.503  206.953   35.599  236.733   33.779  14.050 1.2919 15.126 1.1311 -0.000000      0.000000  
1 1 1 10 13 1  o 5.4016 1.0649 31.985   11.948  34.605    17.172  29.527    16.635  5.6042 1.5017 5.1989 1.5103 0.4052906      2.129758  
1 1 1 10 13 2  o 3.9426 1.0536 12.307   11.465  7.7628    15.662  17.553    16.830  3.5875 1.4370 4.2977 1.5411 -0.7101238     2.107147  
1 1 1 10 13 3  o 6.3354 0.9881 44.475   12.529  56.446    17.241  31.078    18.239  7.3571 1.1717 5.3138 1.5914 2.043344       1.976199  
1 1 1 10 13 4  o 4.9192 1.0486 26.604   11.174  27.252    15.608  25.922    16.003  4.9716 1.4682 4.8667 1.4977 0.1049151      2.097292  
1 1 1 10 13 5  o 9.4901 0.7085 94.344   13.325  103.185   18.309  84.388    19.429  9.9961 0.9158 8.9841 1.0813 1.011993       1.417038  
1 1 1 10 13 6  o 8.8056 0.7540 81.219   13.040  63.253    18.173  100.289   18.723  7.7595 1.1710 9.8518 0.9502 -2.092340      1.508061  
1 1 1 10 13 7  o 12.325 0.6304 157.013  15.536  160.227   21.910  153.763   22.034  12.457 0.8794 12.193 0.9035 0.2645273      1.260860  
1 1 1 10 13 8  o 7.9487 0.8626 69.063   13.107  81.206    18.204  55.993    18.887  8.8053 1.0337 7.0922 1.3812 1.713114       1.725155  
1 1 1 10 13 9  o 8.7146 0.7833 80.046   13.649  82.055    19.326  78.046    19.279  8.8290 1.0945 8.6001 1.1209 0.2288675      1.566609  
1 1 1 10 13 10 o 3.7685 1.1210 3.1487   12.604  19.065    25.489  -2.0032   14.502  4.6371 1.8412 2.8999 1.2793 1.737226       2.241994  
1 1 1 10 13 11 o 4.0269 0.9584 13.888   10.957  -5.8780   16.163  30.693    14.904  2.8804 1.3044 5.1733 1.4044 -2.292911      1.916722  
1 1 1 10 13 12 o 9.3537 0.7507 92.682   14.036  96.671    20.135  88.911    19.578  9.5533 1.0538 9.1542 1.0693 0.3990507      1.501336  
1 1 1 10 13 13 o 4.6633 1.0738 24.435   11.873  32.879    16.839  16.085    16.744  5.2838 1.5150 4.0427 1.5222 1.241183       2.147635  
1 1 1 10 13 14 o 8.6632 0.7926 80.573   13.666  91.116    19.691  70.776    18.982  9.2384 1.0657 8.0880 1.1734 1.150360       1.585144  
1 1 1 10 13 15 o 7.3002 0.9015 58.524   12.891  57.134    18.276  59.901    18.186  7.1474 1.3274 7.4529 1.2201 -0.3054533     1.802945  
1 1 1 10 13 16 o 11.493 0.6950 139.080  15.961  132.594   22.536  145.608   22.609  11.211 1.0051 11.775 0.9601 -0.5642490     1.389972  
1 1 1 10 13 17 o 11.879 0.6817 148.434  16.178  153.824   23.573  143.634   22.243  12.075 0.9761 11.683 0.9519 0.3919306      1.363418  
1 1 1 10 13 18 f 10.173 0.7631 111.275  15.201  90.036    22.084  130.400   20.956  9.1664 1.2046 11.180 0.9372 -2.013281      1.526263  
1 1 1 10 13 19 o 10.599 0.7486 118.854  15.656  144.432   22.672  95.538    21.646  11.739 0.9657 9.4599 1.1441 2.278797       1.497177  
1 1 1 10 13 20 o 18.358 0.6006 350.497  22.035  350.380   31.790  350.605   30.570  18.340 0.8667 18.375 0.8318 -0.3485870E-01 1.201284  
1 1 1 10 13 21 o 9.0245 0.8107 86.454   14.498  103.351   22.236  73.960    19.121  9.7837 1.1364 8.2654 1.1567 1.518261       1.621488  
1 1 1 10 13 22 o 5.3582 1.1262 33.889   12.711  40.046    20.433  30.002    16.235  5.6934 1.6795 5.0230 1.5008 0.6703963      2.252335  
1 1 1 10 13 23 o 3.2796 0.9637 6.6160   10.513  -1.6180   17.882  10.965    12.996  3.1180 1.3953 3.4411 1.3298 -0.3231056     1.927450  
1 1 1 10 13 24 o 5.3456 1.4553 41.038   18.478  38.568    19.908  56.403    49.651  5.2774 1.6774 5.4139 2.3786 -0.1365047     2.910528  
1 1 1 10 13 25 o 3.6620 1.1844 7.1016   17.500  12.935    18.928  -27.2441  45.929  3.6456 1.5319 3.6784 1.8067 -0.3272486E-01 2.368742  
1 1 1 10 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 14 0  o 11.938 0.9688 152.367  22.304  143.574   30.708  162.186   32.449  11.556 1.3808 12.320 1.3591 -0.000000      0.000000  
1 1 1 10 14 1  o 11.087 0.6680 127.211  14.785  122.162   21.251  131.947   20.584  10.861 0.9784 11.314 0.9097 -0.4529867     1.335945  
1 1 1 10 14 2  o 8.6500 0.8650 82.580   13.922  102.524   19.032  59.623    20.419  9.9591 0.9555 7.3410 1.4422 2.618095       1.730045  
1 1 1 10 14 3  o 14.621 0.6057 219.146  17.677  200.294   24.423  239.883   25.616  13.954 0.8751 15.289 0.8377 -1.334725      1.211473  
1 1 1 10 14 4  o 5.8802 1.0314 38.912   12.076  40.495    17.037  37.313    17.120  6.0080 1.4372 5.7523 1.4797 0.2556849      2.062739  
1 1 1 10 14 5  o 12.771 0.6415 168.867  16.375  162.248   22.718  176.025   23.625  12.511 0.9079 13.032 0.9064 -0.5211020     1.282941  
1 1 1 10 14 6  o 11.830 0.6446 145.004  15.143  168.437   21.852  123.354   21.004  12.775 0.8553 10.886 0.9647 1.888499       1.289240  
1 1 1 10 14 7  o 5.0315 1.0678 28.144   11.658  33.460    17.095  23.521    15.939  5.4262 1.5165 4.6367 1.5038 0.7895012      2.135648  
1 1 1 10 14 8  o 5.4710 1.0444 34.190   11.776  39.032    16.621  29.308    16.688  5.8633 1.4301 5.0787 1.5225 0.7846432      2.088843  
1 1 1 10 14 9  o 10.706 0.7263 120.990  15.298  150.308   22.270  94.793    21.051  11.986 0.9290 9.4267 1.1166 2.559614       1.452515  
1 1 1 10 14 10 o 10.989 0.6989 127.038  15.325  139.073   22.060  115.813   21.304  11.508 0.9585 10.470 1.0174 1.038015       1.397808  
1 1 1 10 14 11 o 8.1064 0.8802 71.910   13.715  88.513    19.987  57.134    18.854  9.1088 1.0971 7.1040 1.3767 2.004805       1.760414  
1 1 1 10 14 12 o 11.205 0.9541 141.922  18.859  131.624   35.222  146.061   22.330  10.635 1.6559 11.774 0.9483 -1.138279      1.908188  
1 1 1 10 14 13 o 5.9752 1.0828 42.070   12.999  42.393    18.314  41.742    18.454  6.0026 1.5231 5.9477 1.5394 0.5497265E-01  2.165534  
1 1 1 10 14 14 o 7.6664 0.9047 64.502   13.583  67.018    19.277  62.021    19.142  7.8823 1.2228 7.4505 1.3336 0.4317551      1.809313  
1 1 1 10 14 15 o 7.1020 0.9894 57.323   13.538  54.487    19.501  59.961    18.809  6.8920 1.4602 7.3120 1.3354 -0.4200110     1.978743  
1 1 1 10 14 16 o 6.2940 1.0620 46.351   13.282  54.774    18.911  38.151    18.659  6.9147 1.4151 5.6733 1.5839 1.241464       2.123977  
1 1 1 10 14 17 o 6.0871 1.0485 41.858   13.053  59.361    19.212  26.848    17.791  7.2877 1.3683 4.8864 1.5889 2.401299       2.096907  
1 1 1 10 14 18 o 5.4294 1.0554 35.192   12.685  18.375    19.483  47.564    16.712  4.3464 1.6407 6.5124 1.3281 -2.166096      2.110887  
1 1 1 10 14 19 o 8.3605 0.8805 75.656   14.671  84.849    21.404  67.510    20.148  8.8571 1.2083 7.8638 1.2810 0.9933538      1.760970  
1 1 1 10 14 20 f 5.0375 1.1616 29.767   13.458  24.684    21.945  32.830    17.039  4.7703 1.7527 5.3046 1.5248 -0.5342851     2.323156  
1 1 1 10 14 21 o 10.058 0.7876 111.532  15.486  93.108    22.929  126.987   21.000  9.1807 1.2488 10.936 0.9602 -1.754822      1.575232  
1 1 1 10 14 22 o 11.666 0.7305 148.238  16.862  136.661   25.017  157.876   22.825  11.168 1.1200 12.163 0.9383 -0.9949493     1.461068  
1 1 1 10 14 23 o 3.5311 0.9914 8.3186   10.352  23.148    17.655  0.5486    12.780  4.3213 1.5744 2.7409 1.2054 1.580388       1.982895  
1 1 1 10 14 24 o 5.1563 1.3971 41.558   19.257  43.387    20.916  31.381    49.334  5.5330 1.7138 4.7796 2.2069 0.7534266      2.794182  
1 1 1 10 14 25 o 5.6234 1.5054 51.104   19.087  43.133    20.750  94.934    48.657  5.2999 1.7154 5.9468 2.4743 -0.6468792     3.010822  
1 1 1 10 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 14 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 15 0  o 3.3665 1.4225 14.918   16.978  15.933    23.093  13.725    25.048  3.3917 1.9981 3.3413 2.0252 -0.000000      0.000000  
1 1 1 10 15 1  o 8.7761 0.7910 81.226   13.871  79.642    19.158  82.971    20.110  8.6930 1.1019 8.8591 1.1350 -0.1660528     1.581900  
1 1 1 10 15 2  o 10.889 0.6845 123.532  14.839  109.041   20.757  138.678   21.220  10.213 1.0162 11.564 0.9175 -1.351094      1.369085  
1 1 1 10 15 3  o 5.4492 1.0820 33.843   12.252  34.947    16.415  32.453    18.409  5.5583 1.4584 5.3402 1.5987 0.2181153      2.163919  
1 1 1 10 15 4  o 4.5389 1.0723 21.223   11.914  11.967    16.675  30.877    17.029  3.8556 1.5017 5.2223 1.5312 -1.366642      2.144668  
1 1 1 10 15 5  o 7.7059 0.8988 64.603   13.463  66.478    18.298  62.390    19.879  7.9185 1.1554 7.4932 1.3772 0.4252329      1.797677  
1 1 1 10 15 6  o 7.7688 0.8531 64.477   13.207  66.862    19.659  62.516    17.830  7.8815 1.2472 7.6560 1.1645 0.2255192      1.706289  
1 1 1 10 15 7  o 5.9671 1.0757 41.491   12.876  39.778    18.739  43.024    17.722  5.8259 1.5719 6.1083 1.4687 -0.2823830     2.151310  
1 1 1 10 15 8  o 6.0878 1.0611 43.135   12.840  41.473    18.527  44.672    17.811  5.9518 1.5434 6.2238 1.4567 -0.2720790     2.122295  
1 1 1 10 15 9  o 4.2445 1.0834 18.410   11.854  21.853    16.842  15.030    16.687  4.4815 1.5470 4.0076 1.5171 0.4738402      2.166751  
1 1 1 10 15 10 o 6.9691 0.9780 57.085   13.292  79.359    18.615  33.910    18.988  8.6074 1.0813 5.3308 1.6298 3.276648       1.955904  
1 1 1 10 15 11 o 7.9671 0.9071 71.364   13.821  59.393    20.176  81.949    18.971  7.1786 1.4551 8.7555 1.0834 -1.576892      1.814122  
1 1 1 10 15 12 o 10.598 0.7390 119.076  15.630  123.364   23.003  115.398   21.303  10.760 1.0689 10.435 1.0207 0.3248577      1.477996  
1 1 1 10 15 13 o 6.9321 1.0186 54.775   13.929  69.611    19.750  40.092    19.648  8.0299 1.2298 5.8343 1.6241 2.195532       2.037180  
1 1 1 10 15 14 o 9.2603 1.1209 88.568   18.128  123.243   36.291  77.041    20.925  10.093 1.8666 8.4275 1.2415 1.665694       2.241729  
1 1 1 10 15 15 o 5.5613 1.1376 36.382   13.370  41.668    19.819  31.968    18.111  5.9084 1.6260 5.2141 1.5913 0.6943903      2.275133  
1 1 1 10 15 16 o 4.6684 1.1028 23.731   12.127  28.045    17.760  19.963    16.599  4.9754 1.5846 4.3614 1.5341 0.6139731      2.205513  
1 1 1 10 15 17 o 4.9798 1.0799 27.548   12.205  38.388    17.724  17.772    16.832  5.7565 1.5179 4.2032 1.5364 1.553288       2.159715  
1 1 1 10 15 18 o 3.2656 1.0010 1.0936   12.014  3.2804    18.028  -0.6533   16.113  3.4342 1.4710 3.0969 1.3580 0.3372846      2.001953  
1 1 1 10 15 19 o 11.214 0.7532 134.183  16.519  168.309   23.711  101.997   23.027  12.683 0.9347 9.7455 1.1814 2.937690       1.506494  
1 1 1 10 15 20 o 16.874 0.6289 299.511  21.221  302.191   30.358  296.950   29.675  16.941 0.8960 16.806 0.8829 0.1352978      1.257870  
1 1 1 10 15 21 o 4.6050 1.1140 24.601   12.965  13.954    19.393  33.206    17.434  3.9781 1.5971 5.2319 1.5534 -1.253757      2.227928  
1 1 1 10 15 22 o 3.7626 1.0392 13.012   12.086  0.1902    19.127  21.535    15.594  3.2572 1.4513 4.2680 1.4877 -1.010818      2.078358  
1 1 1 10 15 23 o 9.9733 1.3219 119.468  20.289  107.815   22.406  172.539   47.814  9.6927 1.1558 10.254 2.3777 -0.5612421     2.643780  
1 1 1 10 15 24 o 4.3862 1.3087 27.521   18.551  30.703    19.994  7.8408    49.730  4.5965 1.6754 4.1760 2.0111 0.4204907      2.617472  
1 1 1 10 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 16 0  o 4.0477 1.5483 26.586   17.736  21.454    25.375  31.488    24.799  3.7342 2.1409 4.3612 2.2373 -0.000000      0.000000  
1 1 1 10 16 1  o 13.283 0.6611 183.960  17.557  178.247   24.843  189.658   24.815  13.068 0.9505 13.498 0.9192 -0.4301758     1.322297  
1 1 1 10 16 2  o 4.5991 1.0356 20.443   12.686  40.246    17.552  -1.2193   18.358  5.9182 1.4853 3.2800 1.4436 2.638229       2.071192  
1 1 1 10 16 3  o 3.9482 1.0771 13.014   12.290  6.6455    17.411  19.337    17.349  3.5689 1.4821 4.3276 1.5632 -0.7587600     2.154105  
1 1 1 10 16 4  o 6.1021 1.1212 43.569   13.813  39.687    18.986  47.933    20.132  5.8117 1.5882 6.3924 1.5830 -0.5806966     2.242394  
1 1 1 10 16 5  o 6.5846 1.0177 49.899   13.028  53.417    18.087  46.106    18.781  6.8728 1.3640 6.2964 1.5107 0.5763721      2.035363  
1 1 1 10 16 6  o 8.9449 0.8009 85.252   14.243  73.429    19.564  98.586    20.776  8.2603 1.1842 9.6294 1.0788 -1.369093      1.601879  
1 1 1 10 16 7  o 3.7627 1.0203 10.485   11.360  0.5948    15.925  20.732    16.210  3.1429 1.3645 4.3825 1.5174 -1.239687      2.040684  
1 1 1 10 16 8  o 12.672 0.6668 169.316  16.875  159.135   23.836  179.546   23.893  12.270 0.9713 13.074 0.9138 -0.8037634     1.333597  
1 1 1 10 16 9  o 13.072 0.6918 180.742  18.003  202.012   25.693  160.225   25.233  13.865 0.9266 12.280 1.0274 1.585059       1.383528  
1 1 1 10 16 10 f 10.143 0.7858 110.462  15.915  118.245   22.645  102.865   22.372  10.518 1.0765 9.7685 1.1451 0.7491274      1.571693  
1 1 1 10 16 11 o 4.1727 1.1105 15.298   12.648  24.687    19.654  8.6614    16.525  4.7360 1.6689 3.6095 1.4654 1.126580       2.220928  
1 1 1 10 16 12 o 14.234 0.6500 211.617  18.488  213.443   26.773  209.952   25.561  14.281 0.9374 14.187 0.9008 0.9304619E-01  1.300075  
1 1 1 10 16 13 o 6.5287 1.0593 49.501   13.731  36.186    19.008  64.033    19.857  5.5285 1.6168 7.5289 1.3692 -2.000400      2.118620  
1 1 1 10 16 14 o 3.6012 1.0429 5.5508   12.423  17.079    18.334  -4.2343   16.892  4.1936 1.5896 3.0087 1.3505 1.184922       2.085827  
1 1 1 10 16 15 o 7.5418 0.9977 63.028   14.588  81.038    21.422  47.453    19.921  8.6843 1.2334 6.3994 1.5686 2.284925       1.995456  
1 1 1 10 16 16 o 4.6704 1.1550 23.350   13.380  28.953    19.562  18.426    18.340  5.0363 1.6676 4.3046 1.5985 0.7316875      2.309950  
1 1 1 10 16 17 o 6.4571 1.0247 47.671   13.823  72.752    19.975  24.622    19.149  8.2013 1.2178 4.7129 1.6482 3.488369       2.049314  
1 1 1 10 16 18 o 6.0415 1.2520 50.719   18.846  65.822    21.071  -9.7081   42.146  7.6231 1.4347 4.4599 2.0523 3.163186       2.504023  
1 1 1 10 16 19 o 3.5668 1.0472 2.2250   13.136  19.796    19.602  -12.0957  17.697  4.3565 1.6455 2.7771 1.2957 1.579388       2.094389  
1 1 1 10 16 20 o 5.1026 1.1790 31.734   13.858  30.215    19.625  33.245    19.571  4.9963 1.6708 5.2089 1.6639 -0.2125783     2.357987  
1 1 1 10 16 21 o 5.6241 1.1593 40.322   14.023  33.407    19.902  47.139    19.761  5.1229 1.6813 6.1254 1.5967 -1.002435      2.318677  
1 1 1 10 16 22 o 5.2601 1.1775 37.535   14.133  47.099    20.586  29.010    19.437  5.8667 1.6728 4.6536 1.6575 1.213063       2.354953  
1 1 1 10 16 23 o 8.7479 1.4525 121.739  21.573  120.893   23.918  125.432   49.959  10.124 1.1812 7.3716 2.6540 2.752553       2.905003  
1 1 1 10 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 17 0  o 2.8361 1.3175 -4.3441  19.282  12.432    28.085  -19.3016  26.519  3.3499 2.0825 2.3223 1.6144 -0.000000      0.000000  
1 1 1 10 17 1  o 11.933 0.7055 150.510  16.774  138.574   23.976  161.953   23.476  11.436 1.0483 12.429 0.9444 -0.9930630     1.410943  
1 1 1 10 17 2  o 4.8024 1.1652 25.805   13.511  24.787    19.053  26.834    19.163  4.7316 1.6447 4.8731 1.6509 -0.1414022     2.330372  
1 1 1 10 17 3  o 11.735 0.7320 145.572  17.174  144.294   24.520  146.803   24.062  11.675 1.0501 11.795 1.0200 -0.1194429     1.463929  
1 1 1 10 17 4  o 10.696 0.7737 122.112  16.351  145.509   23.470  100.045   22.793  11.748 0.9989 9.6429 1.1819 2.105469       1.547451  
1 1 1 10 17 5  f 7.4595 1.0519 64.296   15.346  74.981    21.501  53.200    21.911  8.2573 1.3019 6.6617 1.6525 1.595633       2.103765  
1 1 1 10 17 6  o 9.2328 0.8212 92.261   15.160  94.817    21.642  89.799    21.243  9.3616 1.1559 9.1040 1.1667 0.2575970      1.642306  
1 1 1 10 17 7  o 3.3853 1.0061 -0.0893  12.517  15.939    17.979  -15.1667  17.438  4.0970 1.5690 2.6736 1.2597 1.423396       2.012130  
1 1 1 10 17 8  o 11.496 0.7459 141.061  17.125  136.620   24.599  145.237   23.854  11.297 1.0888 11.695 1.0199 -0.3981256     1.491820  
1 1 1 10 17 9  o 8.4656 0.8693 77.591   14.718  77.656    20.818  77.526    20.811  8.4693 1.2290 8.4619 1.2297 0.7414818E-02  1.738561  
1 1 1 10 17 10 o 4.0822 1.1133 13.876   13.118  22.059    19.133  6.6168    18.021  4.5580 1.6423 3.6063 1.5036 0.9516742      2.226643  
1 1 1 10 17 11 o 6.3483 1.1061 47.032   14.045  55.607    20.277  39.123    19.474  6.9406 1.5042 5.7559 1.6221 1.184692       2.212133  
1 1 1 10 17 12 o 3.1068 0.9819 -5.8869  12.734  4.8554    18.749  -15.0862  17.350  3.5457 1.5089 2.6679 1.2569 0.8777757      1.963810  
1 1 1 10 17 13 o 3.5825 1.0253 4.3122   12.440  -10.4751  17.574  19.165    17.613  2.8492 1.3161 4.3159 1.5725 -1.466640      2.050625  
1 1 1 10 17 14 o 7.4655 1.0225 62.975   14.843  46.269    20.720  80.588    21.275  6.2772 1.6344 8.6539 1.2292 -2.376689      2.045014  
1 1 1 10 17 15 o 3.2644 0.9811 -4.2944  12.700  -26.1649  18.689  14.473    17.312  2.5178 1.2175 4.0110 1.5388 -1.493179      1.962182  
1 1 1 10 17 16 o 10.320 0.7861 113.735  16.216  118.509   23.177  109.157   22.697  10.539 1.0996 10.100 1.1236 0.4383430      1.572130  
1 1 1 10 17 17 o 10.982 0.7926 129.620  17.193  119.277   25.690  138.010   23.139  10.519 1.2211 11.446 1.0108 -0.9270477     1.585209  
1 1 1 10 17 18 o 6.5079 1.1816 52.342   15.560  45.195    23.123  58.255    21.035  6.0081 1.7902 7.0078 1.5426 -0.9996433     2.363105  
1 1 1 10 17 19 o 3.8699 1.1077 9.7737   14.222  -4.8033   20.995  22.134    19.332  3.2750 1.4846 4.4648 1.6444 -1.189833      2.215355  
1 1 1 10 17 20 o 5.7535 1.4026 47.408   19.658  52.142    22.299  30.901    41.640  6.3597 1.7142 5.1472 2.2205 1.212578       2.805243  
1 1 1 10 17 21 o 5.1727 1.2052 32.886   15.657  61.936    24.668  13.289    20.261  6.5737 1.8161 3.7717 1.5849 2.802010       2.410419  
1 1 1 10 17 22 o 7.1651 1.0767 68.556   15.306  85.598    21.181  49.930    22.144  8.4662 1.2509 5.8641 1.7529 2.602035       2.153466  
1 1 1 10 17 23 o 5.9921 1.2771 69.187   19.515  76.011    21.234  32.093    49.505  7.5559 1.4580 4.4283 2.0973 3.127572       2.554292  
1 1 1 10 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 17 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 18 0  o 9.9539 1.3233 118.242  22.828  146.192   32.760  91.861    31.827  11.462 1.5002 8.4453 2.1803 -0.000000      0.000000  
1 1 1 10 18 1  o 16.957 0.6352 301.725  21.539  298.852   30.658  304.525   30.267  16.868 0.9088 17.046 0.8878 -0.1779957     1.270482  
1 1 1 10 18 2  f 4.9325 1.2040 28.014   14.640  21.808    21.121  33.754    20.311  4.5531 1.7105 5.3119 1.6949 -0.7588201     2.408013  
1 1 1 10 18 3  o 9.1183 0.9192 93.420   15.820  117.444   22.391  69.473    22.355  10.489 1.0673 7.7474 1.4969 2.741821       1.838481  
1 1 1 10 18 4  o 4.0128 1.0256 7.2048   13.600  33.985    18.456  -24.6112  20.117  5.3570 1.6001 2.6685 1.2836 2.688510       2.051281  
1 1 1 10 18 5  o 5.6508 1.1282 38.435   14.295  21.090    20.911  53.654    19.587  4.5092 1.7004 6.7925 1.4834 -2.283358      2.256463  
1 1 1 10 18 6  o 3.8716 1.0876 8.8079   13.379  23.014    19.398  -4.0835   18.479  4.5953 1.6538 3.1479 1.4128 1.447417       2.175127  
1 1 1 10 18 7  o 7.1918 1.0821 59.487   15.112  71.611    22.101  48.842    20.711  7.9437 1.4443 6.4398 1.6118 1.503901       2.164262  
1 1 1 10 18 8  o 11.146 0.7614 132.184  16.916  141.601   23.672  122.356   24.182  11.585 1.0216 10.708 1.1292 0.8776932      1.522750  
1 1 1 10 18 9  o 8.5431 1.0000 82.511   16.305  63.158    22.991  102.096   23.128  7.3441 1.6097 9.7421 1.1870 -2.398046      2.000014  
1 1 1 10 18 10 o 5.5846 1.1985 37.349   14.567  39.576    20.836  35.220    20.373  5.7357 1.6971 5.4335 1.6928 0.3021898      2.397004  
1 1 1 10 18 11 o 9.3734 0.8578 95.114   16.049  97.828    23.564  92.766    21.917  9.4798 1.2429 9.2670 1.1825 0.2127371      1.715562  
1 1 1 10 18 12 o 5.1234 1.0628 25.356   14.412  54.808    20.375  -4.1291   20.387  6.9142 1.5153 3.3325 1.4906 3.581720       2.125566  
1 1 1 10 18 13 o 15.058 0.6713 237.282  20.125  267.597   28.963  208.977   27.986  16.019 0.9040 14.097 0.9926 1.922263       1.342556  
1 1 1 10 18 14 o 4.9462 1.1566 27.639   13.846  17.289    20.548  36.246    18.738  4.3245 1.6718 5.5679 1.5987 -1.243359      2.313165  
1 1 1 10 18 15 o 3.9271 1.1066 10.570   13.837  -2.5383   20.715  21.130    18.593  3.3911 1.5107 4.4632 1.6173 -1.072135      2.213124  
1 1 1 10 18 16 o 9.5222 0.9601 103.428  17.077  81.549    25.766  120.566   22.804  8.3856 1.5946 10.659 1.0697 -2.273291      1.920200  
1 1 1 10 18 17 o 5.7457 1.2084 41.164   16.125  22.119    23.942  56.974    21.814  4.6158 1.7989 6.8756 1.6140 -2.259810      2.416847  
1 1 1 10 18 18 o 5.3547 1.2594 35.661   15.760  37.875    22.932  33.679    21.696  5.4849 1.8050 5.2244 1.7567 0.2605362      2.518709  
1 1 1 10 18 19 o 4.4228 1.0990 11.243   14.832  48.224    22.647  -16.5347  19.628  6.0749 1.7614 2.7708 1.3147 3.304177       2.197926  
1 1 1 10 18 20 o 6.7994 1.1972 63.412   16.363  54.326    23.357  72.171    22.932  6.1736 1.7884 7.4252 1.5920 -1.251538      2.394333  
1 1 1 10 18 21 o 8.2709 1.0527 86.846   17.009  96.266    24.721  78.378    23.439  8.8212 1.4013 7.7206 1.5714 1.100533       2.105406  
1 1 1 10 18 22 o 7.1854 1.4554 86.759   20.132  82.273    22.378  105.791   46.098  7.8590 1.4780 6.5117 2.5077 1.347257       2.910884  
1 1 1 10 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 19 0  o 4.5881 1.4039 24.739   19.190  -15.3303  27.422  63.194    26.864  2.4537 1.6900 6.7224 2.2422 -0.000000      0.000000  
1 1 1 10 19 1  o 18.536 0.6146 358.215  22.749  357.719   31.338  358.767   33.076  18.543 0.8450 18.529 0.8926 0.1440239E-01  1.229119  
1 1 1 10 19 2  o 4.3138 1.1665 17.922   14.037  17.596    19.601  18.265    20.110  4.2841 1.6388 4.3435 1.6603 -0.5941820E-01 2.332903  
1 1 1 10 19 3  o 6.2242 1.1876 45.515   15.242  36.442    20.607  56.475    22.648  5.5452 1.6983 6.9032 1.6607 -1.358019      2.375295  
1 1 1 10 19 4  o 10.424 0.8178 116.578  16.998  121.362   23.520  111.348   24.594  10.680 1.1011 10.167 1.2095 0.5130367      1.635622  
1 1 1 10 19 5  o 8.9229 0.9022 86.501   16.085  89.721    22.639  83.218    22.859  9.1088 1.2427 8.7370 1.3081 0.3717566      1.804324  
1 1 1 10 19 6  o 6.1221 1.1032 44.291   14.481  23.925    20.631  64.066    20.330  4.7126 1.7043 7.5317 1.4012 -2.819082      2.206331  
1 1 1 10 19 7  o 5.4920 1.2383 35.780   15.484  41.675    21.849  29.830    21.948  5.8873 1.7367 5.0966 1.7656 0.7907586      2.476596  
1 1 1 10 19 8  o 4.1484 1.1715 14.371   14.803  9.3115    21.985  18.567    20.023  3.9565 1.6561 4.3402 1.6573 -0.3837895     2.342933  
1 1 1 10 19 9  o 11.929 0.7705 152.094  18.372  149.523   26.234  154.570   25.737  11.815 1.1102 12.042 1.0686 -0.2271824     1.540949  
1 1 1 10 19 10 o 11.323 0.8020 136.799  18.134  131.217   25.972  142.108   25.329  11.074 1.1727 11.573 1.0943 -0.4994659     1.603994  
1 1 1 10 19 11 o 9.7019 0.9211 103.193  17.620  86.786    25.318  118.603   24.537  8.8693 1.4273 10.534 1.1646 -1.665129      1.842165  
1 1 1 10 19 12 o 3.5583 1.0720 3.0277   13.782  -6.5781   20.625  10.777    18.525  3.2545 1.4737 3.8621 1.5572 -0.6075788     2.143990  
1 1 1 10 19 13 o 9.4923 0.9253 99.142   17.325  92.200    26.071  104.631   23.184  9.1146 1.4302 9.8700 1.1745 -0.7553425     1.850628  
1 1 1 10 19 14 o 11.786 0.8150 148.589  19.136  167.122   27.772  131.836   26.405  12.513 1.1097 11.059 1.1938 1.453952       1.629921  
1 1 1 10 19 15 o 5.7895 1.1657 39.911   16.127  13.523    23.623  62.946    22.071  4.2385 1.7399 7.3404 1.5519 -3.101903      2.331457  
1 1 1 10 19 16 o 4.1552 1.1616 9.1380   15.419  32.580    23.588  -8.3541   20.376  5.1869 1.8283 3.1235 1.4335 2.063411       2.323223  
1 1 1 10 19 17 o 4.1003 1.2035 12.603   16.447  5.3799    24.528  18.503    22.169  3.8642 1.6854 4.3365 1.7186 -0.4723258     2.407046  
1 1 1 10 19 18 o 2.9906 0.9606 -16.9450 14.509  -54.6670  22.520  9.8255    18.971  2.2871 1.1464 3.6940 1.5417 -1.406908      1.921213  
1 1 1 10 19 19 o 4.6509 1.2361 28.773   15.751  37.446    23.188  21.343    21.463  5.0967 1.8110 4.2051 1.6830 0.8916574      2.472245  
1 1 1 10 19 20 o 6.9139 1.1915 65.307   16.333  73.429    24.011  58.312    22.283  7.3509 1.6710 6.4770 1.6990 0.8739300      2.383073  
1 1 1 10 19 21 o 3.9193 1.0754 11.121   14.145  41.408    21.187  -13.2346  19.000  5.1820 1.7360 2.6566 1.2697 2.525373       2.150811  
1 1 1 10 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 0  f 15.028 1.0157 243.957  29.887  242.418   42.355  245.483   42.178  14.973 1.4453 15.083 1.4275 -0.000000      0.000000  
1 1 1 10 20 1  o 16.269 0.6591 276.966  21.443  274.862   30.002  279.163   30.658  16.211 0.9254 16.326 0.9389 -0.1157608     1.318275  
1 1 1 10 20 2  o 9.2821 0.9528 96.631   16.767  119.127   23.632  73.831    23.792  10.564 1.1186 8.0006 1.5428 2.563074       1.905622  
1 1 1 10 20 3  o 15.463 0.6720 251.213  20.753  258.733   28.933  243.245   29.784  15.725 0.9200 15.202 0.9796 0.5229311      1.343907  
1 1 1 10 20 4  o 5.2727 1.1980 32.766   14.331  33.941    20.492  31.641    20.049  5.3523 1.7018 5.1931 1.6867 0.1592097      2.396064  
1 1 1 10 20 5  o 3.1971 1.0160 -4.9710  13.765  1.6483    18.212  -13.7906  21.022  3.3616 1.4593 3.0327 1.4141 0.3288620      2.032047  
1 1 1 10 20 6  o 3.1538 0.9934 -6.4726  13.173  -18.8671  18.296  6.8673    18.981  2.6494 1.2606 3.6583 1.5355 -1.008880      1.986705  
1 1 1 10 20 7  o 6.3468 1.2306 48.529   16.090  45.160    22.212  52.248    23.338  6.1188 1.7352 6.5748 1.7456 -0.4559264     2.461272  
1 1 1 10 20 8  o 3.3788 1.0633 -4.7392  14.719  4.2789    21.070  -13.3350  20.571  3.7208 1.5919 3.0368 1.4102 0.6839826      2.126693  
1 1 1 10 20 9  o 7.8218 1.0920 71.710   16.541  51.153    24.145  89.889    22.705  6.5151 1.7954 9.1285 1.2437 -2.613370      2.184061  
1 1 1 10 20 10 o 12.973 0.7703 178.765  19.865  203.823   28.491  155.062   27.711  13.902 1.0247 12.045 1.1503 1.857261       1.540567  
1 1 1 10 20 11 o 8.1364 1.0937 75.951   17.132  81.493    24.888  70.960    23.617  8.4341 1.5319 7.8387 1.5613 0.5953393      2.187307  
1 1 1 10 20 12 o 11.811 0.8071 149.137  19.003  166.805   27.692  133.413   26.125  12.493 1.1083 11.130 1.1737 1.363594       1.614239  
1 1 1 10 20 13 o 6.7044 1.2491 53.134   17.305  70.271    25.687  38.894    23.416  7.7042 1.7116 5.7047 1.8198 1.999459       2.498241  
1 1 1 10 20 14 o 5.9124 1.2171 43.212   17.218  16.905    25.481  65.317    23.358  4.4366 1.8125 7.3882 1.6249 -2.951595      2.434271  
1 1 1 10 20 15 o 4.2572 1.2136 11.558   16.704  31.033    25.110  -3.9017   22.373  5.0987 1.8746 3.4157 1.5418 1.683024       2.427223  
1 1 1 10 20 16 o 4.5982 1.2858 22.060   17.448  26.325    26.070  18.599    23.483  4.8219 1.8778 4.3744 1.7570 0.4474816      2.571594  
1 1 1 10 20 17 o 4.5775 1.2506 21.962   17.739  1.7249    26.398  38.622    23.952  3.7603 1.6881 5.3947 1.8456 -1.634379      2.501198  
1 1 1 10 20 18 o 2.6265 0.9008 -23.1273 14.711  -35.1914  23.746  -15.6141  18.739  2.6066 1.2839 2.6465 1.2638 -0.3990197E-01 1.801597  
1 1 1 10 20 19 o 10.926 0.9279 143.868  20.200  159.046   29.057  129.673   28.101  11.560 1.2568 10.291 1.3653 1.268994       1.855712  
1 1 1 10 20 20 o 6.0557 1.2952 57.310   16.933  63.287    25.553  52.631    22.610  6.2745 1.8847 5.8369 1.7772 0.4376192      2.590461  
1 1 1 10 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 20 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 0  o 13.609 1.1123 204.961  29.139  194.817   41.503  214.824   40.922  13.213 1.6382 14.005 1.5049 -0.000000      0.000000  
1 1 1 10 21 1  o 13.146 0.7331 183.594  19.121  212.468   27.413  156.236   26.684  14.205 0.9649 12.087 1.1038 2.117389       1.466128  
1 1 1 10 21 2  o 5.1454 1.2371 30.160   15.666  20.095    22.124  40.282    22.187  4.5163 1.7379 5.7745 1.7610 -1.258230      2.474142  
1 1 1 10 21 3  o 4.1235 1.1882 11.296   15.756  20.265    22.475  2.6289    22.094  4.5493 1.7513 3.6977 1.6063 0.8516018      2.376392  
1 1 1 10 21 4  o 4.7093 1.1954 20.566   15.791  38.924    22.186  1.7187    22.479  5.7183 1.7640 3.7004 1.6137 2.017841       2.390776  
1 1 1 10 21 5  o 5.5677 1.2510 35.838   15.894  27.542    21.999  44.899    22.990  4.9976 1.7652 6.1377 1.7733 -1.140064      2.502049  
1 1 1 10 21 6  o 8.8892 0.9650 86.356   17.154  85.308    24.001  87.450    24.526  8.8380 1.3578 8.9405 1.3716 -0.1025219     1.930032  
1 1 1 10 21 7  o 4.3153 1.1859 13.589   15.618  29.547    22.499  -1.2527   21.697  5.1031 1.7865 3.5276 1.5601 1.575492       2.371831  
1 1 1 10 21 8  o 13.315 0.7804 188.682  20.482  150.986   28.410  229.477   29.555  11.857 1.1980 14.773 1.0003 -2.915401      1.560733  
1 1 1 10 21 9  o 8.1670 1.1242 78.312   17.759  60.794    25.989  93.655    24.323  7.0695 1.8254 9.2645 1.3127 -2.194989      2.248418  
1 1 1 10 21 10 o 13.526 0.7622 193.980  20.465  227.850   29.908  164.157   28.065  14.676 1.0190 12.376 1.1338 2.299368       1.524407  
1 1 1 10 21 11 f 10.584 0.8877 121.341  18.769  120.046   27.085  122.537   26.033  10.508 1.2888 10.661 1.2210 -0.1523380     1.775313  
1 1 1 10 21 12 f 4.2963 1.2363 14.612   16.699  18.726    24.298  10.930    22.989  4.5090 1.7953 4.0835 1.7001 0.4255013      2.472519  
1 1 1 10 21 13 o 5.3124 1.1632 27.623   17.837  -14.1559  26.032  64.594    24.489  3.3698 1.5720 7.2550 1.7148 -3.885134      2.326330  
1 1 1 10 21 14 o 5.4120 1.2370 33.616   17.960  3.8757    26.137  60.222    24.721  3.9068 1.7208 6.9173 1.7774 -3.010552      2.473930  
1 1 1 10 21 15 o 5.5912 1.3260 38.819   18.815  60.839    27.258  18.780    26.004  6.7463 1.9254 4.4362 1.8238 2.310125       2.652033  
1 1 1 10 21 16 o 4.2717 1.2549 17.563   17.584  19.195    26.274  16.238    23.665  4.3761 1.8193 4.1672 1.7290 0.2089210      2.509874  
1 1 1 10 21 17 o 6.4936 1.3262 63.076   18.932  47.574    27.747  76.580    25.897  5.5391 1.9796 7.4481 1.7654 -1.909029      2.652477  
1 1 1 10 21 18 o 3.7487 1.1720 9.5186   17.224  16.488    25.861  3.9630    23.089  4.0201 1.7421 3.4774 1.5683 0.5427072      2.344039  
1 1 1 10 21 19 o 3.9709 1.1906 19.837   16.665  12.833    25.599  24.988    21.954  3.7481 1.6739 4.1937 1.6937 -0.4456053     2.381291  
1 1 1 10 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 21 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 0  o 3.0098 1.4030 -1.1807  21.248  -6.5360   27.821  6.3147    32.914  2.7065 1.8178 3.3131 2.1376 -0.000000      0.000000  
1 1 1 10 22 1  o 10.148 0.9214 113.277  18.376  133.167   25.690  92.435    26.297  11.162 1.1508 9.1347 1.4394 2.027071       1.842888  
1 1 1 10 22 2  o 16.192 0.6827 274.437  22.087  260.884   30.476  289.432   32.057  15.771 0.9662 16.613 0.9648 -0.8416290     1.365438  
1 1 1 10 22 3  o 7.7356 1.1363 69.717   17.010  76.354    24.187  63.221    23.927  8.1532 1.5397 7.3181 1.6714 0.8351011      2.272560  
1 1 1 10 22 4  o 6.4831 1.2697 50.783   17.030  51.172    24.093  50.394    24.076  6.5090 1.7934 6.4573 1.7979 0.5168772E-01  2.539421  
1 1 1 10 22 5  o 4.8910 1.0892 9.4995   16.428  59.808    24.443  -31.9444  22.185  7.0786 1.7391 2.7034 1.3118 4.375250       2.178361  
1 1 1 10 22 6  o 3.7494 1.1415 2.8948   15.629  10.380    22.766  -3.7782   21.495  4.0805 1.6947 3.4182 1.5297 0.6623330      2.282967  
1 1 1 10 22 7  o 4.6816 1.2273 21.636   15.569  32.755    23.135  12.431    21.049  5.2894 1.8138 4.0737 1.6538 1.215715       2.454622  
1 1 1 10 22 8  o 14.282 0.7481 216.637  21.302  239.223   30.523  195.194   29.742  15.041 1.0147 13.523 1.0997 1.518414       1.496281  
1 1 1 10 22 9  o 8.7585 1.0872 87.935   18.347  78.791    27.243  95.525    24.820  8.1617 1.7230 9.3553 1.3265 -1.193686      2.174501  
1 1 1 10 22 10 o 4.1091 1.1580 8.6267   16.216  -16.1680  24.231  28.739    21.824  3.2187 1.5065 4.9994 1.7589 -1.780623      2.315908  
1 1 1 10 22 11 o 4.0461 1.1946 5.2761   17.790  -19.1388  26.249  26.020    24.195  3.2616 1.5394 4.8305 1.8272 -1.568819      2.389268  
1 1 1 10 22 12 o 4.8010 1.2694 20.665   18.617  -5.4714   26.486  46.192    26.175  3.6307 1.6541 5.9713 1.9260 -2.340647      2.538840  
1 1 1 10 22 13 o 13.011 0.8702 187.188  22.564  209.656   32.831  167.076   31.063  13.790 1.1904 12.232 1.2697 1.557794       1.740488  
1 1 1 10 22 14 o 4.0965 1.2448 8.4756   19.240  -8.6745   27.814  24.213    26.644  3.5429 1.6433 4.6500 1.8702 -1.107088      2.489581  
1 1 1 10 22 15 o 7.2879 1.2916 74.121   19.797  103.736   28.790  47.557    27.267  8.9265 1.6741 5.6494 1.9673 3.277122       2.583207  
1 1 1 10 22 16 o 4.3990 1.2715 23.857   17.888  18.528    27.237  27.899    23.720  4.2165 1.8071 4.5815 1.7892 -0.3649931     2.543027  
1 1 1 10 22 17 o 5.0410 1.2846 36.427   18.518  60.572    26.242  12.477    26.135  6.2236 1.9182 3.8583 1.7090 2.365236       2.569126  
1 1 1 10 22 18 o 3.2217 1.0611 -2.1280  16.889  -13.0882  26.561  5.3112    21.882  3.0842 1.4813 3.3592 1.5198 -0.2750227     2.122265  
1 1 1 10 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 22 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 0  f 16.680 1.0224 299.874  33.452  281.933   47.315  317.805   47.300  16.129 1.4964 17.231 1.3935 -0.000000      0.000000  
1 1 1 10 23 1  o 5.7258 1.2908 38.581   17.691  21.508    25.080  55.488    24.958  4.7061 1.8393 6.7455 1.8116 -2.039448      2.581627  
1 1 1 10 23 2  o 8.6483 1.0928 85.453   18.503  82.219    26.209  88.666    26.125  8.3906 1.6205 8.9060 1.4667 -0.5154037     2.185666  
1 1 1 10 23 3  o 9.8608 0.9389 106.587  18.492  114.252   26.675  99.496    25.657  10.216 1.3055 9.5054 1.3496 0.7106905      1.877718  
1 1 1 10 23 4  o 4.5659 1.2619 19.978   16.639  20.475    24.805  19.572    22.436  4.6317 1.8235 4.5001 1.7449 0.1316719      2.523811  
1 1 1 10 23 5  o 12.722 0.8523 174.661  21.352  214.221   30.935  138.669   29.507  14.183 1.0905 11.260 1.3102 2.923143       1.704692  
1 1 1 10 23 6  o 8.8642 1.0737 88.601   18.551  99.826    26.914  78.442    25.605  9.5089 1.4152 8.2196 1.6152 1.289344       2.147445  
1 1 1 10 23 7  o 13.001 0.7884 179.210  20.406  204.145   30.328  158.583   27.584  13.835 1.0960 12.168 1.1335 1.667589       1.576744  
1 1 1 10 23 8  o 4.1670 1.1959 6.6761   16.899  31.535    25.283  -13.3942  22.718  5.1698 1.8840 3.1643 1.4736 2.005554       2.391864  
1 1 1 10 23 9  o 6.8368 1.3095 58.207   19.207  83.555    28.427  36.914    26.055  8.2256 1.7797 5.4481 1.9213 2.777482       2.618938  
1 1 1 10 23 10 o 6.4188 1.3439 52.243   18.577  65.847    28.070  41.641    24.781  7.1228 1.9247 5.7149 1.8761 1.407914       2.687826  
1 1 1 10 23 11 o 9.1588 1.1976 105.659  20.767  75.890    30.863  130.288   28.073  7.5394 2.0101 10.778 1.3023 -3.238685      2.395104  
1 1 1 10 23 12 o 3.6743 1.1844 -6.5726  19.588  9.7304    28.497  -21.1744  26.969  4.1490 1.8129 3.1996 1.5247 0.9493790      2.368819  
1 1 1 10 23 13 o 5.5430 1.3497 38.606   20.357  69.478    29.679  11.179    27.974  6.9743 2.0147 4.1117 1.7964 2.862537       2.699302  
1 1 1 10 23 14 o 6.1298 1.3700 57.348   19.307  69.745    27.294  44.933    27.315  6.8662 1.9152 5.3934 1.9593 1.472778       2.739899  
1 1 1 10 23 15 o 4.8828 1.3399 35.292   18.879  30.144    27.548  39.851    25.923  4.6384 1.8886 5.1272 1.9011 -0.4887662     2.679748  
1 1 1 10 23 16 o 5.9306 1.3928 58.293   19.304  56.518    27.166  60.104    27.435  5.8350 1.9657 6.0262 1.9738 -0.1911998     2.785666  
1 1 1 10 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 23 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 0  o 3.1133 1.4330 -2.0309  23.111  17.402    30.276  -29.1664  35.776  3.6231 2.2105 2.6035 1.8242 -0.000000      0.000000  
1 1 1 10 24 1  o 8.2663 1.1577 79.425   18.753  66.974    26.148  92.611    26.909  7.4400 1.7809 9.0925 1.4797 -1.652484      2.315464  
1 1 1 10 24 2  o 7.3236 1.1751 66.621   18.228  96.184    24.891  32.433    26.767  9.3520 1.3308 5.2953 1.9372 4.056755       2.350228  
1 1 1 10 24 3  o 7.0207 1.2512 62.747   18.772  35.332    27.701  86.028    25.528  5.4318 1.9732 8.6096 1.5390 -3.177820      2.502402  
1 1 1 10 24 4  o 9.2971 1.1113 100.052  19.853  125.869   29.118  77.626    27.139  10.615 1.3715 7.9791 1.7489 2.636049       2.222556  
1 1 1 10 24 5  o 7.5040 1.2286 68.813   17.999  72.324    26.963  65.990    24.175  7.6328 1.7962 7.3753 1.6768 0.2574754      2.457237  
1 1 1 10 24 6  o 4.9734 1.3017 28.314   17.844  15.823    27.020  37.976    23.764  4.4277 1.8432 5.5190 1.8384 -1.091331      2.603307  
1 1 1 10 24 7  f 5.6189 1.3375 37.858   18.210  55.850    27.752  24.255    24.131  6.5231 1.9651 4.7147 1.8148 1.808395       2.674902  
1 1 1 10 24 8  o 5.1542 1.3384 31.094   19.554  10.725    29.548  46.965    26.082  4.3060 1.8641 6.0025 1.9212 -1.696466      2.676878  
1 1 1 10 24 9  o 4.5093 1.3104 17.197   18.960  30.692    29.330  7.5102    24.850  5.0729 1.9872 3.9457 1.7088 1.127227       2.620880  
1 1 1 10 24 10 o 8.1765 1.2793 85.543   20.180  93.226    31.112  79.963    26.514  8.4054 1.8959 7.9476 1.7181 0.4578414      2.558544  
1 1 1 10 24 11 o 4.1031 1.2557 10.546   19.502  -2.5992   28.667  21.871    26.609  3.7156 1.7034 4.4905 1.8454 -0.7748606     2.511397  
1 1 1 10 24 12 o 3.4157 1.1230 -6.6179  18.843  5.9404    26.547  -19.3676  26.749  3.7361 1.6836 3.0954 1.4866 0.6407261      2.246036  
1 1 1 10 24 13 o 3.6915 1.1572 -6.2606  18.676  30.226    27.569  -37.2072  25.390  4.6927 1.8970 2.6902 1.3256 2.002472       2.314315  
1 1 1 10 24 14 o 2.9092 0.9887 -31.8186 17.731  5.6277    24.969  -69.9120  25.183  3.5934 1.6248 2.2250 1.1271 1.368334       1.977456  
1 1 1 10 24 15 o 4.0352 1.2417 20.285   18.866  14.423    26.906  25.952    26.459  3.8307 1.7130 4.2396 1.7979 -0.4089303     2.483363  
1 1 1 10 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 24 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 0  o 3.9932 1.7291 24.324   26.545  30.811    37.728  17.965    37.355  4.2346 2.5259 3.7517 2.3621 -0.000000      0.000000  
1 1 1 10 25 1  o 18.263 0.7069 355.347  25.791  375.540   37.493  337.209   35.535  18.754 0.9996 17.771 0.9998 0.9830875      1.413760  
1 1 1 10 25 2  o 8.3960 1.1723 85.986   19.150  66.914    27.565  103.777   26.623  7.2157 1.8882 9.5764 1.3900 -2.360673      2.344683  
1 1 1 10 25 3  o 4.4292 1.2150 15.778   17.549  -11.4299  26.871  36.015    23.174  3.4823 1.6152 5.3760 1.8155 -1.893708      2.430050  
1 1 1 10 25 4  o 4.9609 1.4581 18.558   22.710  4.5676    27.565  48.122    40.071  4.0003 1.7644 5.9215 2.3219 -1.921255      2.916209  
1 1 1 10 25 5  f 7.0195 1.2940 61.835   19.182  90.099    28.708  39.039    25.782  8.5249 1.7426 5.5141 1.9134 3.010814       2.587991  
1 1 1 10 25 6  o 5.8749 1.1934 33.189   19.254  87.883    28.899  -10.4686  25.819  8.3382 1.7867 3.4115 1.5827 4.926711       2.386891  
1 1 1 10 25 7  o 5.6842 1.3483 40.199   18.756  63.899    28.976  23.109    24.606  6.7994 1.9984 4.5691 1.8106 2.230310       2.696654  
1 1 1 10 25 8  o 3.9105 1.2015 -5.2668  18.897  31.702    29.097  -32.2329  24.851  5.0071 1.9738 2.8139 1.3707 2.193238       2.403002  
1 1 1 10 25 9  o 6.5705 1.4042 64.538   20.717  50.362    30.864  76.163    27.949  5.7405 2.0832 7.4004 1.8836 -1.659912      2.808460  
1 1 1 10 25 10 o 5.5214 1.2466 31.998   19.758  89.255    30.465  -9.5659   25.956  7.7705 1.9604 3.2723 1.5403 4.498242       2.493125  
1 1 1 10 25 11 o 5.9279 1.2707 50.034   19.992  11.879    28.791  85.561    27.782  4.0152 1.7854 7.8405 1.8086 -3.825307      2.541363  
1 1 1 10 25 12 o 8.2156 1.3393 100.082  21.658  111.538   30.431  88.324    30.831  8.9188 1.7685 7.5125 2.0118 1.406276       2.678577  
1 1 1 10 25 13 o 3.2159 1.0788 -9.5193  18.711  1.4753    27.126  -19.4982  25.842  3.4856 1.6189 2.9462 1.4264 0.5394242      2.157602  
1 1 1 10 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 25 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 0  o 5.4938 1.9927 59.914   28.376  49.983    40.596  69.401    39.680  4.9551 2.7597 6.0326 2.8752 -0.000000      0.000000  
1 1 1 10 26 1  o 3.4071 1.1054 -6.9977  17.199  -14.2337  23.874  0.8105    24.800  3.1549 1.4826 3.6593 1.6399 -0.5043912     2.210752  
1 1 1 10 26 2  o 3.8184 1.1884 4.6651   17.818  11.849    24.622  -3.2328   25.817  4.0530 1.7271 3.5837 1.6329 0.4693565      2.376796  
1 1 1 10 26 3  o 8.3115 1.2553 89.978   20.543  74.486    30.487  102.862   27.803  7.3113 2.0186 9.3116 1.4929 -2.000350      2.510658  
1 1 1 10 26 4  o 3.9436 1.2294 6.7380   18.765  10.834    28.363  3.5494    25.025  4.1448 1.8099 3.7423 1.6643 0.4024868      2.458801  
1 1 1 10 26 5  o 6.3624 1.2908 57.328   18.992  32.039    28.461  77.627    25.499  4.9549 1.9524 7.7698 1.6891 -2.814869      2.581652  
1 1 1 10 26 6  o 3.7985 1.1725 -0.4271  19.003  -33.6109  27.638  29.326    26.170  2.9068 1.4223 4.6901 1.8645 -1.783290      2.345066  
1 1 1 10 26 7  o 8.9952 1.2305 107.232  21.571  133.122   33.088  88.096    28.447  10.090 1.6397 7.9008 1.8353 2.188827       2.461090  
1 1 1 10 26 8  o 4.1368 1.2795 14.750   19.921  22.603    30.466  8.8850    26.331  4.4296 1.9052 3.8440 1.7084 0.5856197      2.558984  
1 1 1 10 26 9  o 5.7730 1.4386 54.473   20.733  51.813    30.920  56.647    27.946  5.5748 2.0745 5.9711 1.9938 -0.3963475     2.877274  
1 1 1 10 26 10 o 10.327 1.2099 147.608  23.344  105.264   33.041  189.811   32.986  8.2127 2.0245 12.442 1.3256 -4.229320      2.419850  
1 1 1 10 26 11 o 3.0527 1.0414 -19.9186 19.283  -37.5740  27.207  -2.0995   27.333  2.7103 1.3423 3.3952 1.5925 -0.6848602     2.082748  
1 1 1 10 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 26 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 0  o 2.3521 1.1830 -45.3260 24.556  -104.4338 37.180  0.4048    32.703  1.7987 1.3295 2.9055 1.9572 -0.000000      0.000000  
1 1 1 10 27 1  o 3.9963 1.2291 14.005   18.347  12.080    26.959  15.665    25.041  3.9592 1.7456 4.0335 1.7308 -0.7425165E-01 2.458224  
1 1 1 10 27 2  o 3.5774 1.1517 -1.3003  18.236  14.493    27.337  -13.9637  24.478  4.0633 1.7756 3.0915 1.4672 0.9718506      2.303347  
1 1 1 10 27 3  o 4.5073 1.3279 24.879   20.168  15.564    28.781  33.866    28.270  4.1485 1.8171 4.8661 1.9368 -0.7176270     2.655744  
1 1 1 10 27 4  o 11.869 0.9590 169.311  22.742  179.211   32.885  160.235   31.484  12.216 1.3460 11.522 1.3663 0.6941223      1.917935  
1 1 1 10 27 5  o 3.6192 1.1658 -1.0230  19.244  -18.9720  27.178  17.025    27.253  3.1186 1.4980 4.1199 1.7868 -1.001294      2.331683  
1 1 1 10 27 6  o 3.9385 1.2233 12.870   19.150  -0.9980   29.676  22.764    25.067  3.6158 1.6840 4.2612 1.7747 -0.6454122     2.446516  
1 1 1 10 27 7  o 3.5383 1.1613 -0.2558  19.815  -7.1838   29.357  5.5414    26.854  3.4242 1.6198 3.6523 1.6646 -0.2280941     2.322638  
1 1 1 10 27 8  o 3.7937 1.2175 8.2802   20.692  -8.4433   30.022  23.413    28.558  3.3766 1.6089 4.2108 1.8277 -0.8341916     2.434988  
1 1 1 10 27 9  f 3.5430 1.1567 4.2285   19.489  -7.0616   29.097  13.414    26.245  3.3204 1.5826 3.7655 1.6873 -0.4451694     2.313382  
1 1 1 10 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 27 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 0  o 3.1298 1.5069 1.9776   28.703  16.334    42.471  -10.0927  38.943  3.4408 2.2905 2.8187 1.9588 -0.000000      0.000000  
1 1 1 10 28 1  o 3.9922 1.2467 16.103   19.516  14.084    27.102  18.278    28.127  3.9104 1.7358 4.0741 1.7901 -0.1636832     2.493494  
1 1 1 10 28 2  o 3.7130 1.1629 1.2021   19.373  -34.6215  28.587  31.623    26.344  2.8549 1.4068 4.5711 1.8521 -1.716181      2.325798  
1 1 1 10 28 3  o 3.3405 1.1355 -15.9957 22.908  1.5138    28.791  -46.2059  37.818  3.5647 1.6597 3.1163 1.5500 0.4484372      2.270902  
1 1 1 10 28 4  o 5.4919 1.3957 52.580   19.534  52.577    28.084  52.582    27.189  5.4663 1.9866 5.5176 1.9609 -0.5133963E-01 2.791391  
1 1 1 10 28 5  o 4.3001 1.2678 24.505   19.736  46.111    27.326  0.9420    28.536  5.1149 1.9401 3.4854 1.6324 1.629499       2.535537  
1 1 1 10 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 28 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 29 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 30 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 31 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 32 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 10 33 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 1  0  o 2.8579 1.1709 9.7812   11.059  6.1784    15.770  13.267    15.512  2.6238 1.5982 3.0921 1.7117 -0.000000      0.000000  
1 1 1 11 1  1  o 30.888 0.5384 957.687  33.261  959.580   47.003  955.788   47.074  30.919 0.7601 30.858 0.7628 0.6156349E-01  1.076821  
1 1 1 11 1  2  o 38.956 0.6488 1493.62  44.059  1592.80   88.556  1460.99   50.792  39.746 1.1140 38.167 0.6654 1.579460       1.297605  
1 1 1 11 1  3  f 3.9062 0.8206 17.031   7.9423  -8.2891   16.500  24.667    9.0611  2.9460 1.3275 4.8665 0.9651 -1.920519      1.641191  
1 1 1 11 1  4  o 17.422 0.6010 306.163  18.073  302.892   36.199  307.249   20.859  17.338 1.0439 17.507 0.5958 -0.1690369     1.201966  
1 1 1 11 1  5  f 9.0639 0.6897 76.977   11.051  94.968    22.422  71.203    12.701  9.7045 1.1552 8.4232 0.7540 1.281363       1.379498  
1 1 1 11 1  6  o 17.214 0.6061 299.500  17.984  293.708   36.023  301.424   20.756  17.084 1.0543 17.344 0.5984 -0.2602386     1.212281  
1 1 1 11 1  7  o 12.202 0.7628 146.935  17.807  160.348   30.496  139.996   21.935  12.604 1.2097 11.800 0.9295 0.8047295      1.525570  
1 1 1 11 1  8  o 9.1203 0.6261 83.524   11.413  80.120    15.812  87.226    16.490  8.9265 0.8857 9.3140 0.8852 -0.3874798     1.252185  
1 1 1 11 1  9  f 18.655 0.5206 349.588  19.416  336.343   27.335  363.074   27.583  18.297 0.7470 19.012 0.7254 -0.7157078     1.041251  
1 1 1 11 1  10 o 14.275 0.7614 204.916  21.737  204.916   21.737  0.0000    0.0000  14.275 0.7614 ?      ?      ?              ?         
1 1 1 11 1  11 o 37.478 0.5672 1414.03  42.506  1385.54   59.890  1442.94   60.338  37.096 0.8072 37.860 0.7969 -0.7639694     1.134301  
1 1 1 11 1  12 o 20.691 0.5239 431.991  21.670  448.050   30.679  416.000   30.614  21.078 0.7277 20.304 0.7539 0.7741013      1.047837  
1 1 1 11 1  13 o 20.648 0.5333 430.921  22.020  419.110   30.767  443.323   31.528  20.358 0.7557 20.939 0.7529 -0.5806656     1.066699  
1 1 1 11 1  14 o 14.318 0.5618 208.522  16.050  189.696   22.092  229.567   23.358  13.630 0.8104 15.006 0.7783 -1.376205      1.123587  
1 1 1 11 1  15 o 9.0788 0.6849 85.450   12.271  90.385    16.400  79.172    18.498  9.4024 0.8721 8.7551 1.0564 0.6472731      1.369875  
1 1 1 11 1  16 o 3.4051 1.0180 3.0234   11.509  5.7085    19.201  1.5178    14.378  3.7132 1.5504 3.0971 1.3198 0.6161089      2.036089  
1 1 1 11 1  17 o 3.0010 0.8879 2.6216   9.1182  7.0812    11.944  -3.6089   14.117  3.2007 1.2636 2.8013 1.2476 0.3993917      1.775765  
1 1 1 11 1  18 o 8.1378 0.7561 70.174   12.279  71.372    16.924  68.843    17.844  8.2281 1.0284 8.0475 1.1086 0.1805820      1.512208  
1 1 1 11 1  19 o 3.7852 1.1353 6.9854   12.730  6.9008    14.330  7.3020    27.721  3.3515 1.3631 4.2190 1.8160 -0.8674495     2.270622  
1 1 1 11 1  20 f 3.5136 0.9907 7.6025   10.858  -0.2961   15.018  16.252    15.716  3.0054 1.3146 4.0217 1.4824 -1.016318      1.981303  
1 1 1 11 1  21 f 11.357 0.7179 136.758  16.194  151.105   22.608  121.639   23.208  12.014 0.9409 10.701 1.0844 1.313269       1.435722  
1 1 1 11 1  22 o 8.4199 0.9654 83.436   14.872  110.540   20.304  52.063    21.845  10.234 0.9920 6.6056 1.6565 3.628626       1.930805  
1 1 1 11 1  23 o 11.914 0.7350 148.745  17.455  134.028   23.699  166.196   25.806  11.267 1.0517 12.562 1.0272 -1.294745      1.470074  
1 1 1 11 1  24 o 4.8605 1.1316 22.198   13.977  5.2679    18.488  44.781    21.353  3.5773 1.5092 6.1437 1.6865 -2.566382      2.263207  
1 1 1 11 1  25 o 4.5881 1.1255 20.507   14.655  38.084    19.255  -3.6984   22.595  5.6811 1.6171 3.4951 1.5659 2.185969       2.251019  
1 1 1 11 1  26 o 4.0464 1.0991 10.472   14.801  30.100    19.281  -17.6922  23.096  5.0255 1.6551 3.0673 1.4466 1.958259       2.198162  
1 1 1 11 1  27 o 4.9113 1.1720 19.326   15.850  -5.2891   20.379  57.005    25.214  3.1974 1.4545 6.6253 1.8382 -3.427849      2.344064  
1 1 1 11 1  28 o 11.432 0.6541 141.104  14.736  153.762   23.230  132.582   19.062  11.790 0.9852 11.074 0.8606 0.7153864      1.308167  
1 1 1 11 1  29 o 11.329 0.6585 140.536  14.674  153.429   23.282  132.041   18.900  11.672 0.9974 10.987 0.8601 0.6850004      1.317039  
1 1 1 11 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 2  0  o 26.327 0.7482 699.722  39.220  674.174   55.793  724.679   55.143  25.843 1.0838 26.810 1.0319 -0.000000      0.000000  
1 1 1 11 2  1  o 8.8625 0.6264 78.956   11.100  76.373    15.546  81.643    15.854  8.7143 0.8920 9.0107 0.8797 -0.2963505     1.252813  
1 1 1 11 2  2  o 2.6622 0.7932 -0.2674  7.4383  4.6935    10.327  -5.6164   10.723  2.9554 1.1724 2.3690 1.0686 0.5863266      1.586302  
1 1 1 11 2  3  o 22.959 0.5188 528.961  23.822  524.407   33.568  533.582   33.812  22.859 0.7342 23.058 0.7332 -0.1992226     1.037620  
1 1 1 11 2  4  o 27.527 0.5272 760.328  29.025  750.011   40.949  770.745   41.147  27.339 0.7489 27.715 0.7423 -0.3761559     1.054476  
1 1 1 11 2  5  o 20.681 0.5185 429.038  21.445  437.541   30.405  420.619   30.253  20.886 0.7279 20.477 0.7387 0.4087887      1.037060  
1 1 1 11 2  6  o 14.214 0.6171 197.852  15.206  213.414   30.907  192.882   17.466  14.557 1.0616 13.871 0.6296 0.6864862      1.234214  
1 1 1 11 2  7  o 25.810 0.6072 667.840  31.346  0.0000    0.0000  667.840   31.346  ?      ?      25.810 0.6072 ?              ?         
1 1 1 11 2  8  o 23.308 0.6122 545.486  24.534  548.432   49.624  544.533   28.225  23.315 1.0642 23.302 0.6056 0.1330376E-01  1.224478  
1 1 1 11 2  9  o 39.838 0.7074 1593.50  53.446  1628.17   91.886  1575.78   65.704  40.107 1.1455 39.570 0.8302 0.5372581      1.414741  
1 1 1 11 2  10 o 10.701 0.7400 118.541  12.985  110.879   27.535  120.732   14.725  10.439 1.3188 10.963 0.6716 -0.5237589     1.479948  
1 1 1 11 2  11 o 20.900 0.6055 429.092  21.934  464.532   44.595  417.783   25.192  21.409 1.0415 20.391 0.6177 1.017630       1.210915  
1 1 1 11 2  12 o 7.2398 0.9284 53.153   10.694  58.522    23.721  51.783    11.981  7.3304 1.6570 7.1492 0.8379 0.1812463      1.856779  
1 1 1 11 2  13 o 14.127 0.6411 193.279  15.808  224.820   32.274  183.323   18.132  14.787 1.0913 13.468 0.6731 1.319456       1.282191  
1 1 1 11 2  14 o 13.120 0.7507 185.061  18.204  159.639   31.221  198.155   22.407  12.312 1.2679 13.929 0.8043 -1.616546      1.501499  
1 1 1 11 2  15 o 4.5201 0.9710 22.286   9.5210  23.757    12.404  20.176    14.855  4.6583 1.2882 4.3819 1.4532 0.2763677      1.941953  
1 1 1 11 2  16 o 6.5377 1.1320 47.137   13.942  54.308    24.734  43.797    16.879  6.8060 1.7923 6.2693 1.3833 0.5367317      2.264036  
1 1 1 11 2  17 o 6.5972 0.9112 51.073   11.645  73.440    15.913  25.281    17.088  8.4058 0.9465 4.7886 1.5572 3.617233       1.822334  
1 1 1 11 2  18 o 12.643 0.6278 166.695  15.809  147.895   22.063  186.531   22.663  11.886 0.9281 13.399 0.8457 -1.513541      1.255639  
1 1 1 11 2  19 o 6.2548 1.1446 53.418   14.914  62.884    16.860  19.371    31.976  7.6738 1.0986 4.8358 2.0084 2.837914       2.289248  
1 1 1 11 2  20 o 5.7161 1.0263 38.489   12.340  53.057    17.287  23.354    17.620  6.8593 1.3079 4.5730 1.5821 2.286362       2.052698  
1 1 1 11 2  21 o 7.1591 0.9664 57.837   13.422  66.375    18.493  48.334    19.511  7.8657 1.1755 6.4525 1.5343 1.413265       1.932863  
1 1 1 11 2  22 o 14.740 0.6577 229.877  19.232  251.615   26.567  205.941   27.877  15.532 0.8552 13.947 0.9994 1.584941       1.315375  
1 1 1 11 2  23 o 11.394 0.7946 141.704  17.470  172.525   23.917  106.447   25.580  12.866 0.9295 9.9220 1.2891 2.943871       1.589223  
1 1 1 11 2  24 o 4.6850 1.1917 21.995   14.257  14.661    18.569  32.528    22.254  4.0808 1.5860 5.2893 1.7791 -1.208463      2.383424  
1 1 1 11 2  25 o 4.5076 1.1961 18.360   14.615  10.380    18.919  30.170    23.016  3.8627 1.5680 5.1525 1.8067 -1.289856      2.392254  
1 1 1 11 2  26 o 9.8219 0.9883 112.925  17.982  126.734   23.420  93.094    28.066  10.845 1.0798 8.7993 1.6556 2.045190       1.976584  
1 1 1 11 2  27 o 5.2326 1.1996 34.856   16.196  50.956    21.083  11.675    25.297  6.3712 1.6437 4.0939 1.7477 2.277252       2.399192  
1 1 1 11 2  28 o 5.4815 0.9634 37.854   9.8949  34.940    19.521  38.862    11.479  5.0382 1.6657 5.9248 0.9687 -0.8865728     1.926891  
1 1 1 11 2  29 o 4.3719 1.0482 18.164   9.8077  45.374    20.651  10.239    11.145  5.5805 1.6984 3.1632 1.2289 2.417266       2.096338  
1 1 1 11 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 3  0  o 2.9069 1.1899 10.364   11.333  7.7435    16.335  12.797    15.736  2.7502 1.6511 3.0637 1.7139 -0.000000      0.000000  
1 1 1 11 3  1  o 48.614 0.6195 2374.58  60.224  2330.45   84.926  2419.24   85.415  48.158 0.8817 49.070 0.8703 -0.9118767     1.238940  
1 1 1 11 3  2  o 12.929 0.5474 167.772  14.155  168.350   19.983  167.189   20.054  12.951 0.7715 12.906 0.7769 0.4506111E-01  1.094872  
1 1 1 11 3  3  o 34.835 0.5493 1217.71  38.265  1238.43   54.223  1197.15   54.008  35.131 0.7717 34.539 0.7819 0.5921478      1.098574  
1 1 1 11 3  4  o 19.162 0.5174 368.284  19.824  377.427   28.179  359.326   27.893  19.398 0.7264 18.926 0.7369 0.4717255      1.034706  
1 1 1 11 3  5  o 2.8307 0.7890 -4.5615  8.6830  -33.6227  14.120  13.111    11.011  1.9383 0.9612 3.7231 1.2515 -1.784791      1.578004  
1 1 1 11 3  6  o 9.9284 0.6285 100.688  12.157  74.488    17.143  127.197   17.243  8.6013 0.9965 11.256 0.7660 -2.654181      1.256907  
1 1 1 11 3  7  o 23.922 0.6224 565.850  28.400  544.292   34.920  607.964   48.807  23.280 0.7500 24.564 0.9935 -1.284203      1.244781  
1 1 1 11 3  8  o 16.560 0.5359 275.643  17.748  276.784   25.244  274.527   24.957  16.594 0.7606 16.526 0.7550 0.6715584E-01  1.071764  
1 1 1 11 3  9  o 25.471 0.6071 646.812  26.747  666.927   53.943  640.255   30.800  25.685 1.0501 25.257 0.6097 0.4284153      1.214263  
1 1 1 11 3  10 o 31.189 0.6148 955.914  33.530  1032.36   67.244  930.618   38.681  31.938 1.0527 30.439 0.6354 1.499178       1.229597  
1 1 1 11 3  11 o 20.025 0.6431 392.109  24.523  453.156   42.886  362.452   29.892  21.109 1.0158 18.941 0.7891 2.167585       1.286276  
1 1 1 11 3  12 o 29.722 0.6389 902.527  32.779  887.383   65.405  907.607   37.879  29.434 1.1111 30.009 0.6311 -0.5753250     1.277792  
1 1 1 11 3  13 o 11.015 0.8045 138.757  14.181  103.981   28.899  149.786   16.275  9.8758 1.4631 12.155 0.6695 -2.279044      1.609026  
1 1 1 11 3  14 o 9.0840 0.8791 89.845   12.701  82.148    26.400  92.163    14.487  8.6467 1.5850 9.5212 0.7608 -0.8745070     1.758153  
1 1 1 11 3  15 o 4.6871 1.0523 23.799   9.9331  18.934    22.326  25.000    11.091  4.5862 1.7503 4.7879 1.1685 -0.2017541     2.104524  
1 1 1 11 3  16 o 4.7899 1.0940 22.413   10.094  31.416    22.839  20.228    11.253  5.2857 1.8022 4.2940 1.2406 0.9916997      2.187971  
1 1 1 11 3  17 o 5.6947 1.0387 41.261   11.104  20.654    25.709  45.987    12.312  4.7414 1.8597 6.6480 0.9260 -1.906571      2.077462  
1 1 1 11 3  18 o 13.475 0.7295 189.335  16.395  197.249   34.586  187.041   18.620  13.449 1.2858 13.502 0.6895 -0.5287457E-01 1.459062  
1 1 1 11 3  19 o 4.4844 1.1490 13.167   10.749  42.477    26.120  7.1920    11.793  5.8165 1.9269 3.1522 1.2521 2.664266       2.298007  
1 1 1 11 3  20 o 5.6599 0.9900 46.662   12.113  -1.8543   28.659  57.214    13.365  3.9285 1.7616 7.3912 0.9041 -3.462698      1.980056  
1 1 1 11 3  21 f 16.468 0.7345 279.417  20.168  300.536   42.911  273.429   22.849  16.612 1.2916 16.323 0.6999 0.2881050      1.469025  
1 1 1 11 3  22 o 13.785 0.7791 181.535  18.174  247.727   39.886  164.191   20.417  14.993 1.3301 12.577 0.8117 2.416208       1.558213  
1 1 1 11 3  23 o 4.0840 1.2083 4.4927   11.992  29.698    32.002  0.3752    12.935  5.3095 2.0769 2.8585 1.2354 2.450970       2.416574  
1 1 1 11 3  24 o 4.2403 1.0630 19.844   11.979  -16.2276  29.279  27.096    13.128  3.5876 1.6714 4.8931 1.3138 -1.305515      2.125972  
1 1 1 11 3  25 f 8.1925 1.2468 84.892   15.730  71.123    37.638  87.807    17.315  7.2415 2.3069 9.1434 0.9469 -1.901836      2.493620  
1 1 1 11 3  26 o 15.297 0.9445 261.699  27.235  264.340   46.718  260.339   33.521  15.067 1.5503 15.528 1.0794 -0.4611683     1.889068  
1 1 1 11 3  27 o 10.160 1.1789 132.791  21.947  90.939    32.714  167.042   29.595  8.1228 2.0217 12.196 1.2132 -4.073636      2.357809  
1 1 1 11 3  28 o 4.7491 1.3524 31.251   19.766  28.703    29.128  33.426    26.911  4.6463 1.9223 4.8518 1.9027 -0.2055097     2.704712  
1 1 1 11 3  29 o 3.3717 1.1070 -15.4382 19.116  26.032    28.285  -50.3044  25.935  4.2787 1.8379 2.4646 1.2346 1.814132       2.214057  
1 1 1 11 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 4  0  o 15.984 0.7490 259.796  23.686  253.457   33.806  265.908   33.195  15.784 1.0826 16.184 1.0353 -0.000000      0.000000  
1 1 1 11 4  1  f 21.714 0.5128 472.909  22.269  468.470   31.382  477.410   31.606  21.611 0.7261 21.817 0.7244 -0.2053833     1.025592  
1 1 1 11 4  2  o 22.172 0.5129 493.138  22.745  495.530   32.099  490.727   32.234  22.226 0.7221 22.118 0.7287 0.1085911      1.025882  
1 1 1 11 4  3  o 15.264 0.5262 233.857  16.057  243.436   22.769  224.381   22.647  15.576 0.7309 14.952 0.7573 0.6238928      1.052487  
1 1 1 11 4  4  o 9.5111 0.6160 90.923   11.718  90.574    16.590  91.269    16.553  9.4928 0.8738 9.5294 0.8685 -0.3664780E-01 1.232026  
1 1 1 11 4  5  o 19.588 0.6318 393.065  23.334  408.961   28.903  363.313   39.542  20.186 0.7159 18.989 1.0412 1.197895       1.263577  
1 1 1 11 4  6  o 26.480 0.5252 704.249  27.814  708.565   39.411  699.965   39.260  26.561 0.7419 26.399 0.7436 0.1619377      1.050386  
1 1 1 11 4  7  o 22.180 0.5199 494.355  23.061  489.673   32.666  499.007   32.561  22.074 0.7399 22.285 0.7306 -0.2107773     1.039801  
1 1 1 11 4  8  o 16.012 0.5432 258.280  17.365  245.633   24.831  270.386   24.294  15.624 0.7946 16.399 0.7407 -0.7749834     1.086326  
1 1 1 11 4  9  o 11.857 0.5889 142.411  13.885  128.654   20.005  155.198   19.287  11.296 0.8855 12.419 0.7765 -1.122405      1.177723  
1 1 1 11 4  10 o 15.004 0.5616 227.021  16.836  241.512   24.149  213.318   23.484  15.472 0.7804 14.536 0.8078 0.9356937      1.123186  
1 1 1 11 4  11 o 16.175 0.6877 283.078  18.480  235.561   37.177  298.672   21.298  15.130 1.2286 17.219 0.6184 -2.088821      1.375443  
1 1 1 11 4  12 o 24.495 0.6183 603.674  26.359  627.704   52.662  595.642   30.447  24.704 1.0659 24.286 0.6268 0.4178238      1.236519  
1 1 1 11 4  13 o 10.757 0.8104 130.601  14.103  102.736   28.729  139.449   16.188  9.7967 1.4663 11.718 0.6908 -1.920923      1.620836  
1 1 1 11 4  14 o 15.836 0.6854 262.666  18.272  252.555   37.438  265.828   20.934  15.489 1.2085 16.183 0.6468 -0.6934652     1.370743  
1 1 1 11 4  15 o 4.6841 1.0418 24.696   10.054  15.298    22.609  27.013    11.225  4.3918 1.7371 4.9764 1.1508 -0.5845881     2.083701  
1 1 1 11 4  16 o 5.5280 1.1023 31.064   10.938  42.598    23.963  28.028    12.293  6.0197 1.8289 5.0363 1.2309 0.9833798      2.204509  
1 1 1 11 4  17 o 6.4651 1.0112 62.803   12.273  12.104    27.848  75.025    13.673  4.4122 1.8563 8.5180 0.8026 -4.105792      2.022400  
1 1 1 11 4  18 o 19.235 0.6539 378.474  21.445  403.310   44.218  370.835   24.522  19.422 1.1383 19.048 0.6437 0.3746853      1.307737  
1 1 1 11 4  19 o 9.5139 1.0554 113.991  14.325  84.817    32.010  121.297   16.019  8.1872 1.9772 10.841 0.7389 -2.653449      2.110710  
1 1 1 11 4  20 o 19.075 0.7426 404.528  22.884  349.127   47.817  420.986   26.063  17.853 1.3392 20.297 0.6420 -2.444019      1.485173  
1 1 1 11 4  21 o 15.385 0.7595 254.118  19.252  246.943   40.484  256.215   21.885  14.973 1.3519 15.798 0.6927 -0.8249760     1.519058  
1 1 1 11 4  22 o 5.5204 1.1712 36.330   11.984  26.996    31.292  37.935    12.973  5.1650 2.0434 5.8758 1.1451 -0.7108564     2.342373  
1 1 1 11 4  23 o 8.3998 1.1515 76.592   14.143  88.942    35.374  74.243    15.430  8.3645 2.1136 8.4351 0.9146 -0.7062149E-01 2.303042  
1 1 1 11 4  24 o 6.9233 1.1859 53.686   13.083  60.503    32.575  52.374    14.286  6.8094 2.1436 7.0372 1.0151 -0.2277937     2.371763  
1 1 1 11 4  25 o 6.9738 1.4213 56.506   19.898  88.864    35.952  42.216    23.891  8.1345 2.1698 5.8130 1.8365 2.321517       2.842655  
1 1 1 11 4  26 o 8.2842 1.3950 89.830   21.836  87.266    40.209  90.903    26.005  7.6827 2.3756 8.8858 1.4633 -1.203180      2.790073  
1 1 1 11 4  27 o 4.3252 1.2385 9.4152   18.422  43.531    28.143  -16.1626  24.368  5.5429 1.9923 3.1075 1.4717 2.435425       2.476930  
1 1 1 11 4  28 o 7.2115 1.4088 80.784   21.280  71.441    32.016  88.178    28.483  6.5563 2.1315 7.8667 1.8427 -1.310403      2.817584  
1 1 1 11 4  29 o 3.8563 1.2354 8.9644   20.777  35.391    31.770  -10.7853  27.465  4.5421 1.9493 3.1706 1.5184 1.371493       2.470894  
1 1 1 11 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 5  0  o 20.946 0.7269 443.256  30.275  451.824   43.352  435.099   42.298  21.144 1.0308 20.747 1.0251 -0.000000      0.000000  
1 1 1 11 5  1  o 22.406 0.5127 503.961  22.967  486.880   32.481  521.042   32.480  22.025 0.7374 22.787 0.7127 -0.7623367     1.025488  
1 1 1 11 5  2  o 41.434 0.7142 1735.14  55.622  1709.84   96.507  1747.72   68.064  41.157 1.1724 41.711 0.8159 -0.5537720     1.428388  
1 1 1 11 5  3  o 33.736 0.5431 1142.87  36.644  1144.05   51.854  1141.70   51.790  33.754 0.7681 33.719 0.7680 0.3474426E-01  1.086181  
1 1 1 11 5  4  o 27.268 0.5239 746.631  28.569  748.948   40.518  744.340   40.289  27.310 0.7418 27.226 0.7399 0.8384514E-01  1.047712  
1 1 1 11 5  5  o 15.398 0.5350 238.316  16.468  231.358   23.336  245.219   23.243  15.173 0.7690 15.623 0.7439 -0.4503937     1.069916  
1 1 1 11 5  6  o 40.782 0.5789 1673.64  47.212  1642.03   66.749  1705.29   66.786  40.395 0.8262 41.170 0.8111 -0.7753601     1.157805  
1 1 1 11 5  7  o 32.955 0.5459 1092.16  35.963  1135.08   51.244  1050.51   50.483  33.595 0.7627 32.314 0.7811 1.280289       1.091715  
1 1 1 11 5  8  o 24.508 0.5277 604.119  25.864  599.809   36.538  608.449   36.618  24.420 0.7481 24.596 0.7444 -0.1759586     1.055378  
1 1 1 11 5  9  o 8.8712 0.6956 80.110   12.205  94.871    17.430  65.908    17.097  9.6863 0.8998 8.0561 1.0611 1.630179       1.391212  
1 1 1 11 5  10 o 4.0822 0.9094 13.761   9.7164  -2.0557   13.682  29.855    13.801  2.8865 1.2589 5.2778 1.3129 -2.391315      1.818884  
1 1 1 11 5  11 o 18.150 0.5550 333.949  20.139  324.591   28.575  343.185   28.387  17.893 0.7985 18.406 0.7711 -0.5138359     1.110073  
1 1 1 11 5  12 o 14.087 0.5902 203.543  16.577  186.769   23.572  219.954   23.316  13.496 0.8733 14.677 0.7943 -1.181432      1.180485  
1 1 1 11 5  13 o 16.510 0.5756 278.112  18.983  263.401   26.869  292.772   26.823  16.065 0.8363 16.955 0.7910 -0.8900566     1.151118  
1 1 1 11 5  14 o 12.472 0.7876 174.505  15.818  141.438   32.694  184.611   18.074  11.469 1.4254 13.475 0.6706 -2.006621      1.575262  
1 1 1 11 5  15 o 3.4174 1.0227 5.4149   9.6008  1.7236    23.895  6.1255    10.484  3.8326 1.6677 3.0022 1.1844 0.8303854      2.045469  
1 1 1 11 5  16 o 6.0746 1.0500 39.970   10.860  43.264    24.484  39.163    12.117  6.0293 1.8520 6.1199 0.9900 -0.9051609E-01 2.099987  
1 1 1 11 5  17 o 4.3106 1.1386 14.173   10.248  30.668    25.828  11.091    11.164  5.1968 1.9026 3.4243 1.2513 1.772564       2.277236  
1 1 1 11 5  18 o 4.0754 1.1321 13.078   10.479  20.743    26.823  11.697    11.383  4.6781 1.8782 3.4727 1.2644 1.205359       2.264119  
1 1 1 11 5  19 o 4.9772 1.1131 25.765   10.009  33.019    25.447  24.438    10.887  5.2835 1.8950 4.6710 1.1683 0.6125293      2.226209  
1 1 1 11 5  20 o 8.5808 1.0748 81.435   13.125  86.632    32.749  80.440    14.325  8.3453 1.9901 8.8164 0.8124 -0.4710779     2.149532  
1 1 1 11 5  21 o 15.241 0.7873 259.275  19.218  230.136   40.800  267.583   21.787  14.340 1.4226 16.143 0.6748 -1.803268      1.574564  
1 1 1 11 5  22 o 18.013 0.7764 356.941  22.151  319.427   48.004  367.091   24.968  17.067 1.4064 18.960 0.6585 -1.893185      1.552884  
1 1 1 11 5  23 o 9.7450 1.0454 97.423   14.377  121.299   37.059  93.193    15.598  10.002 1.9225 9.4883 0.8220 0.5133839      2.090821  
1 1 1 11 5  24 o 11.532 1.1358 161.701  17.279  134.617   42.894  166.947   18.879  10.324 2.1474 12.739 0.7410 -2.415459      2.271619  
1 1 1 11 5  25 f 7.4947 1.3481 78.033   20.997  49.994    38.464  89.936    25.061  6.0667 2.3017 8.9226 1.4043 -2.855851      2.696273  
1 1 1 11 5  26 o 4.6046 1.3624 18.569   19.835  28.054    35.057  14.103    24.055  5.0405 2.0990 4.1687 1.7376 0.8717575      2.724885  
1 1 1 11 5  27 o 5.6616 1.3605 49.254   20.184  27.082    30.596  66.340    26.858  4.5937 1.9399 6.7294 1.9079 -2.135671      2.720928  
1 1 1 11 5  28 o 3.2584 1.1012 -14.2779 19.597  -2.9622   30.881  -21.9070  25.356  3.5966 1.6889 2.9203 1.4136 0.6763103      2.202384  
1 1 1 11 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 5  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 6  0  o 5.2201 2.0454 37.804   20.442  37.804    20.442  0.0000    0.0000  5.2201 2.0454 5.2201 2.0454 -0.000000      0.000000  
1 1 1 11 6  1  o 13.431 0.5434 181.570  14.570  191.713   20.414  171.040   20.800  13.817 0.7388 13.046 0.7972 0.7707586      1.086870  
1 1 1 11 6  2  o 20.437 0.5137 419.612  20.988  406.576   29.743  432.541   29.620  20.119 0.7392 20.755 0.7136 -0.6356087     1.027405  
1 1 1 11 6  3  f 24.194 0.5150 588.069  24.917  581.399   35.322  594.676   35.154  24.056 0.7342 24.331 0.7224 -0.2749138     1.029969  
1 1 1 11 6  4  o 11.707 0.5727 138.008  13.396  143.199   18.807  132.660   19.087  11.933 0.7880 11.482 0.8312 0.4511557      1.145384  
1 1 1 11 6  5  o 13.509 0.5514 183.518  14.894  185.763   21.364  181.394   20.776  13.589 0.7861 13.429 0.7735 0.1595030      1.102833  
1 1 1 11 6  6  o 13.919 0.5551 195.155  15.426  190.663   22.335  199.253   21.331  13.763 0.8114 14.075 0.7577 -0.3124657     1.110208  
1 1 1 11 6  7  o 29.273 0.5362 862.143  31.388  865.287   44.650  859.071   44.134  29.325 0.7613 29.221 0.7552 0.1040745      1.072320  
1 1 1 11 6  8  o 13.177 0.5763 175.578  15.139  159.386   21.381  191.859   21.440  12.561 0.8511 13.793 0.7772 -1.231854      1.152565  
1 1 1 11 6  9  o 12.361 0.5876 154.760  14.526  152.832   20.545  156.687   20.542  12.283 0.8363 12.439 0.8257 -0.1559687     1.175277  
1 1 1 11 6  10 o 14.480 0.7635 216.372  20.130  218.856   24.052  210.560   36.784  14.692 0.8185 14.268 1.2891 0.4247894      1.526987  
1 1 1 11 6  11 o 11.781 0.6095 142.288  14.335  133.691   20.384  150.698   20.162  11.419 0.8926 12.144 0.8301 -0.7247877     1.218932  
1 1 1 11 6  12 o 5.0600 1.0085 28.056   10.846  21.330    15.780  34.079    14.932  4.5344 1.4975 5.5856 1.3513 -1.051167      2.017091  
1 1 1 11 6  13 o 13.397 0.6113 185.838  16.242  160.603   23.135  210.363   22.808  12.465 0.9280 14.328 0.7959 -1.862642      1.222556  
1 1 1 11 6  14 o 8.2777 0.7385 71.325   12.189  78.969    17.975  64.817    16.586  8.6895 1.0343 7.8658 1.0543 0.8237715      1.476902  
1 1 1 11 6  15 o 21.573 0.5578 478.222  24.059  467.348   34.167  488.917   33.884  21.321 0.8013 21.825 0.7762 -0.5048180     1.115605  
1 1 1 11 6  16 o 3.1800 0.9864 3.0334   9.1822  -8.4007   25.240  4.7774    9.8576  3.5348 1.6121 2.8252 1.1371 0.7095516      1.972773  
1 1 1 11 6  17 o 6.0231 1.0823 43.550   11.743  34.952    26.027  45.747    13.158  5.4553 1.9207 6.5910 0.9982 -1.135632      2.164607  
1 1 1 11 6  18 f 3.7499 1.0987 -1.2170  9.4083  32.944    27.268  -5.8333   10.024  5.3013 1.9528 2.1985 1.0077 3.102753       2.197469  
1 1 1 11 6  19 o 3.7944 1.0430 13.016   10.474  -4.3945   25.359  16.597    11.501  3.6646 1.6490 3.9241 1.2776 -0.2595887     2.086030  
1 1 1 11 6  20 o 14.887 0.8278 253.737  18.613  211.345   41.755  264.249   20.793  13.700 1.5239 16.074 0.6468 -2.374525      1.655509  
1 1 1 11 6  21 o 3.3591 0.9959 7.2703   9.4037  -24.2176  29.006  10.969    9.9406  3.3747 1.6004 3.3434 1.1860 0.3131604E-01  1.991900  
1 1 1 11 6  22 o 8.0307 1.0898 54.178   12.904  109.740   34.969  45.420    13.884  9.5120 1.9046 6.5494 1.0599 2.962577       2.179640  
1 1 1 11 6  23 o 6.8487 1.1335 68.540   12.811  25.354    34.897  75.266    13.772  5.1728 2.1181 8.5245 0.8078 -3.351649      2.266926  
1 1 1 11 6  24 o 8.2100 1.1971 101.027  14.264  46.886    37.290  110.307   15.439  6.0784 2.2749 10.342 0.7464 -4.263248      2.394246  
1 1 1 11 6  25 f 15.806 0.8460 278.413  20.188  265.091   46.801  281.459   22.377  15.091 1.5506 16.520 0.6773 -1.428960      1.692044  
1 1 1 11 6  26 o 3.2662 1.0905 -14.4414 17.938  -20.2861  30.531  -11.3602  22.168  3.4236 1.6289 3.1087 1.4504 0.3148253      2.180997  
1 1 1 11 6  27 o 13.571 0.9335 220.751  24.746  211.568   38.460  227.237   32.326  13.061 1.4724 14.081 1.1478 -1.020653      1.866924  
1 1 1 11 6  28 o 4.0058 1.2369 4.2507   19.449  48.156    31.730  -22.1753  24.616  5.1728 2.0541 2.8388 1.3785 2.334024       2.473807  
1 1 1 11 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 7  0  o 4.8671 1.9965 33.570   19.188  0.0000    0.0000  33.570    19.188  4.8671 1.9965 4.8671 1.9965 -0.000000      0.000000  
1 1 1 11 7  1  o 10.708 0.5954 115.882  12.698  105.389   18.148  125.947   17.774  10.228 0.8872 11.189 0.7943 -0.9613838     1.190767  
1 1 1 11 7  2  o 9.8666 0.6192 97.966   12.211  102.722   17.576  93.528    16.978  10.098 0.8702 9.6349 0.8811 0.4633770      1.238370  
1 1 1 11 7  3  o 5.2315 0.9385 28.741   9.8585  32.907    14.345  25.012    13.571  5.5805 1.3080 4.8825 1.3463 0.6979938      1.877088  
1 1 1 11 7  4  o 13.518 0.5523 183.761  14.929  187.921   21.399  179.815   20.838  13.667 0.7829 13.369 0.7794 0.2976379      1.104667  
1 1 1 11 7  5  o 18.249 0.5307 335.134  19.353  317.925   27.323  352.461   27.417  17.776 0.7685 18.722 0.7322 -0.9458656     1.061492  
1 1 1 11 7  6  o 17.400 0.5421 304.994  18.850  319.188   26.671  290.828   26.644  17.807 0.7489 16.992 0.7840 0.8148232      1.084206  
1 1 1 11 7  7  o 23.315 0.5297 548.341  24.697  543.318   34.736  553.476   35.122  23.207 0.7484 23.423 0.7497 -0.2155762     1.059335  
1 1 1 11 7  8  o 10.368 0.6258 109.061  12.964  102.468   18.138  115.947   18.537  10.045 0.9028 10.692 0.8669 -0.6466188     1.251638  
1 1 1 11 7  9  o 15.975 0.5638 258.661  18.000  246.244   25.350  271.286   25.562  15.584 0.8133 16.366 0.7809 -0.7820148     1.127542  
1 1 1 11 7  10 o 11.848 0.6142 143.679  14.554  143.398   20.534  143.964   20.632  11.837 0.8674 11.860 0.8698 -0.2258205E-01 1.228380  
1 1 1 11 7  11 o 18.441 0.5563 346.524  20.506  337.084   29.147  355.777   28.855  18.186 0.8014 18.696 0.7717 -0.5102730     1.112527  
1 1 1 11 7  12 o 2.9983 0.9024 -1.5505  9.9164  8.6246    14.557  -10.3600  13.545  3.5268 1.3942 2.4698 1.1460 1.056988       1.804773  
1 1 1 11 7  13 o 7.1997 0.8979 56.578   12.358  73.669    17.691  40.289    17.271  8.4040 1.0525 5.9953 1.4551 2.408734       1.795887  
1 1 1 11 7  14 o 4.5730 1.0345 22.906   10.707  21.268    15.764  24.310    14.588  4.4603 1.4974 4.6857 1.4278 -0.2254372     2.069004  
1 1 1 11 7  15 o 8.6082 0.7569 78.736   12.941  70.290    18.589  86.678    18.026  8.1248 1.1440 9.0915 0.9914 -0.9666986     1.513754  
1 1 1 11 7  16 o 4.5548 0.9878 23.506   10.788  9.3622    16.684  33.671    14.143  3.6563 1.4766 5.4533 1.3126 -1.796997      1.975644  
1 1 1 11 7  17 o 7.1485 0.8657 56.416   12.075  55.940    17.696  56.831    16.520  7.0401 1.3048 7.2570 1.1382 -0.2168593     1.731475  
1 1 1 11 7  18 o 5.4384 1.2569 29.166   13.507  52.258    29.396  22.985    15.208  6.3661 2.0398 4.5106 1.4692 1.855511       2.513841  
1 1 1 11 7  19 o 10.329 1.0593 133.480  15.051  98.557    34.700  141.572   16.704  8.9160 1.9957 11.743 0.7113 -2.826632      2.118688  
1 1 1 11 7  20 o 3.8808 1.0147 15.705   10.345  -23.7650  29.757  21.131    11.033  3.4206 1.6218 4.3410 1.2201 -0.9204466     2.029492  
1 1 1 11 7  21 o 5.1575 1.1036 32.933   11.547  12.166    29.224  36.775    12.570  4.5110 1.9000 5.8040 1.1235 -1.293047      2.207275  
1 1 1 11 7  22 o 6.1169 1.1761 45.802   12.122  32.513    34.226  47.708    12.963  5.4851 2.1473 6.7487 0.9604 -1.263573      2.352251  
1 1 1 11 7  23 o 9.6852 1.0031 96.540   14.348  119.093   34.984  91.980    15.732  9.9584 1.8237 9.4120 0.8358 0.5464439      2.006113  
1 1 1 11 7  24 o 8.1992 1.2029 69.060   13.776  100.119   38.239  64.428    14.768  8.5930 2.2119 7.8055 0.9460 0.7875462      2.405735  
1 1 1 11 7  25 o 12.903 0.9599 201.040  17.796  164.927   41.485  209.183   19.700  11.585 1.7905 14.222 0.6926 -2.636825      1.919772  
1 1 1 11 7  26 o 5.3476 1.1466 37.075   10.584  21.128    39.621  38.301    10.983  4.7333 2.1001 5.9618 0.9211 -1.228473      2.293197  
1 1 1 11 7  27 o 7.6447 1.3501 87.465   20.440  80.338    33.594  91.653    25.756  6.9284 2.1762 8.3610 1.5985 -1.432568      2.700164  
1 1 1 11 7  28 o 3.8474 1.2369 13.456   19.892  19.287    34.210  10.477    24.450  4.0727 1.8648 3.6221 1.6254 0.4506106      2.473752  
1 1 1 11 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 8  0  o 16.181 0.7771 266.804  24.843  270.298   36.245  263.708   34.119  16.274 1.1260 16.087 1.0713 -0.000000      0.000000  
1 1 1 11 8  1  o 21.699 0.5207 473.557  22.591  469.726   32.275  477.236   31.632  21.612 0.7467 21.787 0.7259 -0.1754646     1.041401  
1 1 1 11 8  2  o 19.363 0.6432 374.802  23.209  387.349   41.413  369.057   28.023  19.568 1.0582 19.158 0.7314 0.4100304      1.286351  
1 1 1 11 8  3  f 19.408 0.5301 379.014  20.574  370.194   29.088  387.845   29.104  19.181 0.7583 19.635 0.7411 -0.4546680     1.060281  
1 1 1 11 8  4  o 8.7095 0.7135 77.231   12.246  61.454    17.110  93.802    17.535  7.7822 1.0993 9.6367 0.9098 -1.854466      1.426955  
1 1 1 11 8  5  o 21.794 0.5259 478.839  22.911  459.249   32.143  499.069   32.666  21.339 0.7532 22.250 0.7341 -0.9106255     1.051720  
1 1 1 11 8  6  o 13.908 0.5670 195.658  15.768  196.486   22.132  194.803   22.470  13.939 0.7939 13.876 0.8097 0.6291485E-01  1.133944  
1 1 1 11 8  7  o 7.7447 0.7588 61.238   11.707  68.970    16.902  54.107    16.231  8.2210 1.0280 7.2684 1.1166 0.9525523      1.517697  
1 1 1 11 8  8  o 9.4348 0.6611 90.781   12.473  92.894    17.810  88.748    17.472  9.5428 0.9332 9.3267 0.9367 0.2160845      1.322197  
1 1 1 11 8  9  o 8.2165 0.7380 69.965   12.102  74.996    17.123  64.944    17.106  8.5222 1.0046 7.9108 1.0812 0.6114058      1.475902  
1 1 1 11 8  10 o 13.987 0.5969 199.784  16.576  232.296   23.892  169.613   23.016  15.102 0.7910 12.872 0.8940 2.229891       1.193757  
1 1 1 11 8  11 o 8.9500 0.7242 83.079   12.953  87.515    18.668  78.959    17.988  9.1826 1.0165 8.7174 1.0317 0.4652414      1.448331  
1 1 1 11 8  12 o 3.7945 0.9845 12.746   10.041  6.9423    14.644  17.895    13.793  3.4282 1.3838 4.1608 1.4007 -0.7326200     1.968939  
1 1 1 11 8  13 o 9.4399 0.7143 92.884   13.465  100.030   19.569  86.460    18.556  9.7880 0.9997 9.0918 1.0205 0.6961946      1.428530  
1 1 1 11 8  14 o 10.311 0.6844 110.441  14.078  118.181   20.826  103.928   19.104  10.637 0.9789 9.9850 0.9567 0.6525154      1.368735  
1 1 1 11 8  15 o 8.0329 0.8151 71.158   12.417  55.302    17.879  85.933    17.258  7.0196 1.3220 9.0461 0.9539 -2.026586      1.630217  
1 1 1 11 8  16 o 8.2923 0.8542 76.299   13.486  61.653    19.604  89.454    18.580  7.3842 1.3782 9.2004 1.0098 -1.816232      1.708479  
1 1 1 11 8  17 o 9.2429 0.7363 90.589   13.568  101.080   19.735  81.184    18.685  9.7650 1.0105 8.7208 1.0713 1.044218       1.472669  
1 1 1 11 8  18 o 10.690 0.7106 122.007  14.938  107.881   22.330  133.451   20.098  10.062 1.1096 11.317 0.8880 -1.254958      1.421154  
1 1 1 11 8  19 o 10.530 0.7446 122.272  14.957  90.779    22.512  147.157   20.012  9.1570 1.2292 11.903 0.8406 -2.746011      1.489179  
1 1 1 11 8  20 o 12.653 0.8661 178.816  19.189  160.312   36.046  186.134   22.669  11.928 1.5110 13.379 0.8472 -1.451215      1.732285  
1 1 1 11 8  21 o 8.2351 1.1814 91.285   14.305  58.931    34.710  97.905    15.701  6.7394 2.2207 9.7307 0.8068 -2.991287      2.362742  
1 1 1 11 8  22 o 14.953 0.8016 239.547  19.038  237.600   42.188  240.045   21.333  14.612 1.4436 15.293 0.6975 -0.6809349     1.603231  
1 1 1 11 8  23 o 10.812 1.1243 141.049  16.209  120.465   40.206  145.045   17.712  9.7553 2.1212 11.868 0.7462 -2.112986      2.248603  
1 1 1 11 8  24 o 6.5732 1.1723 58.241   12.878  37.611    34.735  61.529    13.866  5.5110 2.1616 7.6354 0.9080 -2.124393      2.344544  
1 1 1 11 8  25 o 5.1342 1.2143 29.505   10.263  31.020    38.567  29.390    10.647  5.1551 2.1776 5.1133 1.0752 0.4185629E-01  2.428536  
1 1 1 11 8  26 o 6.1427 1.1645 53.080   11.766  45.979    36.216  53.918    12.441  5.2502 2.1547 7.0351 0.8842 -1.784821      2.329088  
1 1 1 11 8  27 o 4.4281 1.3111 26.470   20.693  7.2102    33.416  38.450    26.355  3.9080 1.8086 4.9483 1.8985 -1.040257      2.622124  
1 1 1 11 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 8  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 9  0  o 3.1292 1.2787 12.406   13.067  9.1893    18.698  15.476    18.269  2.9393 1.7656 3.3191 1.8503 -0.000000      0.000000  
1 1 1 11 9  1  o 27.944 0.5309 787.310  29.657  758.372   41.765  816.741   42.119  27.422 0.7615 28.465 0.7398 -1.042454      1.061725  
1 1 1 11 9  2  o 21.761 0.5264 477.642  22.906  465.990   32.287  489.449   32.501  21.492 0.7511 22.030 0.7377 -0.5377636     1.052783  
1 1 1 11 9  3  o 9.3948 0.6822 90.460   12.647  73.876    17.922  106.906   17.848  8.5156 1.0523 10.274 0.8686 -1.758499      1.364490  
1 1 1 11 9  4  o 6.1943 1.0926 41.982   13.035  38.768    22.486  43.608    15.998  5.9902 1.7604 6.3983 1.2946 -0.4080815     2.185178  
1 1 1 11 9  5  o 8.8569 0.7442 80.980   12.899  61.641    18.104  100.925   18.385  7.7495 1.1681 9.9643 0.9225 -2.214858      1.488432  
1 1 1 11 9  6  o 8.0745 0.7616 66.775   12.297  68.014    17.418  65.544    17.363  8.1506 1.0685 7.9983 1.0854 0.1523032      1.523106  
1 1 1 11 9  7  o 7.7670 0.7860 62.289   12.198  66.117    17.524  58.690    16.991  8.0020 1.0950 7.5320 1.1279 0.4700737      1.571993  
1 1 1 11 9  8  o 10.805 0.6483 121.016  13.842  141.307   19.505  100.432   19.646  11.752 0.8299 9.8587 0.9964 1.893551       1.296682  
1 1 1 11 9  9  o 4.2951 1.0252 18.680   10.449  18.580    14.698  18.782    14.859  4.2841 1.4459 4.3061 1.4538 -0.2194118E-01 2.050352  
1 1 1 11 9  10 o 11.149 0.6527 128.576  14.515  123.799   21.048  132.909   20.045  10.936 0.9624 11.362 0.8821 -0.4261637     1.305469  
1 1 1 11 9  11 o 8.9828 0.7307 84.454   13.007  72.304    18.490  96.354    18.300  8.3117 1.1123 9.6540 0.9478 -1.342315      1.461335  
1 1 1 11 9  12 o 4.2727 0.9822 16.240   10.690  33.144    15.993  2.5872    14.373  5.4123 1.4488 3.1330 1.3267 2.279318       1.964468  
1 1 1 11 9  13 o 7.8778 0.8438 66.133   12.860  80.306    19.091  54.360    17.399  8.7285 1.0936 7.0270 1.2854 1.701517       1.687641  
1 1 1 11 9  14 o 10.155 0.7085 108.638  14.383  112.013   20.750  105.517   19.953  10.304 1.0069 10.006 0.9971 0.2981520      1.417059  
1 1 1 11 9  15 o 10.449 0.7027 115.205  14.622  103.607   20.697  126.761   20.659  9.8940 1.0460 11.003 0.9388 -1.109009      1.405469  
1 1 1 11 9  16 o 4.5666 1.0074 23.531   11.051  10.661    16.522  33.950    14.866  3.7014 1.4783 5.4319 1.3689 -1.730437      2.014787  
1 1 1 11 9  17 o 4.7448 1.0205 24.126   11.311  38.738    16.639  11.572    15.423  5.7860 1.4428 3.7036 1.4437 2.082426       2.041099  
1 1 1 11 9  18 o 13.716 0.6336 195.711  17.359  207.424   25.240  185.197   23.914  14.105 0.8947 13.326 0.8972 0.7786465      1.267104  
1 1 1 11 9  19 o 3.0155 0.9356 -1.0673  10.587  2.9353    16.937  -3.6343   13.563  3.3212 1.4242 2.7098 1.2137 0.6113751      1.871243  
1 1 1 11 9  20 o 11.155 0.7169 128.292  15.848  151.369   24.429  111.523   20.824  12.004 1.0176 10.307 1.0102 1.696791       1.433851  
1 1 1 11 9  21 o 3.0171 0.9297 0.4694   10.079  -3.5212   17.825  2.3450    12.220  3.1350 1.3987 2.8991 1.2252 0.2358739      1.859419  
1 1 1 11 9  22 o 15.571 0.8449 261.166  23.133  261.473   44.625  261.053   27.051  15.300 1.4583 15.843 0.8537 -0.5428782     1.689867  
1 1 1 11 9  23 o 9.6051 1.1226 98.872   15.174  121.993   38.968  94.740    16.474  9.7020 2.0713 9.5083 0.8663 0.1937399      2.245142  
1 1 1 11 9  24 o 3.3178 1.1330 -17.4506 9.5590  23.550    36.602  -20.4517  9.9027  4.9722 2.1120 1.6633 0.8212 3.308915       2.265982  
1 1 1 11 9  25 o 9.9374 1.1728 129.512  16.141  108.511   38.180  134.081   17.811  8.5980 2.2086 11.277 0.7897 -2.678857      2.345554  
1 1 1 11 9  26 o 5.1022 1.1371 36.581   12.039  23.170    32.775  38.673    12.944  4.4770 1.9506 5.7274 1.1695 -1.250439      2.274297  
1 1 1 11 9  27 o 4.6981 1.3389 37.024   20.081  25.435    33.269  43.666    25.187  4.2741 1.9085 5.1220 1.8783 -0.8479786     2.677809  
1 1 1 11 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 10 0  o 13.546 0.8517 190.803  22.577  201.375   31.431  179.535   32.450  13.968 1.1427 13.124 1.2631 -0.000000      0.000000  
1 1 1 11 10 1  o 11.835 0.6284 142.447  14.822  156.794   21.047  128.332   20.876  12.436 0.8462 11.235 0.9291 1.200939       1.256708  
1 1 1 11 10 2  o 26.000 0.5352 683.545  27.831  684.357   39.362  682.734   39.357  26.015 0.7565 25.984 0.7573 0.3118896E-01  1.070451  
1 1 1 11 10 3  o 11.682 0.6344 138.460  14.808  130.552   20.527  147.040   21.382  11.333 0.9057 12.031 0.8887 -0.6979904     1.268848  
1 1 1 11 10 4  o 20.482 0.5369 425.059  21.992  422.313   31.075  427.815   31.126  20.415 0.7611 20.549 0.7574 -0.1338539     1.073729  
1 1 1 11 10 5  o 10.821 0.6706 120.429  14.422  105.109   20.366  135.839   20.427  10.112 1.0070 11.531 0.8857 -1.419099      1.341133  
1 1 1 11 10 6  o 11.039 0.6634 125.470  14.559  143.722   20.913  108.306   20.280  11.836 0.8834 10.242 0.9900 1.594333       1.326887  
1 1 1 11 10 7  o 10.496 0.6690 113.255  14.038  109.088   19.761  117.500   19.946  10.297 0.9596 10.695 0.9325 -0.3979683     1.338056  
1 1 1 11 10 8  o 12.059 0.6304 149.132  15.184  154.740   21.254  143.285   21.701  12.299 0.8640 11.818 0.9181 0.4811020      1.260727  
1 1 1 11 10 9  o 6.7458 0.9004 49.143   11.855  41.750    16.517  56.997    17.024  6.1312 1.3803 7.3604 1.1565 -1.229235      1.800717  
1 1 1 11 10 10 o 3.5073 0.9585 7.5070   9.7265  16.672    15.153  1.0843    12.685  4.1136 1.4637 2.9010 1.2380 1.212652       1.917025  
1 1 1 11 10 11 o 10.202 0.7204 108.311  14.416  138.706   21.247  82.383    19.624  11.564 0.9187 8.8392 1.1100 2.724646       1.440868  
1 1 1 11 10 12 o 3.5652 0.9941 9.3850   10.461  6.6858    15.852  11.467    13.923  3.4814 1.4268 3.6491 1.3847 -0.1677020     1.988239  
1 1 1 11 10 13 o 9.4769 0.7424 95.117   14.066  95.925    20.186  94.353    19.612  9.5103 1.0613 9.4436 1.0384 0.6671810E-01  1.484767  
1 1 1 11 10 14 o 3.9722 1.0303 15.548   10.697  14.213    16.183  16.584    14.255  3.9309 1.4926 4.0135 1.4206 -0.8265591E-01 2.060524  
1 1 1 11 10 15 o 9.3945 0.7687 95.239   14.274  89.653    21.447  99.681    19.125  9.0893 1.1798 9.6997 0.9858 -0.6104174     1.537474  
1 1 1 11 10 16 o 4.0433 1.0161 16.380   10.968  6.1498    16.410  24.637    14.744  3.4432 1.4352 4.6434 1.4390 -1.200238      2.032299  
1 1 1 11 10 17 o 9.6304 0.7741 98.139   14.874  107.411   21.870  90.160    20.289  10.055 1.0875 9.2053 1.1020 0.8500633      1.548248  
1 1 1 11 10 18 o 7.4955 0.9187 64.613   12.952  48.314    19.393  77.737    17.401  6.4235 1.5312 8.5676 1.0155 -2.144030      1.837341  
1 1 1 11 10 19 o 5.9894 0.8987 38.590   11.546  71.079    17.291  12.449    15.510  8.1960 1.0548 3.7829 1.4552 4.413157       1.797335  
1 1 1 11 10 20 o 10.468 0.7441 116.423  15.373  112.470   23.443  119.405   20.363  10.260 1.1425 10.675 0.9537 -0.4158106     1.488226  
1 1 1 11 10 21 o 13.248 0.6843 185.465  17.904  177.694   27.183  191.419   23.794  12.944 1.0500 13.551 0.8779 -0.6076126     1.368691  
1 1 1 11 10 22 o 6.4762 1.0772 46.294   13.918  70.216    21.967  30.249    17.990  7.8487 1.4529 5.1036 1.5908 2.745089       2.154424  
1 1 1 11 10 23 o 2.7739 0.9021 -11.9845 10.228  5.1117    19.349  -18.6146  12.050  3.5628 1.5249 1.9850 0.9641 1.577773       1.804114  
1 1 1 11 10 24 o 5.0219 0.9993 35.949   12.074  -16.2455  32.674  44.204    12.993  3.6500 1.7211 6.3938 1.0161 -2.743821      1.998680  
1 1 1 11 10 25 o 4.1472 1.2413 12.735   11.458  40.980    36.677  9.6802    12.062  5.0792 2.1333 3.2151 1.2697 1.864137       2.482572  
1 1 1 11 10 26 o 8.4890 1.1993 104.075  15.395  88.454    35.472  107.700   17.088  7.0540 2.2387 9.9241 0.8609 -2.870076      2.398512  
1 1 1 11 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 11 0  o 15.455 0.8377 248.109  25.470  241.569   37.090  253.945   35.037  15.234 1.2360 15.676 1.1311 -0.000000      0.000000  
1 1 1 11 11 1  o 21.703 0.5423 479.740  23.507  460.245   33.634  498.353   32.866  21.260 0.7910 22.146 0.7420 -0.8865414     1.084574  
1 1 1 11 11 2  o 12.905 0.6212 170.492  15.918  198.245   22.958  144.801   22.089  13.934 0.8238 11.876 0.9300 2.058894       1.242406  
1 1 1 11 11 3  o 4.7561 1.0580 24.290   11.284  21.014    15.935  27.586    15.981  4.4960 1.5055 5.0162 1.4868 -0.5202003     2.115935  
1 1 1 11 11 4  o 17.485 0.5599 312.127  19.580  309.491   27.745  314.743   27.636  17.409 0.7969 17.560 0.7869 -0.1516399     1.119884  
1 1 1 11 11 5  o 18.689 0.5555 355.818  20.761  349.123   29.417  362.461   29.303  18.510 0.7946 18.868 0.7765 -0.3581696     1.111064  
1 1 1 11 11 6  o 7.5416 0.8084 59.239   12.153  56.766    17.670  61.458    16.741  7.3782 1.1974 7.7050 1.0863 -0.3268342     1.616791  
1 1 1 11 11 7  o 9.7947 0.7190 99.761   13.896  121.599   20.130  79.883    19.205  10.851 0.9276 8.7388 1.0989 2.111833       1.438020  
1 1 1 11 11 8  o 13.523 0.6217 188.304  16.724  213.394   23.927  164.338   23.385  14.426 0.8293 12.621 0.9264 1.804993       1.243398  
1 1 1 11 11 9  o 3.8627 1.0116 12.064   10.953  21.770    15.584  2.5904    15.397  4.4971 1.4883 3.2284 1.3705 1.268745       2.023198  
1 1 1 11 11 10 o 4.6121 1.0847 22.416   11.779  28.789    17.550  17.193    15.889  5.0614 1.5701 4.1628 1.4969 0.8985186      2.169361  
1 1 1 11 11 11 o 4.3474 1.0204 18.535   11.063  30.881    16.107  7.5098    15.221  5.2163 1.4770 3.4784 1.4084 1.737851       2.040889  
1 1 1 11 11 12 o 5.8228 1.0607 39.030   12.356  42.559    18.727  36.310    16.444  6.0353 1.5449 5.6104 1.4537 0.4249496      2.121314  
1 1 1 11 11 13 o 15.333 0.6033 244.542  18.471  234.991   26.507  253.556   25.752  15.022 0.8823 15.645 0.8230 -0.6224871     1.206571  
1 1 1 11 11 14 o 7.0991 0.9468 56.956   13.103  51.335    18.898  62.161    18.184  6.6423 1.4622 7.5559 1.2033 -0.9135985     1.893654  
1 1 1 11 11 15 o 3.7142 1.0364 10.518   11.456  16.504    16.951  5.4849    15.544  4.0863 1.5329 3.3421 1.3952 0.7442067      2.072790  
1 1 1 11 11 16 o 9.1684 0.7935 89.211   14.512  98.374    21.306  81.282    19.821  9.6126 1.1082 8.7243 1.1360 0.8882885      1.587013  
1 1 1 11 11 17 f 10.612 0.7150 119.087  15.144  116.502   21.978  121.423   20.896  10.481 1.0485 10.743 0.9726 -0.2619505     1.430098  
1 1 1 11 11 18 o 4.4486 1.0720 21.742   11.400  22.643    16.796  20.972    15.524  4.5236 1.5455 4.3735 1.4859 0.1501122      2.143961  
1 1 1 11 11 19 o 12.057 0.6914 153.292  16.572  140.454   24.017  164.960   22.895  11.535 1.0410 12.579 0.9100 -1.044251      1.382729  
1 1 1 11 11 20 o 2.6532 0.8647 -8.9435  10.603  -16.7955  17.261  -4.1852   13.437  2.6220 1.2408 2.6843 1.2047 -0.6224442E-01 1.729482  
1 1 1 11 11 21 o 2.7729 0.8330 -4.2984  9.6712  -36.2007  17.449  9.8478    11.619  2.1867 1.0815 3.3590 1.2673 -1.172235      1.666052  
1 1 1 11 11 22 o 4.7345 1.0062 26.475   12.442  -0.8724   20.663  42.031    15.585  3.4145 1.5157 6.0544 1.3239 -2.639863      2.012482  
1 1 1 11 11 23 o 4.8473 1.0920 28.854   12.106  20.029    21.083  33.195    14.786  4.3802 1.6934 5.3143 1.3792 -0.9341116     2.183982  
1 1 1 11 11 24 o 4.0290 1.0907 15.646   11.286  24.687    21.258  12.096    13.319  4.5393 1.7138 3.5187 1.3497 1.020557       2.181468  
1 1 1 11 11 25 o 6.9417 1.1165 64.816   15.135  54.265    24.967  70.946    19.030  6.0822 1.8705 7.8011 1.2197 -1.718868      2.233003  
1 1 1 11 11 26 o 4.5740 1.3112 33.358   18.948  26.627    31.303  37.251    23.804  4.3132 1.8920 4.8348 1.8160 -0.5216098     2.622488  
1 1 1 11 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 11 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 12 0  o 11.682 1.0755 152.745  21.864  105.591   31.588  196.116   30.294  9.6146 1.8372 13.749 1.1187 -0.000000      0.000000  
1 1 1 11 12 1  o 10.914 0.6814 122.302  14.863  122.019   20.618  122.609   21.445  10.906 0.9453 10.921 0.9818 -0.1547432E-01 1.362892  
1 1 1 11 12 2  o 9.9275 0.7446 103.427  14.329  132.456   20.332  74.782    20.197  11.379 0.8934 8.4761 1.1914 2.902814       1.489192  
1 1 1 11 12 3  o 9.1430 0.8182 88.986   13.909  59.141    19.216  121.828   20.158  7.3896 1.3500 10.896 0.9250 -3.506811      1.636464  
1 1 1 11 12 4  o 4.8982 0.9791 25.599   10.942  39.973    15.397  10.932    15.553  6.0406 1.3120 3.7558 1.4538 2.284740       1.958279  
1 1 1 11 12 5  o 19.667 0.5591 396.309  21.983  386.442   31.169  406.076   31.009  19.416 0.8027 19.918 0.7784 -0.5016270     1.118132  
1 1 1 11 12 6  o 7.0290 0.9244 53.878   12.514  54.730    17.956  53.074    17.450  7.0804 1.3165 6.9776 1.2982 0.1028285      1.848895  
1 1 1 11 12 7  o 8.4015 0.7766 74.219   12.984  72.320    19.174  75.829    17.646  8.2800 1.1578 8.5231 1.0352 -0.2430830     1.553111  
1 1 1 11 12 8  o 8.4491 0.8138 76.187   13.596  87.356    19.047  64.584    19.414  9.1275 1.0434 7.7706 1.2492 1.356924       1.627602  
1 1 1 11 12 9  o 12.726 0.6243 167.115  15.874  176.252   23.099  158.939   21.850  13.054 0.8847 12.398 0.8812 0.6560726      1.248692  
1 1 1 11 12 10 o 3.1946 0.9387 -0.5488  10.862  -14.6511  15.237  14.021    15.487  2.4889 1.1742 3.9002 1.4648 -1.411251      1.877340  
1 1 1 11 12 11 o 4.2174 0.9266 15.232   10.981  -8.5603   15.948  36.679    15.142  2.7580 1.2666 5.6768 1.3529 -2.918830      1.853278  
1 1 1 11 12 12 o 5.6502 1.0705 36.578   12.410  44.545    18.408  29.941    16.802  6.2041 1.5000 5.0963 1.5277 1.107821       2.141036  
1 1 1 11 12 13 o 11.797 0.6973 148.077  16.321  127.868   23.088  168.261   23.074  10.940 1.0552 12.653 0.9118 -1.712485      1.394566  
1 1 1 11 12 14 o 8.9652 0.7941 85.570   14.162  98.567    21.156  75.018    19.063  9.5869 1.1034 8.3434 1.1424 1.243513       1.588240  
1 1 1 11 12 15 o 6.6573 0.9932 50.009   12.802  57.725    18.838  43.387    17.450  7.1636 1.3646 6.1510 1.4433 1.012673       1.986318  
1 1 1 11 12 16 o 7.2318 0.9585 58.511   13.507  54.848    19.748  61.730    18.515  6.9083 1.4742 7.5552 1.2253 -0.6468735     1.916932  
1 1 1 11 12 17 o 10.057 0.7739 108.282  15.494  106.755   22.905  109.570   21.038  9.9573 1.1501 10.156 1.0357 -0.1990833     1.547763  
1 1 1 11 12 18 o 15.122 0.6390 238.028  19.304  232.775   27.755  242.951   26.867  14.944 0.9287 15.300 0.8780 -0.3561525     1.278007  
1 1 1 11 12 19 o 6.2364 1.0429 45.607   12.974  34.381    19.075  55.270    17.698  5.4271 1.6279 7.0456 1.3040 -1.618428      2.085790  
1 1 1 11 12 20 o 8.8919 0.9446 91.206   15.517  66.456    23.243  111.109   20.843  7.5342 1.5923 10.250 1.0168 -2.715490      1.889264  
1 1 1 11 12 21 o 7.9585 0.9039 68.862   14.230  74.940    22.115  64.567    18.589  8.2157 1.3459 7.7012 1.2069 0.5144372      1.807769  
1 1 1 11 12 22 o 6.5160 1.0458 52.399   13.477  37.926    21.687  61.505    17.202  5.5197 1.7503 7.5123 1.1449 -1.992680      2.091504  
1 1 1 11 12 23 o 9.1341 0.8695 95.190   15.108  87.488    24.720  99.782    19.089  8.6595 1.4273 9.6087 0.9933 -0.9492092     1.738926  
1 1 1 11 12 24 o 3.3926 1.0126 8.8679   11.617  -1.1766   21.868  12.817    13.712  3.2825 1.4984 3.5026 1.3624 -0.2200997     2.025201  
1 1 1 11 12 25 o 4.2697 1.1207 24.641   12.992  16.566    22.879  28.484    15.784  3.9264 1.6688 4.6131 1.4965 -0.6867356     2.241484  
1 1 1 11 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 13 0  o 7.8810 1.3832 75.922   18.866  73.515    26.801  78.286    26.563  7.6928 2.0161 8.0693 1.8942 -0.000000      0.000000  
1 1 1 11 13 1  o 2.7221 0.8765 -8.8207  10.731  -2.0423   14.601  -16.7839  15.826  2.9379 1.2903 2.5063 1.1867 0.4316416      1.753043  
1 1 1 11 13 2  o 12.096 0.6529 151.085  15.723  133.462   22.011  169.445   22.467  11.356 0.9691 12.836 0.8752 -1.479611      1.305810  
1 1 1 11 13 3  o 18.603 0.5657 354.264  21.047  352.879   29.775  355.648   29.755  18.566 0.8019 18.641 0.7981 -0.7472610E-01 1.131374  
1 1 1 11 13 4  o 9.3274 0.7335 90.965   13.629  83.764    19.531  97.800    19.028  8.9461 1.0916 9.7087 0.9799 -0.7625523     1.466925  
1 1 1 11 13 5  o 16.005 0.5952 264.040  19.040  276.660   27.120  251.775   26.736  16.390 0.8273 15.619 0.8559 0.7703629      1.190371  
1 1 1 11 13 6  o 11.058 0.6897 128.251  15.075  106.568   21.312  149.965   21.328  10.077 1.0575 12.038 0.8858 -1.961974      1.379487  
1 1 1 11 13 7  o 4.7795 1.0608 25.083   11.597  17.641    16.586  32.201    16.220  4.2230 1.5279 5.3361 1.4720 -1.113108      2.121646  
1 1 1 11 13 8  o 5.9381 1.0604 40.518   12.710  33.546    18.194  47.164    17.764  5.4059 1.5820 6.4704 1.4123 -1.064435      2.120709  
1 1 1 11 13 9  o 4.0838 1.0675 16.320   11.591  13.801    16.564  18.737    16.227  3.9246 1.5053 4.2430 1.5141 -0.3184083     2.135050  
1 1 1 11 13 10 o 6.7762 1.0172 52.579   13.360  54.058    18.926  51.110    18.863  6.8831 1.4219 6.6693 1.4551 0.2138014      2.034451  
1 1 1 11 13 11 o 8.7845 0.8068 82.502   14.156  88.603    20.502  76.944    19.568  9.1017 1.1263 8.4673 1.1555 0.6344461      1.613619  
1 1 1 11 13 12 o 5.1281 1.0861 30.484   12.139  37.662    17.775  24.211    16.617  5.6429 1.5345 4.6132 1.5373 1.029688       2.172125  
1 1 1 11 13 13 o 19.144 0.5861 381.462  22.441  378.339   31.703  384.599   31.771  19.063 0.8315 19.225 0.8263 -0.1618443     1.172253  
1 1 1 11 13 14 o 7.5439 0.9560 63.807   13.847  81.247    19.797  47.103    19.375  8.7223 1.1349 6.3655 1.5389 2.356858       1.912076  
1 1 1 11 13 15 o 3.9669 1.0610 13.930   11.958  5.6765    17.474  21.199    16.399  3.5141 1.4740 4.4197 1.5265 -0.9055889     2.121989  
1 1 1 11 13 16 o 12.844 0.6815 173.502  17.468  190.312   25.341  158.281   24.113  13.450 0.9420 12.238 0.9852 1.212270       1.363063  
1 1 1 11 13 17 o 22.651 0.5826 530.098  26.390  526.010   37.400  534.151   37.243  22.560 0.8289 22.743 0.8188 -0.1828785     1.165134  
1 1 1 11 13 18 o 11.591 0.7262 141.937  16.796  132.840   23.947  150.746   23.564  11.200 1.0691 11.982 0.9833 -0.7825117     1.452487  
1 1 1 11 13 19 o 11.561 0.7621 143.551  17.426  124.527   25.190  161.010   24.131  10.756 1.1709 12.366 0.9757 -1.609241      1.524159  
1 1 1 11 13 20 f 8.7295 1.0015 85.340   16.208  85.582    27.209  85.207    20.180  8.5372 1.6533 8.9218 1.1309 -0.3846321     2.003075  
1 1 1 11 13 21 o 5.4035 1.1698 35.205   13.672  37.996    21.336  33.261    17.809  5.5443 1.7331 5.2627 1.5717 0.2815137      2.339635  
1 1 1 11 13 22 o 9.3685 0.8383 95.051   15.541  113.174   24.133  82.209    20.315  10.109 1.1936 8.6275 1.1773 1.481970       1.676524  
1 1 1 11 13 23 f 3.9599 1.1083 16.860   12.915  11.346    22.365  19.619    15.820  3.8386 1.6411 4.0813 1.4898 -0.2426562     2.216510  
1 1 1 11 13 24 o 3.4794 1.0643 8.0346   13.195  9.4385    21.863  7.2302    16.549  3.6534 1.5924 3.3054 1.4124 0.3479831      2.128517  
1 1 1 11 13 25 o 4.4188 1.1525 26.487   12.938  37.946    22.012  20.439    15.992  4.9039 1.7621 3.9337 1.4861 0.9701457      2.305094  
1 1 1 11 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 13 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 14 0  o 4.4247 1.5865 29.998   18.064  44.540    27.595  19.094    23.895  5.2631 2.4064 3.5863 2.0681 -0.000000      0.000000  
1 1 1 11 14 1  o 14.969 0.6227 232.025  18.625  223.924   26.549  239.875   26.135  14.698 0.9032 15.239 0.8575 -0.5409689     1.245388  
1 1 1 11 14 2  o 2.7780 0.9118 -12.2802 12.165  -9.8449   17.071  -14.7931  17.341  2.8470 1.3086 2.7091 1.2700 0.1378984      1.823567  
1 1 1 11 14 3  o 11.867 0.7033 146.722  16.657  134.261   23.157  160.083   23.978  11.332 1.0218 12.402 0.9667 -1.070193      1.406626  
1 1 1 11 14 4  f 9.0177 0.8797 90.359   14.599  59.541    20.780  120.392   20.514  7.2738 1.4788 10.762 0.9531 -3.487843      1.759326  
1 1 1 11 14 5  o 6.2880 1.0475 44.563   12.871  42.194    17.087  47.670    19.570  6.1176 1.4233 6.4584 1.5372 -0.3408356     2.094976  
1 1 1 11 14 6  o 2.9797 0.9302 -4.0433  11.178  -12.3654  15.846  4.2004    15.771  2.6297 1.2267 3.3298 1.3987 -0.7000728     1.860420  
1 1 1 11 14 7  o 10.126 0.7457 108.554  15.063  118.450   21.495  99.007    21.114  10.601 1.0139 9.6510 1.0939 0.9494934      1.491465  
1 1 1 11 14 8  o 4.4034 0.9734 19.851   11.268  -0.2302   16.843  36.118    15.159  3.1790 1.3913 5.6277 1.3616 -2.448679      1.946719  
1 1 1 11 14 9  o 5.3332 1.0917 33.115   12.434  27.922    17.913  37.943    17.272  4.9416 1.5933 5.7249 1.4930 -0.7832546     2.183476  
1 1 1 11 14 10 o 12.117 0.6972 155.533  16.876  150.518   24.158  160.313   23.585  11.907 1.0145 12.328 0.9566 -0.4210701     1.394357  
1 1 1 11 14 11 o 6.7477 1.0716 53.220   14.108  52.820    20.076  53.610    19.829  6.7134 1.5293 6.7820 1.5015 -0.6860876E-01 2.143255  
1 1 1 11 14 12 o 6.3025 1.0836 46.564   13.562  52.440    19.535  41.097    18.843  6.7141 1.4933 5.8909 1.5706 0.8231754      2.167249  
1 1 1 11 14 13 o 7.9154 0.9358 69.267   14.394  78.151    20.512  60.650    20.203  8.5219 1.2035 7.3089 1.4333 1.212936       1.871557  
1 1 1 11 14 14 o 10.192 0.8114 110.627  16.438  128.685   24.186  95.124    22.410  10.988 1.1006 9.3966 1.1925 1.591228       1.622712  
1 1 1 11 14 15 o 4.5551 1.0982 22.171   12.871  9.1789    18.763  33.720    17.690  3.7600 1.5479 5.3502 1.5583 -1.590263      2.196451  
1 1 1 11 14 16 o 2.9310 0.9317 -8.1691  11.732  3.2144    17.230  -18.0097  16.020  3.3927 1.4452 2.4694 1.1763 0.9232895      1.863396  
1 1 1 11 14 17 o 9.8628 0.8369 107.643  15.828  78.565    23.185  133.020   21.660  8.4600 1.3703 11.266 0.9613 -2.805747      1.673869  
1 1 1 11 14 18 o 7.8231 0.9902 67.875   15.046  82.334    22.384  55.957    20.322  8.6877 1.2882 6.9584 1.5041 1.729212       1.980358  
1 1 1 11 14 19 o 22.286 0.5965 515.351  26.570  507.163   38.089  523.111   37.082  22.096 0.8619 22.476 0.8249 -0.3799419     1.193049  
1 1 1 11 14 20 o 4.1355 1.1411 15.810   13.602  20.273    20.398  12.236    18.253  4.4086 1.6753 3.8624 1.5498 0.5462000      2.282238  
1 1 1 11 14 21 o 3.3436 1.0062 4.1004   12.057  -4.5221   18.894  10.024    15.660  3.1202 1.4119 3.5669 1.4340 -0.4466448     2.012424  
1 1 1 11 14 22 o 14.828 0.6874 238.879  20.255  225.394   29.745  250.540   27.659  14.361 1.0356 15.296 0.9041 -0.9353361     1.374745  
1 1 1 11 14 23 o 4.6459 1.1476 23.685   13.672  47.746    22.420  9.4406    17.250  5.8150 1.7696 3.4769 1.4618 2.338034       2.295281  
1 1 1 11 14 24 o 3.2497 0.9833 7.0534   11.847  -6.6614   20.545  13.886    14.501  2.9664 1.3880 3.5330 1.3932 -0.5666020     1.966582  
1 1 1 11 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 0  o 12.428 1.1271 172.645  25.274  129.631   35.775  215.502   35.710  10.599 1.8585 14.256 1.2759 -0.000000      0.000000  
1 1 1 11 15 1  o 8.0123 0.9607 70.666   15.004  64.429    21.231  76.889    21.207  7.5624 1.4565 8.4622 1.2531 -0.8998461     1.921384  
1 1 1 11 15 2  o 3.5319 1.0384 5.1679   12.346  11.516    17.287  -1.4396   17.638  3.8469 1.5198 3.2170 1.4154 0.6298840      2.076818  
1 1 1 11 15 3  o 10.510 0.7602 117.566  15.864  125.301   21.712  108.708   23.235  10.926 0.9936 10.095 1.1508 0.8303261      1.520393  
1 1 1 11 15 4  o 8.5355 0.8538 78.546   14.551  74.596    20.748  82.370    20.412  8.3025 1.2495 8.7685 1.1640 -0.4660110     1.707653  
1 1 1 11 15 5  o 3.9413 1.0303 10.816   12.423  27.716    16.989  -8.6029   18.211  4.9137 1.5482 2.9689 1.3598 1.944838       2.060610  
1 1 1 11 15 6  o 6.8069 1.0761 54.107   14.369  43.581    20.348  64.577    20.293  6.0572 1.6396 7.5566 1.3941 -1.499366      2.152158  
1 1 1 11 15 7  o 5.5958 1.1300 36.376   13.509  45.684    19.517  27.815    18.718  6.2520 1.5646 4.9395 1.6309 1.312559       2.260058  
1 1 1 11 15 8  f 9.0896 0.8176 89.057   14.745  103.457   21.233  75.644    20.492  9.8422 1.0787 8.3371 1.2289 1.505066       1.635184  
1 1 1 11 15 9  o 4.9495 1.1736 28.539   13.704  27.318    19.828  29.655    18.961  4.8715 1.6787 5.0275 1.6406 -0.1559596     2.347288  
1 1 1 11 15 10 o 3.7784 1.0738 9.0115   12.820  19.069    18.639  -0.0190   17.661  4.3145 1.6096 3.2423 1.4217 1.072284       2.147556  
1 1 1 11 15 11 o 6.7242 1.0571 52.586   13.900  60.678    19.470  44.175    19.850  7.3304 1.3786 6.1181 1.6030 1.212372       2.114266  
1 1 1 11 15 12 o 5.0798 1.1225 28.953   13.286  41.144    18.941  17.146    18.640  5.9294 1.5718 4.2302 1.6029 1.699257       2.244976  
1 1 1 11 15 13 o 6.4665 1.0311 48.445   14.101  74.601    20.114  23.164    19.774  8.3052 1.2109 4.6279 1.6693 3.677261       2.062221  
1 1 1 11 15 14 o 9.6019 0.8235 99.492   15.776  107.598   22.416  91.536    22.206  10.017 1.1189 9.1872 1.2085 0.8293133      1.646984  
1 1 1 11 15 15 o 9.3948 0.9081 96.083   16.280  121.915   23.728  73.106    22.378  10.726 1.1061 8.0637 1.4405 2.662349       1.816159  
1 1 1 11 15 16 o 8.8136 1.2403 85.808   18.543  103.059   38.253  80.509    21.200  8.9866 2.1559 8.6407 1.2267 0.3459206      2.480526  
1 1 1 11 15 17 o 7.4656 1.0582 66.373   15.427  39.442    22.358  90.850    21.314  5.7292 1.7714 9.2020 1.1581 -3.472828      2.116376  
1 1 1 11 15 18 o 3.0259 0.9655 -5.5886  12.286  -4.1218   18.610  -6.7218   16.358  3.1774 1.4225 2.8743 1.3058 0.3031733      1.930992  
1 1 1 11 15 19 o 3.5774 1.0532 6.4086   12.937  -3.9702   19.785  14.160    17.099  3.2337 1.4557 3.9211 1.5225 -0.6873908     2.106429  
1 1 1 11 15 20 o 15.443 0.6831 254.720  21.029  236.390   30.070  272.266   29.420  14.851 1.0124 16.035 0.9174 -1.183510      1.366193  
1 1 1 11 15 21 o 4.7167 1.1488 27.474   13.358  21.333    20.595  31.933    17.550  4.3665 1.6776 5.0668 1.5699 -0.7002921     2.297570  
1 1 1 11 15 22 o 3.8217 1.1058 13.946   13.158  21.921    21.217  8.9628    16.772  4.2279 1.6794 3.4155 1.4390 0.8124070      2.211625  
1 1 1 11 15 23 o 5.5533 1.2037 42.917   14.591  55.966    22.850  33.934    18.959  6.2011 1.7604 4.9055 1.6422 1.295686       2.407447  
1 1 1 11 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 15 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 16 0  o 1.7455 0.8939 -42.3756 15.349  -17.0268  22.080  -66.0787  21.351  2.1115 1.4690 1.3795 1.0187 -0.000000      0.000000  
1 1 1 11 16 1  o 3.7877 1.0859 10.078   12.790  9.0584    17.485  11.251    18.758  3.6895 1.5037 3.8860 1.5669 -0.1964331     2.171728  
1 1 1 11 16 2  o 13.092 0.6562 179.566  17.154  167.353   24.178  191.944   24.342  12.625 0.9576 13.560 0.8976 -0.9350004     1.312489  
1 1 1 11 16 3  o 10.684 0.7443 120.973  15.881  128.880   22.541  113.181   22.377  11.049 1.0200 10.319 1.0843 0.7300978      1.488650  
1 1 1 11 16 4  f 3.8581 1.0901 10.844   13.021  16.997    17.454  3.1253    19.551  4.1694 1.5572 3.5469 1.5259 0.6225421      2.180177  
1 1 1 11 16 5  o 7.4963 1.0206 64.806   14.803  50.142    21.447  78.147    20.457  6.4888 1.6492 8.5038 1.2028 -2.015077      2.041217  
1 1 1 11 16 6  o 6.8113 1.0610 54.598   14.519  70.452    20.362  38.203    20.707  8.0083 1.2713 5.6143 1.6989 2.393958       2.121900  
1 1 1 11 16 7  o 6.4111 1.0800 47.801   13.654  56.072    20.333  41.008    18.425  6.9316 1.5095 5.8905 1.5449 1.041058       2.159907  
1 1 1 11 16 8  o 4.8736 1.0731 24.242   13.446  46.587    19.251  2.9562    18.789  6.2870 1.5426 3.4603 1.4922 2.826638       2.146259  
1 1 1 11 16 9  o 7.3850 1.0203 62.367   14.524  58.500    20.222  66.488    20.875  7.1276 1.4674 7.6424 1.4179 -0.5148315     2.040547  
1 1 1 11 16 10 o 11.505 0.7575 140.155  17.418  135.077   24.092  145.715   25.213  11.289 1.0670 11.720 1.0756 -0.4307556     1.515084  
1 1 1 11 16 11 o 4.7411 1.1395 23.411   13.835  37.489    19.647  9.5637    19.486  5.6352 1.6425 3.8469 1.5798 1.788299       2.278956  
1 1 1 11 16 12 o 6.7944 1.1004 54.798   14.716  45.133    21.262  63.686    20.390  6.1188 1.6843 7.4700 1.4166 -1.351254      2.200799  
1 1 1 11 16 13 o 11.693 0.7659 145.614  17.911  148.229   25.488  143.063   25.174  11.799 1.0801 11.587 1.0862 0.2114477      1.531839  
1 1 1 11 16 14 o 8.6443 0.9580 82.189   16.114  92.698    23.164  72.336    22.429  9.2791 1.2482 8.0094 1.4537 1.269731       1.916082  
1 1 1 11 16 15 o 10.131 0.8578 110.170  17.057  138.730   24.927  85.019    23.391  11.433 1.0901 8.8292 1.3247 2.603604       1.715556  
1 1 1 11 16 16 o 4.3513 1.1626 18.640   13.774  19.362    20.743  18.070    18.422  4.4339 1.6883 4.2687 1.5987 0.1652470      2.325133  
1 1 1 11 16 17 o 10.192 0.8305 111.220  16.907  119.202   24.274  103.699   23.562  10.562 1.1491 9.8230 1.1993 0.7388334      1.660983  
1 1 1 11 16 18 o 13.458 0.9760 211.529  23.239  180.269   41.950  225.369   27.913  12.328 1.7014 14.589 0.9566 -2.261286      1.951948  
1 1 1 11 16 19 o 6.1343 1.1581 44.101   15.400  70.222    23.393  24.121    20.459  7.6523 1.5808 4.6163 1.6929 3.036056       2.316207  
1 1 1 11 16 20 o 7.7088 1.0882 72.516   16.129  69.136    23.793  75.390    21.938  7.4417 1.6426 7.9759 1.4277 -0.5342302     2.176345  
1 1 1 11 16 21 o 3.7843 1.1537 11.398   16.018  1.7265    26.673  16.854    20.033  3.6202 1.6534 3.9485 1.6094 -0.3283722     2.307413  
1 1 1 11 16 22 o 3.3847 1.0262 -2.9535  13.725  25.809    21.018  -24.3360  18.122  4.3931 1.6929 2.3764 1.1604 2.016721       2.052416  
1 1 1 11 16 23 o 5.5937 1.2212 46.895   15.591  65.755    23.498  32.059    20.840  6.6061 1.7504 4.5812 1.7034 2.024912       2.442454  
1 1 1 11 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 16 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 17 0  f 6.4191 1.7739 63.229   21.796  56.164    29.446  71.790    32.416  5.9286 2.4789 6.9096 2.5379 -0.000000      0.000000  
1 1 1 11 17 1  o 4.5046 1.1525 21.556   13.576  28.454    19.389  14.922    19.016  4.9376 1.6607 4.0716 1.5986 0.8660216      2.305072  
1 1 1 11 17 2  o 2.7462 0.9102 -16.5109 12.628  -26.1978  16.947  -4.4181   18.935  2.3310 1.1347 3.1614 1.4235 -0.8303690     1.820435  
1 1 1 11 17 3  o 3.7019 1.0820 7.8361   13.112  2.7230    17.853  13.825    19.322  3.3753 1.4551 4.0285 1.6019 -0.6532385     2.164092  
1 1 1 11 17 4  o 10.686 0.7540 121.735  16.104  118.624   22.280  125.140   23.303  10.550 1.0559 10.822 1.0766 -0.2726612     1.508001  
1 1 1 11 17 5  o 7.6726 0.9979 65.810   14.928  56.389    20.069  77.477    22.334  6.9708 1.4849 8.3744 1.3335 -1.403610      1.995803  
1 1 1 11 17 6  o 4.1440 1.0961 12.807   13.858  -6.6556   19.996  30.793    19.223  3.1740 1.4427 5.1140 1.6507 -1.939969      2.192248  
1 1 1 11 17 7  o 3.7677 1.0838 7.2150   13.634  -6.2898   19.952  19.044    18.673  3.1977 1.4486 4.3376 1.6125 -1.139813      2.167601  
1 1 1 11 17 8  o 6.0685 1.1681 44.110   14.770  35.612    21.859  51.248    20.035  5.4895 1.7590 6.6475 1.5375 -1.158049      2.336266  
1 1 1 11 17 9  o 4.2624 1.1461 15.570   14.015  26.809    20.310  5.3526    19.364  4.8898 1.6982 3.6349 1.5396 1.254858       2.292204  
1 1 1 11 17 10 o 6.1079 1.2155 45.094   15.474  43.232    22.819  46.679    21.054  5.9641 1.7787 6.2517 1.6571 -0.2876606     2.430978  
1 1 1 11 17 11 f 6.1935 1.1760 45.893   14.889  51.424    21.783  41.043    20.397  6.5438 1.6614 5.8431 1.6648 0.7006931      2.351978  
1 1 1 11 17 12 o 3.4124 1.0393 1.8115   13.012  -4.6532   19.619  6.8888    17.386  3.2433 1.4557 3.5815 1.4837 -0.3381989     2.078543  
1 1 1 11 17 13 o 6.0264 1.2001 42.617   15.557  56.875    22.489  29.534    21.543  6.9568 1.6426 5.0960 1.7502 1.860780       2.400283  
1 1 1 11 17 14 o 4.4902 1.1947 18.958   15.007  28.387    21.298  9.6606    21.149  5.0195 1.7392 3.9610 1.6383 1.058488       2.389328  
1 1 1 11 17 15 o 7.5538 1.0751 65.693   15.919  53.310    22.475  78.159    22.552  6.6753 1.6837 8.4322 1.3372 -1.756822      2.150112  
1 1 1 11 17 16 o 12.741 0.7536 171.728  19.191  179.129   27.654  164.853   26.655  13.007 1.0630 12.474 1.0684 0.5325384      1.507141  
1 1 1 11 17 17 o 10.677 0.8463 124.238  18.050  132.357   26.251  116.957   24.860  11.011 1.1920 10.343 1.2017 0.6674509      1.692652  
1 1 1 11 17 18 o 3.0522 0.9752 -6.0282  13.081  -18.2654  20.219  2.7800    17.154  2.8095 1.3335 3.2949 1.4233 -0.4853480     1.950377  
1 1 1 11 17 19 o 9.9536 0.9895 111.707  18.268  164.632   28.197  73.424    23.981  12.189 1.1567 7.7182 1.6058 4.470641       1.979025  
1 1 1 11 17 20 o 5.1172 1.3913 37.326   18.670  40.491    38.534  36.356    21.342  5.1159 2.1696 5.1186 1.7422 -0.2744675E-02 2.782562  
1 1 1 11 17 21 o 6.4666 1.1507 55.486   15.880  85.805    23.947  31.688    21.216  8.1729 1.5210 4.7602 1.7272 3.412726       2.301427  
1 1 1 11 17 22 o 5.4873 1.2581 46.603   15.836  54.013    23.277  40.218    21.607  5.8823 1.8056 5.0922 1.7525 0.7900829      2.516217  
1 1 1 11 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 0  o 10.024 1.3444 119.972  23.433  146.300   33.568  94.948    32.725  11.446 1.5457 8.6030 2.2002 -0.000000      0.000000  
1 1 1 11 18 1  o 12.414 0.7235 163.524  17.947  162.289   24.835  164.874   25.964  12.379 1.0031 12.449 1.0428 -0.7021809E-01 1.446936  
1 1 1 11 18 2  o 8.1249 1.0439 76.343   16.307  86.037    22.125  64.814    24.129  8.8862 1.2449 7.3637 1.6760 1.522515       2.087762  
1 1 1 11 18 3  o 2.7668 0.9255 -18.0254 13.448  -21.5364  18.074  -13.6713  20.127  2.5641 1.2289 2.9695 1.3843 -0.4054778     1.851082  
1 1 1 11 18 4  o 10.910 0.7835 126.672  17.047  124.240   23.159  129.548   25.185  10.819 1.0703 11.002 1.1446 -0.1830025     1.567087  
1 1 1 11 18 5  o 6.9468 1.0874 55.645   14.715  49.621    20.240  62.397    21.430  6.5205 1.5707 7.3730 1.5042 -0.8524814     2.174798  
1 1 1 11 18 6  o 5.9392 1.1847 42.019   15.383  56.229    21.454  26.986    22.067  6.9430 1.5805 4.9355 1.7652 2.007485       2.369407  
1 1 1 11 18 7  o 13.950 0.6982 205.381  19.248  244.497   27.590  168.291   26.866  15.306 0.9013 12.593 1.0667 2.712497       1.396492  
1 1 1 11 18 8  o 7.4298 1.0673 64.739   15.534  44.704    22.234  83.845    21.712  6.0740 1.7406 8.7856 1.2357 -2.711544      2.134649  
1 1 1 11 18 9  o 3.7000 1.1024 4.0989   14.566  16.275    20.446  -8.4500   20.757  4.2241 1.6579 3.1758 1.4536 1.048232       2.204876  
1 1 1 11 18 10 o 3.9290 1.1277 9.1703   14.350  -1.2774   20.293  19.621    20.295  3.4179 1.5103 4.4401 1.6750 -1.022181      2.255361  
1 1 1 11 18 11 o 8.5134 0.9398 78.853   15.977  75.338    22.801  82.244    22.395  8.3040 1.3729 8.7228 1.2837 -0.4188519     1.879571  
1 1 1 11 18 12 o 2.8236 0.9388 -16.1737 13.564  -14.7776  19.417  -17.5045  18.956  2.8840 1.3494 2.7632 1.3054 0.1207340      1.877503  
1 1 1 11 18 13 o 3.8538 1.0750 1.1221   14.562  -25.6337  20.455  28.618    20.736  2.6892 1.2937 5.0184 1.7173 -2.329203      2.150036  
1 1 1 11 18 14 f 9.4491 0.9473 98.504   17.770  85.775    25.081  111.335   25.181  8.7747 1.4292 10.123 1.2437 -1.348764      1.894562  
1 1 1 11 18 15 o 5.2382 1.2190 31.795   15.363  20.587    22.409  41.734    21.103  4.5659 1.7509 5.9106 1.6964 -1.344652      2.437932  
1 1 1 11 18 16 o 3.4564 1.0776 -0.2729  14.773  -9.0736   22.343  6.5626    19.691  3.2537 1.4961 3.6591 1.5513 -0.4053426     2.155251  
1 1 1 11 18 17 o 4.1075 1.1994 12.366   16.097  20.115    23.724  5.7554    21.912  4.4771 1.7767 3.7378 1.6117 0.7393053      2.398783  
1 1 1 11 18 18 o 6.8303 1.2196 59.902   16.600  58.360    25.162  61.091    22.089  6.6462 1.8334 7.0144 1.6088 -0.3682623     2.439135  
1 1 1 11 18 19 o 9.5006 0.9985 109.838  18.861  103.303   27.404  115.719   25.999  9.1211 1.5022 9.8802 1.3157 -0.7591648     1.996917  
1 1 1 11 18 20 o 7.5629 1.2085 77.516   17.941  93.474    26.284  63.594    24.550  8.4374 1.6164 6.6883 1.7970 1.749170       2.416998  
1 1 1 11 18 21 o 4.2204 1.2114 24.276   15.788  28.475    24.455  21.276    20.674  4.3992 1.7838 4.0415 1.6396 0.3577056      2.422865  
1 1 1 11 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 18 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 0  o 4.0236 1.6594 22.623   23.451  5.3917    33.366  39.446    32.968  3.2958 2.1360 4.7514 2.5400 -0.000000      0.000000  
1 1 1 11 19 1  o 14.638 0.6865 225.057  20.086  216.534   28.356  233.641   28.457  14.348 0.9882 14.929 0.9531 -0.5816889     1.372901  
1 1 1 11 19 2  o 4.2746 1.1347 15.030   14.392  30.005    19.791  -1.7784   20.968  5.0993 1.6767 3.4499 1.5293 1.649405       2.269402  
1 1 1 11 19 3  o 6.5679 1.2381 51.858   16.533  49.467    22.585  54.618    24.268  6.4198 1.7230 6.7161 1.7785 -0.2963338     2.476279  
1 1 1 11 19 4  o 3.1882 1.0188 -5.9418  13.869  -8.4178   19.393  -3.3492   19.844  3.0781 1.4074 3.2983 1.4733 -0.2202537     2.037527  
1 1 1 11 19 5  o 14.077 0.7196 209.864  20.245  206.592   29.003  212.973   28.273  13.953 1.0393 14.201 0.9955 -0.2476845     1.439159  
1 1 1 11 19 6  o 7.4903 1.0869 65.000   15.709  73.544    23.257  57.832    21.303  7.9662 1.5151 7.0144 1.5589 0.9517279      2.173885  
1 1 1 11 19 7  o 9.1148 0.9921 93.860   17.270  73.479    24.234  114.889   24.617  7.9247 1.5844 10.305 1.1944 -2.380179      1.984209  
1 1 1 11 19 8  o 9.7970 0.9042 104.629  17.535  120.763   24.836  88.591    24.761  10.617 1.1697 8.9773 1.3791 1.639443       1.808324  
1 1 1 11 19 9  o 7.5431 1.1132 66.783   16.779  38.267    23.747  95.217    23.712  5.6883 1.8345 9.3978 1.2616 -3.709504      2.226432  
1 1 1 11 19 10 o 5.0215 1.2444 28.355   15.496  25.275    22.146  31.309    21.690  4.8375 1.7632 5.2055 1.7564 -0.3680053     2.488769  
1 1 1 11 19 11 o 3.3641 1.0585 -3.0942  14.417  -7.8820   21.074  1.1169    19.765  3.2460 1.4776 3.4821 1.5160 -0.2360690     2.116920  
1 1 1 11 19 12 o 6.2839 1.2450 48.080   16.584  57.833    23.116  37.738    23.805  6.9664 1.6788 5.6014 1.8388 1.365010       2.489920  
1 1 1 11 19 13 f 10.800 0.8731 126.038  18.857  125.478   26.563  126.607   26.775  10.777 1.2324 10.823 1.2370 -0.4537487E-01 1.746106  
1 1 1 11 19 14 f 14.342 0.7419 219.740  21.220  207.319   30.515  231.372   29.529  13.907 1.0971 14.777 0.9992 -0.8693876     1.483897  
1 1 1 11 19 15 o 8.8694 1.0904 94.648   18.185  64.501    26.201  122.667   25.259  7.1519 1.8256 10.587 1.1929 -3.435129      2.180767  
1 1 1 11 19 16 o 6.0688 1.2907 47.208   17.441  34.756    24.701  59.588    24.630  5.2763 1.8697 6.8614 1.7797 -1.585104      2.581306  
1 1 1 11 19 17 o 4.4044 1.2418 19.908   16.312  26.833    25.222  14.928    21.387  4.7511 1.8479 4.0576 1.6594 0.6934857      2.483626  
1 1 1 11 19 18 o 5.1603 1.2731 38.037   16.852  26.119    24.847  48.190    22.933  4.5025 1.8077 5.8182 1.7932 -1.315667      2.546268  
1 1 1 11 19 19 o 6.6413 1.2989 62.799   18.344  85.410    27.606  44.923    24.546  7.8036 1.8048 5.4790 1.8684 2.324587       2.597727  
1 1 1 11 19 20 o 3.3822 1.0636 0.9760   15.911  -23.9610  24.177  20.026    21.132  2.7736 1.3512 3.9909 1.6428 -1.217320      2.127121  
1 1 1 11 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 19 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 0  o 6.5630 1.9272 70.468   25.569  63.254    37.321  76.850    35.101  6.0271 2.7964 7.0990 2.6525 -0.000000      0.000000  
1 1 1 11 20 1  o 14.283 0.7298 216.662  20.782  239.264   29.792  195.239   29.005  15.042 0.9903 13.524 1.0723 1.517431       1.459676  
1 1 1 11 20 2  o 6.2221 1.1929 45.742   16.685  21.536    23.124  72.030    24.099  4.6126 1.7762 7.8317 1.5928 -3.219090      2.385751  
1 1 1 11 20 3  o 6.2270 1.1351 46.171   16.172  16.390    23.071  74.943    22.677  4.3542 1.7441 8.0998 1.4532 -3.745653      2.270184  
1 1 1 11 20 4  o 10.456 0.8691 118.710  18.091  129.965   25.460  107.234   25.710  11.004 1.1569 9.9084 1.2974 1.095377       1.738285  
1 1 1 11 20 5  o 14.734 0.7177 228.936  21.100  221.303   30.533  235.914   29.193  14.468 1.0552 14.999 0.9732 -0.5306873     1.435421  
1 1 1 11 20 6  o 4.0738 1.1913 8.3714   16.207  19.079    23.293  -1.6766   22.564  4.5564 1.7748 3.5912 1.5895 0.9651411      2.382510  
1 1 1 11 20 7  o 4.0727 1.1874 7.2975   16.163  22.496    24.115  -5.0997   21.779  4.7471 1.8173 3.3982 1.5288 1.348942       2.374810  
1 1 1 11 20 8  f 7.9464 1.1210 72.159   17.458  89.051    25.494  57.243    23.957  8.9750 1.4203 6.9177 1.7347 2.057251       2.241949  
1 1 1 11 20 9  o 4.8255 1.2168 24.902   15.585  11.708    23.702  34.953    20.686  4.1961 1.7348 5.4548 1.7067 -1.258702      2.433648  
1 1 1 11 20 10 o 8.4278 1.0720 81.251   17.539  70.395    24.995  91.780    24.617  7.7171 1.6681 9.1385 1.3469 -1.421350      2.143948  
1 1 1 11 20 11 o 10.492 0.9578 122.318  19.710  97.674    27.981  146.589   27.769  9.3228 1.5007 11.662 1.1906 -2.338780      1.915626  
1 1 1 11 20 12 o 18.581 0.6719 362.118  24.967  368.211   35.406  356.092   35.211  18.742 0.9446 18.421 0.9557 0.3210773      1.343745  
1 1 1 11 20 13 o 5.0759 1.2153 24.785   16.636  53.758    24.963  1.6386    22.312  6.5270 1.8355 3.6248 1.5935 2.902222       2.430682  
1 1 1 11 20 14 o 5.1467 1.2941 32.061   17.190  22.529    25.590  39.899    23.205  4.6634 1.8469 5.6301 1.8132 -0.9667745     2.588225  
1 1 1 11 20 15 o 7.9199 1.2173 78.853   19.114  63.667    28.024  92.062    26.138  6.9235 1.9440 8.9163 1.4657 -1.992733      2.434653  
1 1 1 11 20 16 o 5.2981 1.1804 27.110   17.293  69.368    26.073  -6.0788   23.107  7.2732 1.8017 3.3229 1.5256 3.950316       2.360848  
1 1 1 11 20 17 o 4.4089 1.2435 24.188   17.486  8.9228    26.818  35.476    23.062  3.8412 1.7145 4.9765 1.8015 -1.135303      2.486989  
1 1 1 11 20 18 o 9.5463 1.1166 120.650  19.822  85.956    28.734  152.150   27.379  7.6918 1.8830 11.401 1.2008 -3.708953      2.233282  
1 1 1 11 20 19 o 4.4225 1.2543 28.622   17.602  16.558    26.278  38.440    23.707  3.9253 1.7274 4.9196 1.8192 -0.9942255     2.508671  
1 1 1 11 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 20 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 0  o 7.3063 1.7656 80.253   24.864  57.573    37.642  97.808    33.118  5.7610 2.7940 8.8516 2.1593 -0.000000      0.000000  
1 1 1 11 21 1  o 9.8734 0.9808 106.926  19.309  97.640    27.197  116.364   27.418  9.4031 1.4462 10.344 1.3254 -0.9405680     1.961622  
1 1 1 11 21 2  o 7.4791 1.2028 66.829   17.741  52.472    25.464  80.372    24.731  6.5680 1.8562 8.3901 1.5302 -1.822163      2.405622  
1 1 1 11 21 3  o 3.4517 1.0830 -2.3908  14.901  1.1153    21.699  -5.5199   20.499  3.6221 1.5824 3.2812 1.4790 0.3409746      2.165911  
1 1 1 11 21 4  o 3.6726 1.1302 -2.5896  16.231  -17.7236  22.453  13.976    23.490  3.0592 1.4376 4.2860 1.7444 -1.226854      2.260484  
1 1 1 11 21 5  o 5.8134 1.1871 33.932   17.433  72.560    25.972  2.2550    23.519  7.8371 1.7055 3.7897 1.6517 4.047354       2.374175  
1 1 1 11 21 6  o 9.1325 1.0743 94.195   19.002  110.093   27.377  79.417    26.397  10.021 1.3660 8.2442 1.6584 1.776523       2.148548  
1 1 1 11 21 7  o 3.6607 1.1189 -5.9463  15.789  19.001    24.543  -23.5619  20.623  4.5693 1.8090 2.7520 1.3174 1.817338       2.237875  
1 1 1 11 21 8  o 9.1162 1.0698 93.996   19.071  102.806   28.139  86.513    25.935  9.5807 1.4685 8.6518 1.5561 0.9288893      2.139601  
1 1 1 11 21 9  o 11.784 0.8386 149.321  19.758  153.637   28.389  145.267   27.515  11.948 1.1880 11.621 1.1839 0.3271255      1.677213  
1 1 1 11 21 10 o 10.053 1.0014 113.571  19.286  91.730    27.302  135.323   27.247  8.9081 1.5908 11.198 1.2166 -2.289884      2.002699  
1 1 1 11 21 11 o 6.3215 1.2439 49.883   18.050  23.386    25.993  74.559    25.084  4.7530 1.8681 7.8901 1.6430 -3.137106      2.487782  
1 1 1 11 21 12 o 8.0158 1.2454 80.032   19.437  70.470    28.284  88.588    26.756  7.4170 1.8986 8.6146 1.6122 -1.197594      2.490809  
1 1 1 11 21 13 o 8.1747 1.2300 85.440   20.455  47.226    29.128  122.618   28.730  5.9518 2.0353 10.398 1.3816 -4.445950      2.459917  
1 1 1 11 21 14 o 4.2291 1.2618 13.318   18.825  0.7885    28.165  23.435    25.309  3.8484 1.7342 4.6098 1.8333 -0.7613864     2.523560  
1 1 1 11 21 15 o 5.6064 1.3462 40.930   18.790  64.031    28.657  23.511    24.885  6.6952 1.9924 4.5177 1.8107 2.177475       2.692317  
1 1 1 11 21 16 o 4.1221 1.2010 15.604   17.490  -5.7887   25.981  33.335    23.653  3.3815 1.5751 4.8627 1.8134 -1.481180      2.401971  
1 1 1 11 21 17 f 7.1040 1.2408 74.977   19.655  42.724    28.364  104.773   27.261  5.1601 1.9720 9.0479 1.5065 -3.887787      2.481593  
1 1 1 11 21 18 o 7.1210 1.3551 79.970   19.807  95.334    29.571  67.468    26.675  7.8178 1.9080 6.4242 1.9247 1.393660       2.710175  
1 1 1 11 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 21 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 0  o 2.6338 1.2677 -14.5435 20.761  0.7813    29.279  -30.0387  29.442  2.9877 1.9593 2.2799 1.6092 -0.000000      0.000000  
1 1 1 11 22 1  o 20.383 0.6427 434.194  26.139  444.275   36.030  422.992   37.979  20.668 0.8717 20.099 0.9448 0.5686989      1.285467  
1 1 1 11 22 2  o 4.7016 1.2304 19.821   16.544  2.6144    23.068  38.044    23.741  3.7667 1.6388 5.6365 1.8356 -1.869758      2.460734  
1 1 1 11 22 3  o 5.7131 1.3010 37.832   17.660  54.949    25.757  22.648    24.259  6.6869 1.8588 4.7393 1.8207 1.947558       2.601976  
1 1 1 11 22 4  o 5.8011 1.0832 32.016   17.363  79.900    24.649  -15.1456  24.462  8.3258 1.5369 3.2764 1.5269 5.049472       2.166426  
1 1 1 11 22 5  o 4.6776 1.2349 21.487   16.403  7.2366    23.899  34.177    22.553  3.9885 1.7006 5.3667 1.7911 -1.378263      2.469868  
1 1 1 11 22 6  o 7.6288 1.1930 67.770   18.693  102.119   27.675  38.952    25.350  9.5781 1.4447 5.6795 1.8989 3.898598       2.386022  
1 1 1 11 22 7  o 12.253 0.8494 162.966  20.558  144.475   30.187  178.960   28.075  11.516 1.3106 12.989 1.0807 -1.472511      1.698716  
1 1 1 11 22 8  o 6.7140 1.3313 56.605   18.702  50.735    27.268  61.818    25.700  6.3354 1.9558 7.0926 1.8067 -0.7572298     2.662597  
1 1 1 11 22 9  o 8.6689 1.1889 92.209   20.364  145.756   29.611  44.155    28.051  11.475 1.2903 5.8631 1.9974 5.611704       2.377869  
1 1 1 11 22 10 o 3.9902 1.2105 7.0295   17.373  15.142    25.732  0.2349    23.550  4.3406 1.8021 3.6397 1.6168 0.7008591      2.421082  
1 1 1 11 22 11 o 4.4494 1.2780 14.893   18.518  32.893    27.317  -0.4133   25.190  5.1961 1.9466 3.7027 1.6565 1.493385       2.556060  
1 1 1 11 22 12 o 7.7932 1.3541 79.728   20.957  84.451    30.198  75.339    29.107  8.0330 1.9079 7.5535 1.9220 0.4795723      2.708196  
1 1 1 11 22 13 o 11.165 0.9857 145.971  21.773  127.874   31.298  162.941   30.309  10.351 1.5119 11.979 1.2651 -1.628236      1.971365  
1 1 1 11 22 14 o 10.267 1.1111 135.849  21.548  110.591   31.473  158.135   29.564  8.9595 1.8185 11.574 1.2771 -2.614942      2.222146  
1 1 1 11 22 15 o 3.6027 1.1246 -1.1331  17.563  -28.9682  25.680  23.328    24.073  2.8523 1.3902 4.3531 1.7681 -1.500818      2.249236  
1 1 1 11 22 16 o 2.8834 0.9875 -21.7489 17.529  -21.8101  25.433  -21.6935  24.194  2.9192 1.4137 2.8476 1.3790 0.7162404E-01  1.974925  
1 1 1 11 22 17 o 3.3982 1.1152 1.5903   18.208  -3.7442   27.535  5.7355    24.273  3.3330 1.5742 3.4635 1.5801 -0.1304476     2.230445  
1 1 1 11 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 0  o 11.603 1.4266 157.547  28.800  202.410   42.264  118.657   39.351  13.529 1.6239 9.6768 2.3459 -0.000000      0.000000  
1 1 1 11 23 1  o 9.3907 1.0705 99.002   19.608  88.280    26.796  111.363   28.770  8.7504 1.5897 10.031 1.4340 -1.280641      2.140926  
1 1 1 11 23 2  o 4.8582 1.3111 24.112   17.675  25.257    26.033  23.133    24.074  4.9425 1.8891 4.7738 1.8186 0.1687779      2.622213  
1 1 1 11 23 3  o 7.8597 1.2454 74.837   19.200  60.813    27.695  87.815    26.642  7.0037 1.9199 8.7157 1.5869 -1.712045      2.490822  
1 1 1 11 23 4  o 13.202 0.8252 188.288  21.679  168.210   30.669  208.339   30.649  12.442 1.2325 13.963 1.0975 -1.520456      1.650311  
1 1 1 11 23 5  o 7.5073 1.2152 69.510   19.052  40.202    27.043  98.390    26.845  5.6728 1.9602 9.3418 1.4368 -3.668978      2.430365  
1 1 1 11 23 6  o 3.6059 1.1416 -6.1809  17.915  -26.8744  26.816  10.499    24.076  3.1285 1.4988 4.0834 1.7224 -0.9548955     2.283230  
1 1 1 11 23 7  o 9.6349 1.0859 107.576  20.394  121.261   29.787  95.502    27.979  10.323 1.4427 8.9466 1.6235 1.376586       2.171890  
1 1 1 11 23 8  o 6.6678 1.1919 56.849   19.348  14.830    29.010  90.513    25.966  4.4467 1.8840 8.8889 1.4606 -4.442218      2.383854  
1 1 1 11 23 9  o 3.5299 1.1506 -10.5126 18.694  1.0917    28.507  -19.2678  24.761  3.9291 1.7597 3.1307 1.4829 0.7984881      2.301211  
1 1 1 11 23 10 f 16.667 0.7711 303.268  25.692  301.008   36.772  305.424   35.911  16.582 1.1088 16.751 1.0719 -0.1686058     1.542197  
1 1 1 11 23 11 o 5.1053 1.1220 21.447   18.667  -39.7241  28.365  68.184    24.793  2.9230 1.4325 7.2875 1.7274 -4.364479      2.244084  
1 1 1 11 23 12 o 3.6251 1.1615 -2.3097  18.632  16.538    27.258  -18.8387  25.526  4.1821 1.8004 3.0682 1.4679 1.113962       2.322981  
1 1 1 11 23 13 o 4.4636 1.2999 21.745   19.286  40.904    28.836  6.2379    25.942  5.1876 1.9869 3.7396 1.6765 1.448013       2.599725  
1 1 1 11 23 14 o 5.8416 1.3286 52.153   19.824  25.138    28.177  78.630    27.896  4.4031 1.8607 7.2800 1.8969 -2.876905      2.657102  
1 1 1 11 23 15 o 5.0984 1.3293 40.069   19.387  64.886    28.265  18.020    26.641  6.1993 2.0016 3.9974 1.7496 2.201926       2.658516  
1 1 1 11 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 23 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 0  o 5.1883 1.7394 41.194   25.039  7.4931    34.574  78.364    36.310  3.3454 2.1704 7.0311 2.7188 -0.000000      0.000000  
1 1 1 11 24 1  o 13.570 0.8060 199.910  21.870  194.714   30.619  205.322   31.248  13.386 1.1437 13.753 1.1360 -0.3671217     1.611973  
1 1 1 11 24 2  o 4.9361 1.3095 25.264   18.023  42.381    27.166  11.807    24.088  5.7456 1.9656 4.1266 1.7308 1.619036       2.618986  
1 1 1 11 24 3  o 4.3726 1.2520 10.646   18.910  -14.8094  26.995  35.172    26.497  3.4091 1.5939 5.3361 1.9311 -1.926940      2.503930  
1 1 1 11 24 4  o 5.1060 1.3314 29.286   18.956  12.773    26.797  45.824    26.818  4.2774 1.8114 5.9346 1.9519 -1.657271      2.662885  
1 1 1 11 24 5  o 6.2607 1.3654 50.962   19.201  63.671    27.559  38.974    26.767  6.9962 1.9141 5.5252 1.9476 1.470953       2.730719  
1 1 1 11 24 6  o 6.4389 1.3526 50.560   19.903  83.991    30.882  26.810    26.029  8.0225 1.9449 4.8553 1.8803 3.167235       2.705234  
1 1 1 11 24 7  o 7.5112 1.3080 75.882   20.043  55.420    30.367  91.675    26.679  6.3143 2.0770 8.7081 1.5904 -2.393785      2.616015  
1 1 1 11 24 8  o 5.6746 1.1661 37.781   19.403  -17.7450  29.910  78.131    25.497  3.4477 1.6321 7.9015 1.6659 -4.453816      2.332147  
1 1 1 11 24 9  o 12.457 0.9402 179.404  23.208  206.678   33.149  153.183   32.503  13.512 1.2266 11.403 1.4252 2.109750       1.880400  
1 1 1 11 24 10 o 3.7041 1.1862 3.4462   19.015  -2.5917   28.067  8.5685    25.851  3.5833 1.6581 3.8249 1.6967 -0.2416174     2.372348  
1 1 1 11 24 11 o 6.0315 1.3182 55.139   19.142  33.030    28.804  72.625    25.617  4.8253 1.9431 7.2376 1.7817 -2.412274      2.636314  
1 1 1 11 24 12 o 6.9805 1.4029 75.416   20.887  61.924    29.268  89.419    29.818  6.1843 2.0393 7.7767 1.9270 -1.592401      2.805715  
1 1 1 11 24 13 o 3.8511 1.2197 11.965   19.404  8.4944    27.544  15.383    27.340  3.7443 1.6985 3.9580 1.7508 -0.2136581     2.439339  
1 1 1 11 24 14 o 3.7159 1.1878 10.478   19.223  -0.8247   27.943  20.633    26.485  3.4164 1.6050 4.0154 1.7513 -0.5989509     2.375520  
1 1 1 11 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 24 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 0  o 7.8494 2.0366 99.999   30.191  85.587    42.859  114.194   42.536  6.9042 2.9995 8.7945 2.7556 -0.000000      0.000000  
1 1 1 11 25 1  f 8.5659 1.2454 92.654   21.065  63.638    29.305  123.676   30.301  6.8267 2.0106 10.305 1.4702 -3.478354      2.490809  
1 1 1 11 25 2  o 4.3562 1.2768 12.504   18.895  33.500    28.540  -3.8813   25.213  5.1594 1.9766 3.5530 1.6169 1.606408       2.553652  
1 1 1 11 25 3  o 10.328 1.0554 125.731  21.683  125.151   32.187  126.213   29.339  10.218 1.5751 10.439 1.4053 -0.2213049     2.110854  
1 1 1 11 25 4  o 11.098 0.9587 140.198  21.152  162.174   31.821  122.801   28.312  11.887 1.3384 10.309 1.3731 1.577963       1.917497  
1 1 1 11 25 5  o 7.7839 1.2845 79.297   19.625  80.770    28.187  77.911    27.341  7.8414 1.8306 7.7263 1.8024 0.1151242      2.568982  
1 1 1 11 25 6  o 4.3910 1.2881 19.765   18.746  13.079    28.496  24.867    24.891  4.1944 1.8232 4.5876 1.8201 -0.3932424     2.576155  
1 1 1 11 25 7  o 4.9145 1.3408 29.407   20.056  56.370    29.848  7.2119    27.081  5.9923 2.0600 3.8368 1.7170 2.155578       2.681676  
1 1 1 11 25 8  o 4.6153 1.3200 28.943   19.215  20.427    30.488  34.556    24.750  4.3293 1.8838 4.9014 1.8495 -0.5720673     2.639954  
1 1 1 11 25 9  o 5.3325 1.3359 38.219   20.047  69.347    29.319  10.889    27.472  6.7183 2.0190 3.9467 1.7500 2.771549       2.671846  
1 1 1 11 25 10 o 4.4623 1.3081 23.859   20.010  43.764    29.051  5.8907    27.602  5.1989 1.9936 3.7256 1.6940 1.473294       2.616117  
1 1 1 11 25 11 o 4.7435 1.3100 30.647   20.351  1.6967    28.923  59.036    28.641  3.5963 1.6707 5.8906 2.0182 -2.294287      2.620023  
1 1 1 11 25 12 o 4.4133 1.3194 30.839   20.225  25.137    29.546  35.866    27.745  4.2042 1.8413 4.6225 1.8902 -0.4182520     2.638771  
1 1 1 11 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 25 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 0  o 6.1338 1.8813 71.783   27.245  43.160    38.475  100.570   38.585  4.4320 2.5940 7.8355 2.7254 -0.000000      0.000000  
1 1 1 11 26 1  o 4.0719 1.2470 14.982   18.722  11.048    25.920  19.274    27.070  3.9030 1.7166 4.2408 1.8091 -0.3377256     2.493900  
1 1 1 11 26 2  o 3.4164 1.1321 -14.8143 20.005  12.580    29.263  -38.8503  27.411  4.0452 1.7993 2.7877 1.3744 1.257487       2.264137  
1 1 1 11 26 3  o 4.5104 1.3302 26.138   20.278  17.595    30.118  33.222    27.427  4.2182 1.8529 4.8027 1.9089 -0.5844727     2.660305  
1 1 1 11 26 4  o 3.4742 1.1394 -5.0560  18.710  6.2673    28.494  -13.6382  24.806  3.8313 1.7338 3.1171 1.4787 0.7142305      2.278718  
1 1 1 11 26 5  o 4.4969 1.3048 25.197   19.236  14.948    28.525  33.745    26.050  4.1209 1.8069 4.8728 1.8828 -0.7519007     2.609514  
1 1 1 11 26 6  o 5.7128 1.4359 52.403   20.713  49.170    30.892  55.044    27.918  5.4968 2.0680 5.9287 1.9928 -0.4319687     2.871867  
1 1 1 11 26 7  f 6.6349 1.4050 72.250   21.408  52.198    32.274  88.005    28.607  5.4958 2.1028 7.7739 1.8641 -2.278100      2.810041  
1 1 1 11 26 8  o 3.3783 1.1299 -7.5439  20.210  -10.4120  28.889  -4.7949   28.283  3.3277 1.5836 3.4289 1.6121 -0.1011934     2.259775  
1 1 1 11 26 9  o 5.3922 1.3182 46.268   21.026  8.4988    30.578  80.145    28.960  3.7768 1.7417 7.0076 1.9792 -3.230724      2.636402  
1 1 1 11 26 10 o 4.5362 1.2724 30.490   19.821  0.1677    30.037  53.879    26.381  3.5065 1.6525 5.5659 1.9353 -2.059393      2.544793  
1 1 1 11 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 26 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 0  o 5.9672 2.0070 73.082   29.465  111.487   45.429  45.197    38.711  7.5400 3.0684 4.3943 2.5877 -0.000000      0.000000  
1 1 1 11 27 1  f 3.6405 1.1625 -2.5307  19.752  -34.4530  28.887  25.502    27.069  2.9027 1.4271 4.3782 1.8355 -1.475513      2.325035  
1 1 1 11 27 2  o 4.5483 1.3291 29.775   19.625  29.119    29.647  30.287    26.183  4.5244 1.9101 4.5722 1.8486 -0.4780579E-01 2.658132  
1 1 1 11 27 3  o 4.0323 1.3126 8.8954   23.103  -1.6753   28.611  28.703    39.165  3.5248 1.6456 4.5398 2.0455 -1.014976      2.625220  
1 1 1 11 27 4  o 5.2106 1.3681 44.273   20.600  23.087    29.963  63.264    28.369  4.2600 1.8603 6.1612 2.0066 -1.901200      2.736230  
1 1 1 11 27 5  o 5.1230 1.2576 37.115   20.869  -13.2777  31.651  75.869    27.756  3.3435 1.6087 6.9025 1.9335 -3.559037      2.515209  
1 1 1 11 27 6  f 4.4476 1.2719 23.758   21.155  -18.2237  31.632  57.729    28.455  3.2182 1.5628 5.6770 2.0073 -2.458737      2.543893  
1 1 1 11 27 7  o 6.8644 1.3024 83.565   21.434  44.103    33.277  111.545   28.020  4.8224 2.0291 8.9064 1.6332 -4.083949      2.604746  
1 1 1 11 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 27 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 28 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 29 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 30 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 31 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 11 32 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 1  0  o 21.726 0.7509 477.476  32.427  463.321   46.209  491.210   45.517  21.401 1.0860 22.051 1.0373 -0.000000      0.000000  
1 1 1 12 1  1  o 7.7968 0.7075 62.206   10.786  76.364    15.156  47.676    15.354  8.7169 0.8694 6.8766 1.1164 1.840370       1.414953  
1 1 1 12 1  2  o 14.821 0.6456 230.192  16.118  203.292   32.446  239.006   18.571  14.199 1.1425 15.442 0.6013 -1.242977      1.291111  
1 1 1 12 1  3  o 11.874 0.6695 144.343  13.516  136.841   27.372  146.762   15.543  11.649 1.1749 12.099 0.6423 -0.4503736     1.338995  
1 1 1 12 1  4  o 8.5034 0.8257 75.825   11.270  70.444    23.448  77.441    12.852  8.2203 1.4807 8.7866 0.7313 -0.5662889     1.651423  
1 1 1 12 1  5  o 19.532 0.5914 367.336  20.177  415.766   40.992  351.851   23.179  20.328 1.0083 18.736 0.6186 1.592152       1.182878  
1 1 1 12 1  6  o 12.148 0.6512 147.997  15.822  0.0000    0.0000  147.997   15.822  ?      ?      12.148 0.6512 ?              ?         
1 1 1 12 1  7  o 16.335 0.6423 272.959  17.779  259.855   36.211  277.121   20.407  16.046 1.1284 16.624 0.6138 -0.5783463     1.284511  
1 1 1 12 1  8  o 12.630 0.5740 160.473  14.493  162.184   20.281  158.688   20.719  12.700 0.7985 12.560 0.8248 0.1399536      1.147959  
1 1 1 12 1  9  o 20.708 0.5273 431.132  21.838  426.464   30.825  435.836   30.941  20.595 0.7484 20.821 0.7430 -0.2258492     1.054591  
1 1 1 12 1  10 o 18.270 0.5377 335.986  19.621  357.951   27.853  314.349   27.644  18.866 0.7382 17.674 0.7821 1.192451       1.075420  
1 1 1 12 1  11 o 31.193 0.5494 981.992  34.272  989.165   48.448  974.807   48.489  31.309 0.7737 31.078 0.7801 0.2303867      1.098737  
1 1 1 12 1  12 o 15.705 0.5562 250.108  17.431  266.577   24.492  233.204   24.813  16.238 0.7542 15.173 0.8177 1.064889       1.112370  
1 1 1 12 1  13 o 4.9117 0.9640 26.664   10.257  35.017    13.700  16.009    15.473  5.6956 1.2380 4.1278 1.4780 1.567813       1.927981  
1 1 1 12 1  14 o 6.1152 0.9419 41.023   11.169  44.365    15.164  37.059    16.515  6.4251 1.2247 5.8053 1.4314 0.6198754      1.883853  
1 1 1 12 1  15 o 11.883 0.6161 145.268  14.616  143.724   20.027  147.029   21.380  11.825 0.8468 11.941 0.8952 -0.1161499     1.232280  
1 1 1 12 1  16 o 10.876 0.6561 123.424  14.183  130.461   19.414  115.369   20.771  11.237 0.8639 10.515 0.9876 0.7216759      1.312136  
1 1 1 12 1  17 o 7.1298 0.8551 55.092   11.863  58.176    16.352  51.664    17.236  7.4253 1.1011 6.8344 1.3086 0.5909319      1.710261  
1 1 1 12 1  18 o 4.1579 1.0371 18.155   10.748  16.760    15.148  19.569    15.252  4.0516 1.4611 4.2641 1.4721 -0.2125058     2.074101  
1 1 1 12 1  19 o 4.4626 1.0429 21.326   11.492  32.438    16.346  10.463    16.161  5.2613 1.4873 3.6639 1.4625 1.597374       2.085867  
1 1 1 12 1  20 o 3.4988 1.0200 7.0472   11.624  3.4734    16.651  10.445    16.235  3.3244 1.4185 3.6733 1.4659 -0.3488755     2.039901  
1 1 1 12 1  21 o 10.585 0.7505 118.085  15.844  108.755   21.499  129.174   23.439  10.130 1.0611 11.040 1.0615 -0.9098816     1.500962  
1 1 1 12 1  22 o 3.4794 1.0347 5.6180   12.152  5.5722    16.210  5.6769    18.361  3.3997 1.4225 3.5591 1.5029 -0.1593511     2.069335  
1 1 1 12 1  23 o 9.6533 0.8339 99.623   16.048  97.903    21.774  101.668   23.746  9.5853 1.1358 9.7212 1.2214 -0.1359091     1.667850  
1 1 1 12 1  24 o 8.7984 0.9695 86.348   16.366  88.466    21.532  83.449    25.186  9.0694 1.1870 8.5273 1.5332 0.5420485      1.938986  
1 1 1 12 1  25 o 4.2192 1.1798 14.330   14.525  9.7611    18.713  21.255    23.037  3.8102 1.5545 4.6281 1.7752 -0.8179262     2.359623  
1 1 1 12 1  26 o 6.5437 1.1371 56.149   16.820  78.745    21.696  22.104    26.631  8.4127 1.2895 4.6748 1.8734 3.737829       2.274258  
1 1 1 12 1  27 o 4.4356 1.2464 21.193   16.390  21.241    21.406  21.125    25.478  4.3871 1.7035 4.4840 1.8198 -0.9692287E-01 2.492720  
1 1 1 12 1  28 o 6.0850 1.0270 49.522   18.293  94.792    23.730  -16.7923  28.720  8.8998 1.3331 3.2702 1.5625 5.629676       2.053913  
1 1 1 12 1  29 o 6.5508 1.3338 64.410   17.757  56.069    21.938  80.257    30.238  6.1836 1.7143 6.9179 2.0438 -0.7343078     2.667545  
1 1 1 12 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 2  0  o 16.153 0.7728 266.159  24.602  241.832   34.949  290.052   34.636  15.395 1.1499 16.911 1.0329 -0.000000      0.000000  
1 1 1 12 2  1  o 29.895 0.5371 896.732  32.114  891.820   45.364  901.667   45.469  29.813 0.7608 29.978 0.7584 -0.1644630     1.074235  
1 1 1 12 2  2  o 19.298 0.5221 373.590  20.148  363.291   28.398  384.030   28.591  19.030 0.7461 19.567 0.7306 -0.5369263     1.044281  
1 1 1 12 2  3  o 34.971 0.5567 1227.41  38.933  1243.20   55.130  1211.69   54.991  35.196 0.7832 34.746 0.7913 0.4502068      1.113361  
1 1 1 12 2  4  o 24.256 0.5270 590.412  25.563  585.320   36.153  595.503   36.150  24.151 0.7485 24.361 0.7420 -0.2099342     1.053929  
1 1 1 12 2  5  o 26.183 0.6169 697.285  27.845  672.877   55.520  705.487   32.186  25.839 1.0744 26.528 0.6066 -0.6890125     1.233797  
1 1 1 12 2  6  o 9.9402 0.8958 102.290  17.382  84.248    25.961  116.951   23.402  9.1120 1.4246 10.768 1.0866 -1.656487      1.791688  
1 1 1 12 2  7  o 19.176 0.6367 383.317  20.751  345.231   41.456  396.050   23.970  18.482 1.1215 19.870 0.6032 -1.388060      1.273403  
1 1 1 12 2  8  o 23.354 0.6097 545.191  24.640  557.579   49.556  541.123   28.399  23.488 1.0549 23.220 0.6115 0.2677002      1.219329  
1 1 1 12 2  9  o 37.760 0.6508 1402.53  42.763  1510.61   86.333  1367.39   49.226  38.624 1.1176 36.896 0.6671 1.728497       1.301565  
1 1 1 12 2  10 o 15.310 0.6386 226.009  16.880  258.354   34.942  216.163   19.279  15.956 1.0950 14.663 0.6574 1.292402       1.277136  
1 1 1 12 2  11 o 15.679 0.7204 252.274  21.175  245.156   36.740  255.814   25.911  15.460 1.1882 15.898 0.8149 -0.4385710     1.440837  
1 1 1 12 2  12 o 8.4034 0.8372 63.642   11.971  91.234    26.403  56.502    13.431  9.3544 1.4112 7.4524 0.9011 1.902053       1.674398  
1 1 1 12 2  13 o 8.1554 0.8410 60.604   12.074  90.352    25.361  51.884    13.730  9.2180 1.3756 7.0928 0.9679 2.125232       1.681994  
1 1 1 12 2  14 o 6.6597 0.9833 40.892   11.093  66.011    23.707  33.851    12.552  7.7102 1.5902 5.6091 1.1573 2.101145       1.966680  
1 1 1 12 2  15 o 4.2328 1.1066 16.881   12.519  5.3679    22.531  22.024    15.058  3.9321 1.6628 4.5335 1.4607 -0.6014235     2.213299  
1 1 1 12 2  16 o 15.279 0.5832 239.834  17.802  228.489   24.468  252.592   25.948  14.898 0.8212 15.660 0.8285 -0.7621317     1.166488  
1 1 1 12 2  17 o 3.1444 0.9477 1.0895   10.500  -3.8451   13.854  7.7482    16.093  2.7484 1.2291 3.5404 1.4427 -0.7919490     1.895312  
1 1 1 12 2  18 o 6.3367 0.9881 46.364   12.399  54.400    16.565  36.128    18.697  7.1230 1.1628 5.5504 1.5978 1.572557       1.976162  
1 1 1 12 2  19 o 10.423 0.7459 115.432  15.369  93.890    21.062  139.971   22.479  9.3401 1.1275 11.506 0.9768 -2.166121      1.491768  
1 1 1 12 2  20 o 8.2629 0.9550 79.582   14.528  105.534   19.966  50.380    21.179  10.003 0.9980 6.5226 1.6285 3.480582       1.910002  
1 1 1 12 2  21 o 4.8988 1.1695 27.237   13.586  26.821    18.744  27.697    19.721  4.8629 1.6328 4.9347 1.6748 -0.7186508E-01 2.339009  
1 1 1 12 2  22 o 3.6366 1.0832 6.0920   13.438  7.5548    18.362  4.4051    19.719  3.6659 1.5222 3.6073 1.5416 0.5867481E-01  2.166473  
1 1 1 12 2  23 f 6.3678 1.1639 46.738   15.055  35.615    20.001  61.277    22.867  5.5017 1.6707 7.2339 1.6208 -1.732196      2.327718  
1 1 1 12 2  24 o 2.6048 0.8896 -25.4513 13.729  -24.0686  17.842  -27.4582  21.496  2.4788 1.1965 2.7309 1.3169 -0.2521100     1.779252  
1 1 1 12 2  25 o 9.7551 0.9286 104.706  18.032  101.844   24.245  108.248   26.975  9.6448 1.2569 9.8654 1.3672 -0.2206335     1.857133  
1 1 1 12 2  26 o 4.3653 1.2258 18.605   15.861  19.390    20.693  17.486    24.697  4.3440 1.6782 4.3865 1.7874 -0.4253101E-01 2.451700  
1 1 1 12 2  27 o 5.1829 1.1172 30.308   16.773  62.453    22.260  -11.9077  25.510  7.0590 1.6121 3.3069 1.5471 3.752047       2.234401  
1 1 1 12 2  28 o 4.5387 1.2206 25.954   17.148  41.801    22.349  3.2650    26.741  5.4061 1.7820 3.6712 1.6685 1.734919       2.441201  
1 1 1 12 2  29 o 3.4061 1.1073 1.1478   16.309  -7.1780   20.148  16.971    27.776  2.8882 1.3588 3.9241 1.7487 -1.035892      2.214516  
1 1 1 12 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 3  0  o 28.620 0.7580 825.509  43.241  820.049   61.671  830.789   60.646  28.524 1.0846 28.716 1.0592 -0.000000      0.000000  
1 1 1 12 3  1  o 10.109 0.6087 102.628  12.298  108.364   17.565  97.114    17.223  10.387 0.8456 9.8311 0.8759 0.5555210      1.217476  
1 1 1 12 3  2  o 16.648 0.5322 278.274  17.710  289.414   25.065  267.168   25.027  16.982 0.7380 16.314 0.7670 0.6680050      1.064390  
1 1 1 12 3  3  o 21.675 0.6449 471.419  26.197  475.234   45.983  469.585   31.876  21.719 1.0586 21.631 0.7368 0.8791924E-01  1.289799  
1 1 1 12 3  4  o 22.354 0.5244 501.599  23.443  504.754   33.136  498.437   33.170  22.424 0.7388 22.283 0.7443 0.1413841      1.048743  
1 1 1 12 3  5  o 10.014 0.6240 100.848  12.496  102.837   17.795  98.912    17.551  10.112 0.8799 9.9165 0.8849 0.1951389      1.247951  
1 1 1 12 3  6  o 29.571 0.5406 879.062  31.964  853.227   45.247  904.797   45.159  29.135 0.7765 30.007 0.7525 -0.8722534     1.081286  
1 1 1 12 3  7  o 3.7879 0.9094 12.567   8.7876  3.7685    12.849  20.298    12.045  3.1504 1.2871 4.4253 1.2850 -1.274845      1.818714  
1 1 1 12 3  8  o 23.459 0.6216 557.488  24.978  548.820   50.513  560.294   28.737  23.291 1.0844 23.627 0.6081 -0.3362751     1.243291  
1 1 1 12 3  9  o 31.804 0.6249 990.457  34.649  1081.99   69.978  960.726   39.881  32.684 1.0705 30.923 0.6448 1.760611       1.249730  
1 1 1 12 3  10 o 17.173 0.6143 283.803  18.630  330.625   37.398  268.348   21.486  18.023 1.0375 16.323 0.6582 1.700325       1.228630  
1 1 1 12 3  11 f 23.307 0.6172 536.619  25.042  581.455   50.548  522.036   28.828  23.854 1.0595 22.759 0.6333 1.094511       1.234386  
1 1 1 12 3  12 o 8.9350 0.9829 90.769   13.253  76.402    28.926  94.586    14.911  8.2275 1.8073 9.6426 0.7732 -1.415139      1.965727  
1 1 1 12 3  13 o 15.857 0.6885 263.165  18.590  249.396   37.382  267.689   21.428  15.458 1.2091 16.256 0.6591 -0.7976913     1.377068  
1 1 1 12 3  14 o 10.180 0.8205 107.804  14.142  111.398   29.190  106.702   16.166  10.154 1.4373 10.206 0.7920 -0.5161667E-01 1.641091  
1 1 1 12 3  15 o 4.7096 1.1356 21.900   10.834  26.481    25.072  20.848    12.014  5.0571 1.8707 4.3622 1.2881 0.6948581      2.271288  
1 1 1 12 3  16 o 17.057 0.6773 304.072  19.836  299.747   39.729  305.508   22.894  16.802 1.1823 17.312 0.6612 -0.5104656     1.354621  
1 1 1 12 3  17 o 7.2404 1.0218 82.573   13.447  14.983    28.554  101.835   15.243  4.5472 1.8940 9.9336 0.7673 -5.386441      2.043535  
1 1 1 12 3  18 o 11.653 0.7729 134.871  15.198  164.378   32.719  126.752   17.163  12.231 1.3376 11.076 0.7747 1.154408       1.545740  
1 1 1 12 3  19 o 7.0343 1.1492 63.778   13.499  46.667    31.072  67.760    14.987  6.0402 2.1003 8.0283 0.9334 -1.988127      2.298370  
1 1 1 12 3  20 o 10.742 0.9029 128.773  15.802  118.043   33.012  131.962   17.997  10.184 1.6208 11.301 0.7963 -1.116658      1.805826  
1 1 1 12 3  21 o 3.9288 1.1442 10.658   11.693  11.277    28.642  10.535    12.809  4.3832 1.8651 3.4745 1.3258 0.9086633      2.288368  
1 1 1 12 3  22 o 4.4111 1.2426 13.357   12.735  27.932    31.980  10.611    13.883  5.2521 2.0696 3.5701 1.3758 1.682012       2.485162  
1 1 1 12 3  23 o 6.3536 1.2392 28.654   14.237  94.857    34.115  14.692    15.667  8.7630 1.9917 3.9442 1.4749 4.818729       2.478332  
1 1 1 12 3  24 o 5.8411 1.1989 45.248   14.495  18.066    34.590  51.039    15.965  4.8916 2.0640 6.7906 1.2204 -1.899042      2.397788  
1 1 1 12 3  25 o 6.1788 1.3334 42.607   14.776  59.761    36.031  39.138    16.200  6.5642 2.2629 5.7934 1.4112 0.7708278      2.666866  
1 1 1 12 3  26 o 9.1800 1.2574 93.789   17.879  123.988   41.993  87.103    19.759  9.4125 2.2594 8.9476 1.1041 0.4648962      2.514731  
1 1 1 12 3  27 o 3.9206 1.1699 13.589   12.852  7.1989    34.064  14.650    13.878  4.1490 1.8847 3.6921 1.3866 0.4568574      2.339852  
1 1 1 12 3  28 o 4.6381 1.4123 26.856   22.117  47.967    39.716  17.365    26.629  5.1895 2.2019 4.0867 1.7694 1.102792       2.824694  
1 1 1 12 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 3  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 4  0  o 24.217 0.7464 592.137  35.987  585.120   51.242  598.967   50.552  24.071 1.0692 24.362 1.0418 -0.000000      0.000000  
1 1 1 12 4  1  o 29.518 0.5359 874.657  31.634  899.182   45.007  850.713   44.472  29.928 0.7519 29.108 0.7639 0.8195915      1.071890  
1 1 1 12 4  2  o 14.120 0.5555 200.347  15.679  206.165   22.078  194.427   22.271  14.328 0.7704 13.912 0.8004 0.4162121      1.110953  
1 1 1 12 4  3  o 12.912 0.6610 163.538  16.397  153.386   20.247  182.884   27.949  12.354 0.8194 13.470 1.0375 -1.115517      1.322078  
1 1 1 12 4  4  o 41.549 0.5862 1735.94  48.714  1726.23   68.813  1745.70   68.971  41.432 0.8304 41.666 0.8277 -0.2337990     1.172447  
1 1 1 12 4  5  o 19.729 0.5281 391.310  20.824  407.290   29.467  375.366   29.432  20.134 0.7318 19.325 0.7615 0.8089352      1.056124  
1 1 1 12 4  6  o 28.761 0.5392 832.068  31.009  816.596   44.059  847.255   43.651  28.494 0.7731 29.029 0.7519 -0.5344944     1.078424  
1 1 1 12 4  7  o 11.123 0.6099 124.765  13.551  121.970   19.526  127.363   18.822  11.001 0.8875 11.246 0.8368 -0.2454348     1.219776  
1 1 1 12 4  8  f 19.502 0.5423 382.798  21.149  383.803   30.073  381.815   29.750  19.527 0.7700 19.477 0.7637 0.4959106E-01  1.084518  
1 1 1 12 4  9  o 13.914 0.5942 196.304  16.465  216.632   23.257  175.877   23.314  14.646 0.7940 13.181 0.8843 1.464929       1.188457  
1 1 1 12 4  10 o 13.826 0.5957 193.770  16.473  194.136   23.312  193.405   23.282  13.839 0.8422 13.813 0.8428 0.2618027E-01  1.191485  
1 1 1 12 4  11 o 8.1679 0.9265 63.762   12.280  83.637    27.241  58.693    13.758  8.7516 1.6159 7.5842 0.9070 1.167366       1.853010  
1 1 1 12 4  12 o 13.737 0.7120 190.960  16.603  203.081   34.506  187.308   18.940  13.898 1.2414 13.576 0.6975 0.3214493      1.423984  
1 1 1 12 4  13 o 16.311 0.7245 293.596  19.412  241.301   39.344  310.422   22.317  15.119 1.3011 17.502 0.6375 -2.383080      1.448934  
1 1 1 12 4  14 f 9.2964 0.9219 91.698   13.581  94.711    29.240  90.869    15.336  9.1753 1.6543 9.4175 0.8142 -0.2422047     1.843802  
1 1 1 12 4  15 o 9.7351 0.8467 98.722   13.702  104.343   29.116  97.123    15.529  9.7499 1.4931 9.7202 0.7988 0.2974796E-01  1.693376  
1 1 1 12 4  16 f 17.221 0.7206 325.281  20.545  285.186   41.814  338.041   23.588  16.242 1.2872 18.200 0.6480 -1.957640      1.441111  
1 1 1 12 4  17 o 6.3944 1.0803 55.164   12.608  27.315    28.108  62.179    14.107  5.0773 1.9574 7.7115 0.9147 -2.634195      2.160577  
1 1 1 12 4  18 f 4.6224 1.1259 23.748   11.071  18.698    26.677  24.798    12.169  4.5735 1.8599 4.6712 1.2694 -0.9770870E-01 2.251799  
1 1 1 12 4  19 o 3.8163 1.1333 6.6109   10.936  18.640    28.197  4.4810    11.865  4.6506 1.9041 2.9819 1.2296 1.668707       2.266604  
1 1 1 12 4  20 o 9.8203 0.9020 90.744   14.539  132.136   33.658  81.250    16.120  10.820 1.5553 8.8202 0.9138 2.000109       1.803912  
1 1 1 12 4  21 o 6.8578 1.1039 70.588   14.059  19.805    32.736  82.073    15.568  4.8544 2.0255 8.8611 0.8784 -4.006714      2.207763  
1 1 1 12 4  22 o 14.052 0.8094 192.602  18.746  244.081   42.053  179.836   20.941  14.900 1.4112 13.205 0.7930 1.695185       1.618710  
1 1 1 12 4  23 o 4.8154 1.2662 16.801   12.501  44.486    32.070  11.840    13.575  6.0022 2.1300 3.6285 1.3696 2.373638       2.532378  
1 1 1 12 4  24 o 14.392 0.8579 213.488  19.900  239.671   44.621  206.987   22.234  14.622 1.5258 14.162 0.7850 0.4600544      1.715886  
1 1 1 12 4  25 o 5.9133 1.1608 48.918   14.134  11.524    37.729  55.022    15.244  4.6740 2.0627 7.1527 1.0656 -2.478652      2.321699  
1 1 1 12 4  26 o 10.130 1.1964 124.942  17.194  125.266   41.272  124.873   18.914  9.4033 2.2286 10.858 0.8710 -1.454278      2.392747  
1 1 1 12 4  27 o 5.1922 1.4657 34.775   21.431  72.376    39.525  19.118    25.506  6.2092 2.3385 4.1753 1.7676 2.033984       2.931427  
1 1 1 12 4  28 o 3.8356 1.2678 -8.4557  20.777  42.722    40.124  -27.2068  24.287  4.9255 2.1517 2.7458 1.3413 2.179760       2.535565  
1 1 1 12 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 4  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 5  0  f 5.4880 1.4198 40.600   14.398  38.717    20.323  42.497    20.400  5.3100 2.0291 5.6659 1.9866 -0.000000      0.000000  
1 1 1 12 5  1  o 26.866 0.5291 725.237  28.430  732.500   40.080  717.883   40.333  27.003 0.7421 26.730 0.7545 0.2728157      1.058292  
1 1 1 12 5  2  f 35.458 0.5554 1263.96  39.386  1240.35   55.574  1287.78   55.828  35.124 0.7911 35.792 0.7799 -0.6679459     1.110897  
1 1 1 12 5  3  o 5.9892 0.8542 37.140   10.047  52.073    14.675  23.962    13.785  7.1826 1.0216 4.7958 1.3694 2.386815       1.708444  
1 1 1 12 5  4  f 10.340 0.6239 107.568  12.891  114.195   18.589  101.429   17.893  10.648 0.8729 10.033 0.8917 0.6143599      1.247812  
1 1 1 12 5  5  o 31.901 0.5458 1023.48  34.821  1046.37   49.536  1001.13   48.957  32.254 0.7679 31.547 0.7759 0.7068214      1.091670  
1 1 1 12 5  6  f 7.9093 0.7558 63.582   11.892  57.058    17.009  69.820    16.632  7.5049 1.1332 8.3137 1.0003 -0.8088279     1.511523  
1 1 1 12 5  7  o 9.4892 0.6748 91.043   12.791  89.531    18.454  92.442    17.746  9.4106 0.9805 9.5678 0.9274 -0.1572256     1.349604  
1 1 1 12 5  8  o 3.0839 0.9064 2.6189   9.2253  1.6945    13.123  3.5222    12.971  3.0368 1.2758 3.1310 1.2878 -0.9418321E-01 1.812745  
1 1 1 12 5  9  o 26.012 0.5435 684.292  28.274  683.231   40.226  685.329   39.749  25.990 0.7739 26.034 0.7634 -0.4385757E-01 1.087054  
1 1 1 12 5  10 o 9.3435 1.0493 97.931   16.417  103.861   19.305  82.435    31.207  10.086 0.9570 8.6009 1.8677 1.485197       2.098584  
1 1 1 12 5  11 o 4.5911 1.0134 20.526   11.134  35.145    16.422  8.0872    15.148  5.6300 1.4497 3.5522 1.4165 2.077799       2.026854  
1 1 1 12 5  12 o 15.434 0.5956 243.134  18.365  258.511   26.161  228.193   25.787  15.923 0.8215 14.945 0.8627 0.9775734      1.191247  
1 1 1 12 5  13 o 9.7054 0.7220 98.380   13.908  111.273   19.611  85.333    19.727  10.375 0.9452 9.0360 1.0916 1.338613       1.443903  
1 1 1 12 5  14 f 6.8387 1.1141 46.409   12.552  67.985    28.412  41.176    13.991  7.5358 1.8888 6.1416 1.1819 1.394162       2.228107  
1 1 1 12 5  15 o 11.429 0.8734 145.791  15.667  128.137   34.084  150.520   17.640  10.731 1.5881 12.126 0.7274 -1.394834      1.746731  
1 1 1 12 5  16 o 8.9754 0.9996 94.415   13.841  81.963    29.303  97.992    15.704  8.2224 1.8291 9.7283 0.8071 -1.505842      1.999258  
1 1 1 12 5  17 o 12.871 0.8228 182.858  17.054  168.249   36.318  186.991   19.316  12.256 1.4816 13.487 0.7161 -1.230410      1.645608  
1 1 1 12 5  18 o 5.7714 1.1378 39.564   11.776  36.345    27.960  40.258    12.984  5.4919 1.9843 6.0509 1.1140 -0.5589643     2.275617  
1 1 1 12 5  19 o 8.4337 1.0760 78.746   13.529  84.046    32.009  77.593    14.928  8.2283 1.9710 8.6391 0.8640 -0.4107933     2.152027  
1 1 1 12 5  20 o 7.4511 1.1523 78.144   13.661  41.192    33.183  85.685    14.991  5.8145 2.1519 9.0877 0.8248 -3.273226      2.304561  
1 1 1 12 5  21 o 11.549 0.9062 149.306  16.464  136.874   35.963  152.603   18.519  10.932 1.6449 12.165 0.7611 -1.233598      1.812442  
1 1 1 12 5  22 o 4.5430 1.2399 17.838   12.104  23.551    33.323  16.969    12.992  5.0825 2.0741 4.0034 1.3593 1.079005       2.479879  
1 1 1 12 5  23 f 4.8440 1.2138 23.820   11.617  26.889    31.619  23.340    12.491  5.1370 2.0471 4.5510 1.3048 0.5860147      2.427635  
1 1 1 12 5  24 o 3.7199 1.1267 8.3079   10.694  -3.6156   33.606  9.6515    11.281  4.1358 1.8761 3.3040 1.2482 0.8318219      2.253400  
1 1 1 12 5  25 o 8.8884 1.2850 103.529  16.256  88.725    41.431  106.223   17.674  7.7344 2.4146 10.042 0.8800 -2.308007      2.569986  
1 1 1 12 5  26 o 6.8634 1.3629 53.811   14.485  83.189    41.845  49.811    15.440  7.1369 2.4395 6.5900 1.2163 0.5469670      2.725866  
1 1 1 12 5  27 o 4.1610 1.2960 14.802   21.416  -7.7131   39.449  24.210    25.501  3.9023 1.8551 4.4198 1.8103 -0.5174360     2.592050  
1 1 1 12 5  28 o 4.1053 1.3151 6.6635   21.427  54.428    39.055  -13.9038  25.628  5.1589 2.1859 3.0516 1.4628 2.107318       2.630219  
1 1 1 12 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 6  0  o 20.799 0.7478 438.788  30.880  418.885   44.032  458.052   43.319  20.322 1.0905 21.276 1.0235 -0.000000      0.000000  
1 1 1 12 6  1  f 9.9797 0.6317 100.367  12.607  102.714   17.872  98.043    17.786  10.097 0.8851 9.8629 0.9017 0.2336636      1.263474  
1 1 1 12 6  2  o 21.413 0.6466 459.655  25.967  454.777   31.565  469.867   45.669  21.268 0.7421 21.558 1.0592 -0.2900810     1.293289  
1 1 1 12 6  3  o 5.6557 0.8963 33.455   10.334  47.227    14.717  20.063    14.513  6.8330 1.0769 4.4784 1.4331 2.354564       1.792606  
1 1 1 12 6  4  o 16.923 0.5439 288.079  18.395  303.654   26.198  272.933   25.834  17.376 0.7539 16.469 0.7843 0.9062805      1.087853  
1 1 1 12 6  5  o 15.634 0.5481 246.090  17.131  250.204   24.031  241.839   24.427  15.769 0.7620 15.500 0.7880 0.2691574      1.096143  
1 1 1 12 6  6  o 20.287 0.5393 414.715  21.873  428.184   31.005  401.370   30.861  20.617 0.7519 19.957 0.7732 0.6601334      1.078524  
1 1 1 12 6  7  o 9.6910 0.6662 95.320   12.912  96.154    18.233  94.481    18.288  9.7344 0.9365 9.6476 0.9478 0.8674049E-01  1.332466  
1 1 1 12 6  8  o 10.568 0.6511 113.491  13.760  116.202   19.581  110.847   19.340  10.693 0.9156 10.442 0.9261 0.2512407      1.302247  
1 1 1 12 6  9  o 13.835 0.5953 194.484  16.440  211.278   23.519  178.439   22.988  14.426 0.8152 13.245 0.8678 1.181675       1.190637  
1 1 1 12 6  10 o 6.5158 0.9374 45.641   12.008  55.658    17.377  36.486    16.612  7.2926 1.1914 5.7390 1.4475 1.553587       1.874762  
1 1 1 12 6  11 o 5.8833 0.9918 37.886   11.485  38.559    16.858  37.303    15.689  5.9237 1.4375 5.8430 1.3669 0.8074236E-01  1.983642  
1 1 1 12 6  12 o 21.822 0.5635 487.704  24.587  504.711   35.192  471.486   34.366  22.196 0.7927 21.448 0.8012 0.7484703      1.127075  
1 1 1 12 6  13 o 4.5204 0.9644 20.146   11.251  -0.4568   16.472  38.166    15.405  3.1804 1.3843 5.8605 1.3431 -2.680089      1.928738  
1 1 1 12 6  14 o 3.5861 0.9852 9.9045   10.145  12.458    14.745  7.6089    13.980  3.7734 1.4266 3.3988 1.3590 0.3746319      1.970329  
1 1 1 12 6  15 o 14.610 0.6275 222.029  18.335  221.837   26.094  222.215   25.768  14.600 0.8936 14.620 0.8812 -0.2030945E-01 1.255044  
1 1 1 12 6  16 o 3.4183 1.0478 1.4845   9.9820  11.856    24.813  -0.5181   10.903  4.2471 1.7670 2.5894 1.1266 1.657767       2.095626  
1 1 1 12 6  17 o 6.2214 0.9325 63.261   12.720  -13.9425  29.550  80.820    14.092  3.6237 1.6852 8.8190 0.7990 -5.195286      1.865035  
1 1 1 12 6  18 o 5.3448 1.1973 23.332   11.815  58.889    28.386  15.881    12.994  6.7973 1.9723 3.8924 1.3579 2.904880       2.394569  
1 1 1 12 6  19 o 8.0048 1.0802 62.529   13.536  92.854    32.260  56.050    14.912  8.7223 1.9028 7.2872 1.0232 1.435178       2.160455  
1 1 1 12 6  20 f 13.711 0.8444 216.731  18.095  179.839   38.734  227.030   20.465  12.560 1.5420 14.861 0.6885 -2.301824      1.688763  
1 1 1 12 6  21 o 8.5735 1.2088 94.726   16.126  68.332    35.727  101.478   18.071  7.2732 2.2376 9.8738 0.9151 -2.600626      2.417535  
1 1 1 12 6  22 o 9.0561 1.1650 89.603   15.338  102.445   37.914  87.090    16.772  8.9771 2.1417 9.1352 0.9180 -0.1580772     2.330098  
1 1 1 12 6  23 o 6.5531 1.2812 37.896   12.952  80.141    35.788  31.529    13.894  7.8297 2.1963 5.2766 1.3199 2.553076       2.562386  
1 1 1 12 6  24 o 4.2578 1.2189 15.381   11.564  12.699    36.661  15.677    12.186  4.6875 2.0520 3.8281 1.3162 0.8594012      2.437860  
1 1 1 12 6  25 o 11.025 1.1029 135.188  16.695  154.588   42.851  131.717   18.127  10.836 2.0524 11.214 0.8082 -0.3785238     2.205800  
1 1 1 12 6  26 o 5.4527 1.3527 22.368   12.058  85.607    38.928  15.657    12.681  7.1664 2.3514 3.7389 1.3381 3.427474       2.705433  
1 1 1 12 6  27 o 4.8908 1.1808 28.957   9.8368  35.782    38.457  28.479    10.175  4.8372 2.1100 4.9444 1.0608 -0.1071639     2.361667  
1 1 1 12 6  28 o 4.7058 1.4077 19.214   22.980  91.680    41.100  -13.7438  27.718  6.2918 2.3811 3.1198 1.5022 3.171935       2.815373  
1 1 1 12 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 7  0  o 24.271 0.7451 595.551  35.999  616.835   51.382  575.030   50.452  24.701 1.0443 23.840 1.0629 -0.000000      0.000000  
1 1 1 12 7  1  o 10.519 0.6418 111.454  13.493  116.494   19.468  106.795   18.717  10.747 0.9057 10.290 0.9095 0.4574966      1.283546  
1 1 1 12 7  2  o 13.526 0.5787 184.240  15.645  193.687   22.305  175.092   21.950  13.869 0.8041 13.184 0.8325 0.6857901      1.157403  
1 1 1 12 7  3  o 31.922 0.5452 1025.93  34.805  1014.89   49.305  1036.89   49.137  31.749 0.7765 32.094 0.7655 -0.3453045     1.090388  
1 1 1 12 7  4  o 19.542 0.6773 381.277  24.647  372.426   29.690  400.898   44.205  19.223 0.7723 19.861 1.1129 -0.6378498     1.354585  
1 1 1 12 7  5  o 18.278 0.5466 337.054  19.974  329.494   27.803  345.116   28.712  18.067 0.7695 18.489 0.7765 -0.4217529     1.093152  
1 1 1 12 7  6  o 13.226 0.5961 177.184  15.766  172.381   22.091  182.170   22.509  13.043 0.8469 13.410 0.8393 -0.3668194     1.192273  
1 1 1 12 7  7  o 21.192 0.5438 454.570  23.029  435.507   32.640  473.467   32.497  20.744 0.7868 21.640 0.7508 -0.8967094     1.087537  
1 1 1 12 7  8  o 7.0516 0.8243 52.293   11.200  41.745    15.566  63.617    16.129  6.2286 1.2919 7.8745 1.0241 -1.645815      1.648573  
1 1 1 12 7  9  o 4.9234 0.9943 25.654   10.954  38.838    15.750  13.301    15.246  5.9459 1.3547 3.9010 1.4557 2.044952       1.988501  
1 1 1 12 7  10 o 4.6075 1.0346 21.406   11.031  30.865    16.296  13.406    14.987  5.3052 1.4799 3.9098 1.4464 1.395419       2.069297  
1 1 1 12 7  11 o 4.0951 0.9848 15.950   10.401  4.9594    15.069  25.951    14.374  3.3431 1.3828 4.8471 1.4027 -1.503962      1.969677  
1 1 1 12 7  12 o 10.166 0.7097 107.025  14.383  119.594   20.944  95.806    19.788  10.740 0.9750 9.5923 1.0314 1.147568       1.419359  
1 1 1 12 7  13 o 9.5037 0.7412 94.766   14.070  90.997    20.121  98.373    19.681  9.3046 1.0813 9.7027 1.0142 -0.3981028     1.482476  
1 1 1 12 7  14 o 9.4341 0.7685 94.730   14.354  81.687    20.583  107.075   20.026  8.7542 1.1756 10.114 0.9900 -1.359854      1.536956  
1 1 1 12 7  15 o 3.6584 0.9729 10.265   10.645  -3.1734   16.090  20.727    14.197  2.9841 1.3303 4.3328 1.4199 -1.348722      1.945707  
1 1 1 12 7  16 o 11.680 0.6990 145.005  16.171  123.968   22.997  165.580   22.744  10.785 1.0661 12.574 0.9044 -1.788560      1.398055  
1 1 1 12 7  17 o 3.9877 0.8752 12.417   10.421  -15.4748  15.771  34.031    13.883  2.5001 1.1840 5.4753 1.2892 -2.975168      1.750380  
1 1 1 12 7  18 o 17.197 0.7853 338.569  21.043  273.618   45.107  356.636   23.790  15.708 1.4358 18.686 0.6366 -2.977697      1.570574  
1 1 1 12 7  19 o 9.9627 1.0363 109.894  15.113  114.453   35.574  108.890   16.694  9.6770 1.9059 10.248 0.8145 -0.5715303     2.072625  
1 1 1 12 7  20 o 8.1053 1.1035 64.210   13.438  95.470    33.808  58.345    14.644  8.7657 1.9757 7.4449 0.9835 1.320768       2.206983  
1 1 1 12 7  21 o 15.711 0.8584 280.865  20.548  239.705   45.895  291.184   22.980  14.563 1.5757 16.860 0.6815 -2.297045      1.716786  
1 1 1 12 7  22 o 9.2305 1.1644 95.628   15.093  103.322   38.275  94.212    16.423  8.9468 2.1629 9.5142 0.8631 -0.5674000     2.328733  
1 1 1 12 7  23 o 7.1058 1.1342 78.282   14.252  17.723    36.684  89.047    15.467  4.9517 2.1090 9.2599 0.8351 -4.308216      2.268358  
1 1 1 12 7  24 o 5.3011 1.3185 15.424   12.146  76.438    37.268  8.1726    12.848  7.3208 2.2909 3.2814 1.3058 4.039451       2.636920  
1 1 1 12 7  25 o 7.6177 1.2795 58.585   14.329  104.285   39.735  51.753    15.363  8.3805 2.3006 6.8548 1.1206 1.525757       2.559042  
1 1 1 12 7  26 o 8.9990 1.2008 78.622   14.911  162.191   43.131  67.278    15.891  10.248 2.1719 7.7500 1.0252 2.497887       2.401675  
1 1 1 12 7  27 o 8.6706 1.3008 118.339  15.727  98.563    43.793  121.267   16.851  6.7569 2.4769 10.584 0.7960 -3.827509      2.601691  
1 1 1 12 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 7  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 8  0  f 2.0010 0.9820 -16.8150 13.565  -10.4348  20.068  -22.1831  18.407  2.2096 1.5012 1.7924 1.2665 -0.000000      0.000000  
1 1 1 12 8  1  o 9.3523 0.7053 88.941   13.163  95.618    18.609  82.257    18.620  9.7095 0.9583 8.9951 1.0350 0.7143517      1.410531  
1 1 1 12 8  2  o 7.1700 0.8436 53.154   11.733  44.429    16.076  63.099    17.164  6.4722 1.2873 7.8677 1.0908 -1.395485      1.687274  
1 1 1 12 8  3  o 25.093 0.5347 635.976  26.830  635.665   37.677  636.297   38.216  25.089 0.7509 25.098 0.7613 -0.9037018E-02 1.069322  
1 1 1 12 8  4  o 22.838 0.6598 523.906  28.457  549.225   49.618  511.496   34.737  23.186 1.0700 22.490 0.7723 0.6960163      1.319603  
1 1 1 12 8  5  o 7.4800 0.8720 59.485   12.334  41.092    17.252  78.717    17.641  6.1733 1.4260 8.7867 1.0039 -2.613404      1.743928  
1 1 1 12 8  6  o 12.199 0.6363 151.549  15.509  144.701   21.998  158.316   21.867  11.919 0.9228 12.478 0.8762 -0.5592995     1.272518  
1 1 1 12 8  7  o 9.0864 0.7296 85.322   13.041  66.732    18.062  105.567   18.848  8.0237 1.1256 10.149 0.9286 -2.125470      1.459148  
1 1 1 12 8  8  o 6.3814 0.9335 44.662   11.518  39.560    16.489  49.522    16.094  5.9864 1.4019 6.7763 1.2330 -0.7899461     1.866960  
1 1 1 12 8  9  o 3.8102 0.9508 9.9238   10.285  -4.5554   14.452  24.783    14.640  2.8279 1.2607 4.7924 1.4236 -1.964510      1.901585  
1 1 1 12 8  10 o 7.8572 0.7805 64.681   12.245  64.063    17.763  65.242    16.905  7.8106 1.1371 7.9039 1.0694 -0.9336519E-01 1.560945  
1 1 1 12 8  11 o 4.0260 0.9323 13.656   10.344  -4.7433   15.130  29.805    14.175  2.8674 1.2833 5.1845 1.3528 -2.317026      1.864597  
1 1 1 12 8  12 o 7.8889 0.8890 68.495   13.392  56.957    19.687  78.433    18.270  7.1317 1.4300 8.6462 1.0566 -1.514482      1.777972  
1 1 1 12 8  13 o 4.5706 1.0303 21.762   11.151  32.997    16.252  11.768    15.329  5.3886 1.4681 3.7526 1.4458 1.636001       2.060524  
1 1 1 12 8  14 o 7.2704 0.9446 58.720   13.345  70.564    19.328  47.930    18.448  8.0905 1.1945 6.4502 1.4636 1.640215       1.889159  
1 1 1 12 8  15 o 7.6945 0.9014 64.392   13.420  78.730    20.014  52.679    18.089  8.5635 1.1686 6.8256 1.3727 1.737827       1.802701  
1 1 1 12 8  16 o 10.874 0.7070 125.188  15.366  126.996   22.205  123.527   21.287  10.940 1.0149 10.808 0.9848 0.1322565      1.414099  
1 1 1 12 8  17 o 6.7571 0.9968 51.360   13.329  68.470    19.523  36.421    18.242  7.9477 1.2282 5.5665 1.5704 2.381224       1.993621  
1 1 1 12 8  18 o 3.4012 0.9925 6.0099   10.826  8.8151    16.718  3.9838    14.208  3.6321 1.4741 3.1704 1.3295 0.4616716      1.985080  
1 1 1 12 8  19 o 4.2857 1.0626 19.562   11.810  9.6267    18.160  26.843    15.546  3.7461 1.5303 4.8253 1.4746 -1.079189      2.125143  
1 1 1 12 8  20 o 17.089 0.7660 321.740  20.835  285.411   44.766  331.785   23.540  16.151 1.3858 18.028 0.6529 -1.876390      1.531917  
1 1 1 12 8  21 o 6.7559 1.1261 68.298   13.892  14.838    35.780  77.787    15.074  4.8604 2.0768 8.6514 0.8712 -3.791013      2.252143  
1 1 1 12 8  22 o 9.0488 1.2355 112.392  15.650  72.510    38.699  120.189   17.111  7.3173 2.3400 10.780 0.7936 -3.463090      2.470922  
1 1 1 12 8  23 o 19.596 0.7972 424.814  24.866  396.327   53.867  432.529   28.031  18.701 1.4402 20.492 0.6840 -1.790670      1.594369  
1 1 1 12 8  24 o 8.2462 1.2722 90.451   15.037  75.656    40.277  92.848    16.209  7.1018 2.3935 9.3906 0.8631 -2.288747      2.544351  
1 1 1 12 8  25 o 7.1615 1.2599 71.635   14.363  59.298    40.276  73.433    15.374  6.0646 2.3417 8.2583 0.9308 -2.193707      2.519883  
1 1 1 12 8  26 o 6.8477 1.2454 71.234   14.627  56.268    41.819  73.321    15.614  5.5441 2.2992 8.1513 0.9577 -2.607272      2.490737  
1 1 1 12 8  27 o 7.1559 1.2412 86.035   15.050  70.155    44.007  88.139    16.015  5.4366 2.3126 8.8753 0.9022 -3.438634      2.482402  
1 1 1 12 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 9  0  o 13.616 0.8780 192.937  23.394  180.397   33.205  205.297   32.965  13.144 1.2917 14.087 1.1896 -0.000000      0.000000  
1 1 1 12 9  1  o 17.183 0.5566 298.632  19.118  311.523   27.355  286.323   26.731  17.547 0.7795 16.818 0.7947 0.7285194      1.113165  
1 1 1 12 9  2  o 6.2416 0.9732 41.838   11.831  37.908    16.530  45.965    16.940  5.9278 1.4141 6.5553 1.3374 -0.6275711     1.946320  
1 1 1 12 9  3  o 13.197 0.6111 176.716  16.116  167.281   22.509  186.641   23.086  12.832 0.8770 13.561 0.8512 -0.7284021     1.222186  
1 1 1 12 9  4  o 10.585 0.6701 114.488  14.156  105.309   19.865  123.960   20.179  10.146 0.9789 11.024 0.9152 -0.8774490     1.340111  
1 1 1 12 9  5  o 15.231 0.5805 236.313  17.621  210.675   24.507  263.752   25.353  14.365 0.8530 16.097 0.7875 -1.732421      1.160959  
1 1 1 12 9  6  o 8.8262 0.9265 79.120   15.379  92.210    27.568  73.205    18.531  9.2658 1.4876 8.3865 1.1048 0.8793001      1.852976  
1 1 1 12 9  7  o 13.870 0.6101 196.559  16.908  208.891   24.303  184.990   23.539  14.296 0.8500 13.444 0.8754 0.8515024      1.220197  
1 1 1 12 9  8  o 5.0227 1.0616 27.530   11.497  29.158    16.309  25.922    16.210  5.1529 1.4949 4.8924 1.5076 0.2605333      2.123100  
1 1 1 12 9  9  o 5.4320 1.0404 32.937   11.842  41.993    16.857  24.115    16.638  6.1426 1.4029 4.7215 1.5367 1.421178       2.080749  
1 1 1 12 9  10 o 13.082 0.6143 176.270  16.070  181.593   22.887  171.092   22.570  13.280 0.8617 12.884 0.8759 0.3958540      1.228670  
1 1 1 12 9  11 o 10.114 0.7347 108.293  14.660  91.001    21.104  124.418   20.380  9.2796 1.1371 10.948 0.9307 -1.668385      1.469447  
1 1 1 12 9  12 o 3.0628 0.9389 -1.7744  10.743  6.4972    16.284  -8.1491   14.295  3.5017 1.4419 2.6239 1.2029 0.8778195      1.877762  
1 1 1 12 9  13 o 14.601 0.6190 222.179  18.054  234.108   25.541  210.265   25.525  15.009 0.8508 14.193 0.8992 0.8160992      1.237927  
1 1 1 12 9  14 o 4.8408 1.1135 26.397   12.340  29.575    18.230  23.710    16.764  5.0646 1.6046 4.6170 1.5442 0.4476004      2.226968  
1 1 1 12 9  15 o 7.9000 0.8739 68.304   13.764  66.942    20.130  69.500    18.862  7.7952 1.2912 8.0048 1.1781 -0.2096415     1.747882  
1 1 1 12 9  16 o 5.5339 1.0962 36.329   12.665  32.778    18.659  39.363    17.246  5.2637 1.6167 5.8042 1.4809 -0.5404658     2.192417  
1 1 1 12 9  17 o 9.8626 0.7819 103.454  15.369  104.637   22.744  102.460   20.850  9.8901 1.1498 9.8350 1.0600 0.5514717E-01  1.563871  
1 1 1 12 9  18 o 6.4118 1.0396 48.691   13.020  40.711    19.959  54.604    17.179  5.8368 1.6412 6.9869 1.2764 -1.150085      2.079107  
1 1 1 12 9  19 o 10.626 0.8753 115.226  17.441  141.803   31.721  103.711   20.880  11.349 1.3975 9.9034 1.0542 1.445679       1.750534  
1 1 1 12 9  20 o 6.3429 1.0595 46.952   13.058  43.338    20.770  49.314    16.791  6.0475 1.6647 6.6384 1.3112 -0.5908837     2.119057  
1 1 1 12 9  21 o 9.9977 0.8169 108.441  16.046  99.428    24.368  115.341   21.322  9.5518 1.2756 10.444 1.0208 -0.8918848     1.633719  
1 1 1 12 9  22 o 21.264 0.7651 476.897  28.154  490.859   56.131  472.204   32.544  21.141 1.3276 21.388 0.7608 -0.2471352     1.530119  
1 1 1 12 9  23 o 9.5494 1.1935 101.641  16.095  121.518   41.014  98.023    17.499  9.4624 2.2076 9.6364 0.9079 -0.1740084     2.387037  
1 1 1 12 9  24 o 8.4079 1.2305 115.528  15.782  49.656    41.441  126.702   17.068  5.8207 2.3354 10.995 0.7762 -5.174418      2.460991  
1 1 1 12 9  25 o 5.7082 1.1622 49.752   14.039  22.948    39.552  53.615    15.016  4.5465 2.0514 6.8698 1.0929 -2.323300      2.324347  
1 1 1 12 9  26 o 8.3185 1.3375 98.829   15.896  110.185   44.596  97.176    17.014  7.2568 2.5166 9.3802 0.9069 -2.123361      2.675025  
1 1 1 12 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 9  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 10 0  o 3.2054 1.3808 10.931   16.646  11.093    23.232  10.760    23.864  3.2000 1.9449 3.2108 1.9606 -0.000000      0.000000  
1 1 1 12 10 1  o 11.621 0.6617 138.532  15.368  139.193   22.185  137.921   21.308  11.642 0.9527 11.600 0.9185 0.4256821E-01  1.323367  
1 1 1 12 10 2  o 6.4967 0.9981 46.397   12.630  38.975    17.687  54.117    18.040  5.9280 1.4927 7.0655 1.3253 -1.137539      1.996160  
1 1 1 12 10 3  o 14.846 0.5855 225.550  17.372  229.410   24.251  221.481   24.896  14.984 0.8092 14.708 0.8463 0.2758846      1.170955  
1 1 1 12 10 4  o 2.7541 0.8754 -5.4342  10.048  -4.2463   13.543  -6.8888   14.986  2.7334 1.2193 2.7747 1.2563 -0.4135728E-01 1.750750  
1 1 1 12 10 5  o 9.1021 0.7353 85.168   13.357  78.462    18.286  92.838    19.556  8.7170 1.0489 9.4872 1.0306 -0.7701845     1.470503  
1 1 1 12 10 6  o 14.244 0.6089 208.053  17.219  178.299   24.175  238.690   24.532  13.186 0.9167 15.301 0.8016 -2.115315      1.217758  
1 1 1 12 10 7  o 10.180 0.7183 107.556  14.487  128.084   21.049  89.080    19.969  11.128 0.9458 9.2327 1.0814 1.894804       1.436652  
1 1 1 12 10 8  o 6.5131 1.1419 32.041   14.756  93.968    29.952  12.194    16.957  9.1096 1.7067 3.9167 1.5174 5.192980       2.283736  
1 1 1 12 10 9  o 13.748 0.6297 195.436  17.277  178.961   24.149  212.713   24.729  13.140 0.9190 14.356 0.8613 -1.216381      1.259473  
1 1 1 12 10 10 f 6.3224 0.9582 44.862   12.114  60.767    17.071  28.727    17.193  7.5894 1.1247 5.0553 1.5518 2.534076       1.916489  
1 1 1 12 10 11 o 5.1756 1.0526 29.807   11.926  41.302    17.229  19.230    16.526  6.0324 1.4467 4.3188 1.5295 1.713581       2.105250  
1 1 1 12 10 12 o 8.4984 0.8080 77.255   13.699  78.553    20.165  76.144    18.667  8.5460 1.1798 8.4507 1.1045 0.9528828E-01  1.616099  
1 1 1 12 10 13 o 5.2198 1.0059 31.832   11.690  15.616    17.372  45.252    15.804  4.0781 1.5469 6.3614 1.2864 -2.283317      2.011897  
1 1 1 12 10 14 o 4.7351 1.0410 25.154   11.937  10.496    17.339  38.359    16.457  3.7334 1.5061 5.7367 1.4373 -2.003359      2.081920  
1 1 1 12 10 15 o 2.8381 0.9151 -6.8748  11.483  -9.8739   17.255  -4.4911   15.384  2.8247 1.3046 2.8514 1.2836 -0.2664351E-01 1.830201  
1 1 1 12 10 16 f 7.4953 0.9640 62.097   14.094  71.718    20.670  53.738    19.267  8.1302 1.2712 6.8604 1.4496 1.269897       1.928056  
1 1 1 12 10 17 o 9.1643 0.8004 90.876   14.463  76.679    20.858  104.024   20.073  8.4062 1.2406 9.9224 1.0115 -1.516199      1.600706  
1 1 1 12 10 18 f 3.9323 1.0552 12.596   12.379  -1.2726   18.669  23.479    16.538  3.2824 1.4497 4.5823 1.5338 -1.299891      2.110421  
1 1 1 12 10 19 o 13.549 0.6943 194.230  18.618  178.032   27.586  207.782   25.232  12.971 1.0634 14.127 0.8930 -1.156939      1.388634  
1 1 1 12 10 20 o 9.7416 0.7945 100.717  15.308  104.699   23.615  97.832    20.103  9.8658 1.1968 9.6175 1.0451 0.2483835      1.588912  
1 1 1 12 10 21 o 13.921 0.6897 202.015  18.953  212.342   29.531  194.782   24.714  14.175 1.0417 13.667 0.9041 0.5078278      1.379325  
1 1 1 12 10 22 o 9.8790 0.8065 104.368  15.790  117.103   24.412  95.208    20.705  10.364 1.1777 9.3937 1.1020 0.9706278      1.612906  
1 1 1 12 10 23 o 4.5527 0.8601 25.874   10.774  -14.8146  20.797  40.798    12.595  2.9441 1.3836 6.1612 1.0221 -3.217147      1.720195  
1 1 1 12 10 24 f 4.7597 1.2850 23.576   12.496  36.794    37.646  21.939    13.247  5.2240 2.1752 4.2954 1.3686 0.9286418      2.569963  
1 1 1 12 10 25 o 8.1175 1.2729 106.573  16.561  70.422    42.733  112.962   17.965  6.0398 2.3884 10.195 0.8811 -4.155420      2.545728  
1 1 1 12 10 26 o 5.6869 1.4111 37.650   14.010  99.111    41.833  29.885    14.869  6.6815 2.4252 4.6923 1.4435 1.989275       2.822283  
1 1 1 12 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 10 32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 11 0  f 4.2588 1.5482 27.632   16.998  35.919    25.408  20.919    22.870  4.7799 2.2982 3.7377 2.0750 -0.000000      0.000000  
1 1 1 12 11 1  o 5.5045 1.0761 33.373   12.250  32.323    17.294  34.430    17.353  5.4213 1.5289 5.5878 1.5148 -0.1665220     2.152228  
1 1 1 12 11 2  o 9.7582 0.7321 98.827   14.165  111.399   19.821  85.703    20.251  10.420 0.9511 9.0967 1.1131 1.322997       1.464101  
1 1 1 12 11 3  o 8.0873 0.8177 67.854   13.116  56.830    18.025  80.261    19.122  7.3726 1.2224 8.8020 1.0862 -1.429429      1.635300  
1 1 1 12 11 4  o 3.8574 1.0350 12.482   10.998  13.104    15.210  11.802    15.920  3.8792 1.4527 3.8356 1.4746 0.4361606E-01  2.069989  
1 1 1 12 11 5  o 9.1807 0.7410 87.561   13.542  99.888    19.752  76.628    18.602  9.8024 1.0075 8.5590 1.0867 1.243382       1.481914  
1 1 1 12 11 6  o 5.0043 0.9953 25.541   11.686  45.538    16.997  7.6176    16.092  6.4258 1.3647 3.5829 1.4490 2.842858       1.990500  
1 1 1 12 11 7  f 10.010 0.7237 104.270  14.463  113.070   20.931  96.228    20.009  10.421 1.0043 9.5985 1.0423 0.8220224      1.447413  
1 1 1 12 11 8  f 7.6157 0.8942 62.118   13.617  62.894    19.518  61.381    19.008  7.6582 1.2743 7.5732 1.2549 0.8493137E-01  1.788493  
1 1 1 12 11 9  f 12.524 0.6562 162.995  16.362  159.900   24.166  165.614   22.233  12.390 0.9752 12.657 0.8783 -0.2673073     1.312404  
1 1 1 12 11 10 o 5.9377 1.0724 40.582   12.780  41.811    18.278  39.406    17.877  6.0256 1.5175 5.8497 1.5157 0.1758132      2.144823  
1 1 1 12 11 11 o 10.727 0.7203 122.013  15.396  112.938   22.078  130.602   21.480  10.307 1.0710 11.147 0.9635 -0.8399897     1.440591  
1 1 1 12 11 12 o 6.5845 1.0500 49.690   13.523  57.724    19.730  42.572    18.571  7.1216 1.4348 6.0474 1.5333 1.074280       2.099906  
1 1 1 12 11 13 f 9.0584 0.8055 88.796   14.543  84.883    21.103  92.335    20.070  8.8348 1.1943 9.2821 1.0811 -0.4473495     1.610973  
1 1 1 12 11 14 o 8.2934 0.8261 74.384   13.695  73.703    19.634  75.030    19.111  8.2443 1.1908 8.3425 1.1454 -0.9815025E-01 1.652260  
1 1 1 12 11 15 o 3.8175 1.0442 11.613   11.413  18.166    17.203  6.4609    15.254  4.2382 1.5526 3.3968 1.3967 0.8414168      2.088391  
1 1 1 12 11 16 o 8.9192 0.8329 85.810   14.779  81.961    21.682  89.151    20.199  8.6940 1.2470 9.1443 1.1045 -0.4503069     1.665757  
1 1 1 12 11 17 f 5.1143 1.1140 28.307   13.304  46.293    20.062  14.187    17.776  6.2425 1.5996 3.9861 1.5510 2.256453       2.228094  
1 1 1 12 11 18 o 13.932 0.6904 203.274  19.228  199.840   27.464  206.575   26.929  13.805 0.9947 14.060 0.9577 -0.2545538     1.380783  
1 1 1 12 11 19 o 4.3877 1.1349 19.683   12.845  18.813    20.396  20.255    16.536  4.4084 1.6752 4.3671 1.5314 0.4131460E-01  2.269711  
1 1 1 12 11 20 o 16.245 0.6503 277.163  21.021  266.421   30.935  286.379   28.651  15.909 0.9723 16.581 0.8640 -0.6726561     1.300681  
1 1 1 12 11 21 o 11.260 0.7788 136.035  17.375  137.005   26.414  135.296   23.069  11.242 1.1748 11.278 1.0227 -0.3595829E-01 1.557582  
1 1 1 12 11 22 o 5.5893 1.1139 39.850   13.385  26.335    22.761  46.996    16.549  4.7942 1.7807 6.3845 1.3388 -1.590323      2.227830  
1 1 1 12 11 23 o 6.6640 1.1345 53.346   14.381  63.015    24.581  48.314    17.732  6.9821 1.7606 6.3459 1.4313 0.6362224      2.268998  
1 1 1 12 11 24 o 5.9141 1.0106 51.298   14.353  12.509    24.195  72.360    17.829  3.8747 1.6821 7.9536 1.1208 -4.078939      2.021284  
1 1 1 12 11 25 o 3.0055 0.9204 3.4677   10.725  -22.4532  22.357  11.216    12.224  2.7172 1.3182 3.2938 1.2850 -0.5766468     1.840828  
1 1 1 12 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 12 0  o 6.8494 1.6619 65.217   20.636  58.534    29.233  71.855    29.134  6.3178 2.4386 7.3810 2.2584 -0.000000      0.000000  
1 1 1 12 12 1  o 9.3535 0.8178 92.726   15.139  104.553   21.050  80.054    21.788  10.016 1.0508 8.6907 1.2535 1.325709       1.635686  
1 1 1 12 12 2  o 4.8906 1.1010 25.997   12.665  34.605    17.115  15.580    18.828  5.5547 1.5038 4.2266 1.6087 1.328062       2.202098  
1 1 1 12 12 3  o 11.066 0.6983 126.638  15.441  121.545   21.300  132.279   22.415  10.833 0.9831 11.298 0.9920 -0.4647055     1.396601  
1 1 1 12 12 4  o 3.2874 0.9268 -0.7740  10.815  -20.2290  15.438  17.971    15.154  2.3628 1.1334 4.2120 1.4666 -1.849180      1.853532  
1 1 1 12 12 5  o 8.4361 0.8268 75.614   13.891  82.326    19.504  68.706    19.788  8.8433 1.1028 8.0289 1.2323 0.8143759      1.653675  
1 1 1 12 12 6  o 5.0194 1.1159 28.314   12.501  26.888    17.923  29.664    17.445  4.9163 1.5946 5.1224 1.5614 -0.2060947     2.231771  
1 1 1 12 12 7  o 6.2316 1.0621 44.168   13.104  40.565    18.566  47.746    18.498  5.9570 1.5452 6.5063 1.4577 -0.5493083     2.124276  
1 1 1 12 12 8  o 9.5241 0.8011 95.914   15.211  106.608   21.952  86.038    21.095  10.053 1.0918 8.9953 1.1726 1.057570       1.602190  
1 1 1 12 12 9  o 9.9967 0.7662 106.160  15.296  104.844   22.146  107.361   21.152  9.9196 1.1163 10.074 1.0499 -0.1541491     1.532428  
1 1 1 12 12 10 o 3.4363 1.0034 5.0109   11.737  -5.5626   17.675  13.350    15.697  3.0313 1.3692 3.8413 1.4672 -0.8100142     2.006852  
1 1 1 12 12 11 o 8.3986 0.8863 76.711   14.321  95.314    21.151  60.961    19.461  9.4459 1.1196 7.3513 1.3742 2.094592       1.772523  
1 1 1 12 12 12 o 6.5414 1.0093 48.306   13.725  78.364    20.432  23.590    18.527  8.4860 1.2039 4.5968 1.6203 3.889212       2.018585  
1 1 1 12 12 13 o 9.6214 0.8021 100.020  15.224  119.487   21.768  81.381    21.300  10.604 1.0264 8.6390 1.2328 1.964703       1.604154  
1 1 1 12 12 14 o 8.8763 0.8453 84.513   14.986  89.698    21.863  79.918    20.581  9.1315 1.1971 8.6211 1.1936 0.5104179      1.690522  
1 1 1 12 12 15 o 4.8812 1.1658 26.652   13.532  31.548    19.960  22.487    18.409  5.2027 1.6823 4.5598 1.6143 0.6429300      2.331531  
1 1 1 12 12 16 o 2.8779 0.9055 -12.5094 11.797  -34.3373  16.761  8.9138    16.605  2.1462 1.0612 3.6096 1.4676 -1.463396      1.811093  
1 1 1 12 12 17 o 8.8109 0.8486 82.687   14.870  95.491    21.773  71.495    20.356  9.4710 1.1495 8.1507 1.2488 1.320355       1.697248  
1 1 1 12 12 18 o 10.057 0.8027 107.615  16.106  118.502   23.359  97.748    22.237  10.557 1.1063 9.5580 1.1633 0.9988594      1.605364  
1 1 1 12 12 19 o 4.3864 1.1614 17.908   13.971  28.097    20.998  9.8151    18.714  4.9685 1.7266 3.8043 1.5536 1.164196       2.322734  
1 1 1 12 12 20 o 10.099 1.0690 120.127  18.780  102.472   33.204  128.431   22.773  9.1829 1.8714 11.016 1.0336 -1.832977      2.137924  
1 1 1 12 12 21 o 8.3460 0.9349 78.333   14.980  78.841    23.315  77.977    19.549  8.2298 1.4705 8.4623 1.1551 -0.2325516     1.869874  
1 1 1 12 12 22 o 4.6066 1.1422 20.567   13.120  40.693    22.081  9.5837    16.311  5.6463 1.7628 3.5669 1.4529 2.079417       2.284351  
1 1 1 12 12 23 o 8.7782 0.9501 88.386   16.438  106.061   26.102  76.770    21.161  9.4485 1.3813 8.1079 1.3049 1.340598       1.900198  
1 1 1 12 12 24 o 6.1124 1.1480 55.159   15.172  34.739    25.735  66.039    18.784  4.8713 1.8744 7.3535 1.3260 -2.482131      2.295973  
1 1 1 12 12 25 o 3.0733 0.9910 1.4554   11.671  6.0210    23.819  0.0132    13.388  3.4688 1.5758 2.6777 1.2021 0.7911150      1.982015  
1 1 1 12 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 12 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 13 0  o 2.1724 1.0639 -17.0225 16.064  -9.5117   21.679  -26.1685  23.923  2.2958 1.5599 2.0491 1.4471 -0.000000      0.000000  
1 1 1 12 13 1  o 9.6071 0.7635 97.089   14.661  96.471    20.352  97.756    21.137  9.5832 1.0619 9.6311 1.0973 -0.4789543E-01 1.526990  
1 1 1 12 13 2  o 15.383 0.6173 245.455  18.885  274.591   26.719  216.371   26.696  16.328 0.8182 14.437 0.9246 1.891969       1.234627  
1 1 1 12 13 3  o 11.092 0.6891 128.181  15.283  126.411   21.737  129.911   21.492  11.010 0.9871 11.173 0.9618 -0.1630135     1.378204  
1 1 1 12 13 4  o 3.4744 1.0004 3.8673   11.677  15.656    16.483  -8.0112   16.545  4.0837 1.5156 2.8651 1.3061 1.218623       2.000742  
1 1 1 12 13 5  o 12.728 0.6762 168.893  17.126  189.032   24.340  149.147   24.101  13.509 0.9009 11.947 1.0087 1.561845       1.352433  
1 1 1 12 13 6  o 5.4002 1.0712 33.026   12.498  44.725    17.846  21.762    17.510  6.2759 1.4508 4.5245 1.5765 1.751427       2.142447  
1 1 1 12 13 7  o 3.4068 1.0087 3.2405   11.792  12.155    17.450  -4.2505   15.997  3.8753 1.5282 2.9384 1.3169 0.9368789      2.017376  
1 1 1 12 13 8  o 5.2336 1.0974 32.023   12.591  24.245    18.288  39.031    17.361  4.6706 1.6120 5.7966 1.4895 -1.126010      2.194814  
1 1 1 12 13 9  o 4.4402 1.0523 19.181   11.869  34.113    17.516  6.5061    16.138  5.4164 1.5426 3.4640 1.4318 1.952404       2.104640  
1 1 1 12 13 10 o 5.3696 1.1332 34.015   13.052  36.627    19.416  31.860    17.630  5.5359 1.6384 5.2034 1.5660 0.3324747      2.266424  
1 1 1 12 13 11 o 9.1079 0.8268 90.478   14.861  76.430    21.341  103.701   20.705  8.3485 1.2782 9.8673 1.0492 -1.518817      1.653619  
1 1 1 12 13 12 o 5.2231 1.1307 31.306   13.347  43.218    19.512  20.830    18.298  6.0269 1.5942 4.4193 1.6039 1.607603       2.261436  
1 1 1 12 13 13 o 12.156 0.7119 155.726  17.188  179.360   24.688  133.496   23.943  13.090 0.9430 11.223 1.0667 1.866827       1.423769  
1 1 1 12 13 14 o 6.5720 1.0768 50.486   14.003  40.078    19.866  60.763    19.741  5.8173 1.6380 7.3267 1.3982 -1.509441      2.153555  
1 1 1 12 13 15 o 4.8123 1.0361 21.173   13.790  -8.1590   19.599  49.937    19.408  3.0912 1.4140 6.5333 1.5148 -3.442137      2.072155  
1 1 1 12 13 16 f 7.1983 1.0600 59.128   14.744  59.077    21.482  59.174    20.274  7.1695 1.5438 7.2270 1.4530 -0.5747128E-01 2.120034  
1 1 1 12 13 17 o 13.806 0.6821 199.450  18.811  208.605   27.459  191.355   25.823  14.098 0.9739 13.515 0.9554 0.5834494      1.364240  
1 1 1 12 13 18 f 6.6289 1.1339 52.101   14.929  45.523    21.698  58.015    20.573  6.1629 1.7035 7.0950 1.4969 -0.9320335     2.267705  
1 1 1 12 13 19 o 6.0763 1.1042 44.193   13.790  32.382    20.835  53.401    18.397  5.2758 1.7197 6.8768 1.3855 -1.601023      2.208382  
1 1 1 12 13 20 o 8.6351 0.9292 82.735   16.013  86.822    23.603  79.250    21.796  8.8155 1.3387 8.4547 1.2890 0.3607950      1.858416  
1 1 1 12 13 21 o 4.2143 1.1334 15.130   13.160  30.554    21.759  6.2338    16.525  5.0162 1.7568 3.4125 1.4325 1.603689       2.266860  
1 1 1 12 13 22 f 12.978 0.7719 189.640  19.415  147.363   28.364  226.910   26.632  11.407 1.2433 14.550 0.9152 -3.143364      1.543831  
1 1 1 12 13 23 o 5.8883 1.1902 48.500   14.775  42.602    24.440  51.896    18.548  5.3923 1.8634 6.3843 1.4813 -0.9919958     2.380442  
1 1 1 12 13 24 o 5.2815 1.1409 42.425   14.444  24.476    24.502  51.983    17.881  4.2607 1.7629 6.3023 1.4489 -2.041637      2.281889  
1 1 1 12 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 14 0  o 12.499 1.0055 168.059  24.183  188.990   35.551  150.035   32.991  13.273 1.3728 11.725 1.4695 -0.000000      0.000000  
1 1 1 12 14 1  o 5.5579 1.1496 35.506   13.584  32.744    18.653  38.626    19.822  5.3450 1.6113 5.7707 1.6401 -0.4256449     2.299190  
1 1 1 12 14 2  o 13.846 0.6614 199.842  18.284  204.099   25.306  195.193   26.446  14.020 0.9025 13.673 0.9671 0.3466816      1.322819  
1 1 1 12 14 3  o 7.6214 0.9685 65.242   14.160  71.473    18.926  57.318    21.341  8.1894 1.1555 7.0534 1.5547 1.135939       1.937081  
1 1 1 12 14 4  o 6.6027 0.9880 49.621   14.172  14.455    19.630  87.910    20.483  4.1240 1.6226 9.0814 1.1278 -4.957362      1.976014  
1 1 1 12 14 5  o 2.5724 0.8639 -17.7145 12.060  -14.7031  16.533  -21.1385  17.629  2.6099 1.2287 2.5349 1.2146 0.7504177E-01  1.727752  
1 1 1 12 14 6  o 3.3603 1.0252 1.6024   12.606  6.1666    18.320  -2.5017   17.372  3.5942 1.5086 3.1264 1.3887 0.4678488      2.050413  
1 1 1 12 14 7  o 16.573 0.6204 285.827  20.558  295.512   29.316  276.456   28.837  16.855 0.8696 16.292 0.8850 0.5637207      1.240771  
1 1 1 12 14 8  o 9.4581 0.8117 96.200   15.100  118.693   21.871  75.715    20.872  10.578 1.0338 8.3381 1.2516 2.239969       1.623340  
1 1 1 12 14 9  o 3.9489 1.0433 10.913   12.659  -7.6439   18.248  28.128    17.576  2.9874 1.3657 4.9104 1.5777 -1.922932      2.086677  
1 1 1 12 14 10 o 3.2535 1.0069 -3.5391  13.067  -16.0627  18.210  9.7554    18.762  2.7193 1.2831 3.7878 1.5523 -1.068435      2.013898  
1 1 1 12 14 11 o 15.202 0.6363 241.544  19.339  238.233   27.584  244.746   27.121  15.089 0.9140 15.315 0.8855 -0.2257547     1.272598  
1 1 1 12 14 12 f 3.6403 1.0267 5.2619   12.595  -12.4487  18.456  20.703    17.233  2.8679 1.3331 4.4128 1.5619 -1.544881      2.053443  
1 1 1 12 14 13 o 10.888 0.7705 126.036  16.554  153.936   24.105  101.132   22.774  12.081 0.9977 9.6952 1.1745 2.385464       1.541007  
1 1 1 12 14 14 o 9.6038 0.8638 100.115  16.279  125.506   23.708  77.465    22.392  10.831 1.0944 8.3763 1.3366 2.455075       1.727514  
1 1 1 12 14 15 o 9.6260 0.8856 101.192  16.691  80.838    23.990  120.289   23.237  8.5901 1.3964 10.662 1.0897 -2.071829      1.771259  
1 1 1 12 14 16 o 5.5106 1.1961 35.900   14.599  30.222    21.311  40.921    20.041  5.1324 1.7410 5.8889 1.6406 -0.7565093     2.392184  
1 1 1 12 14 17 o 9.2472 0.9037 93.702   16.492  109.148   23.222  77.983    23.425  10.093 1.1504 8.4011 1.3942 1.692045       1.807477  
1 1 1 12 14 18 f 8.0126 0.9970 71.926   15.521  68.181    22.827  75.146    21.165  7.6996 1.5362 8.3256 1.2711 -0.6260552     1.993907  
1 1 1 12 14 19 o 5.1738 1.2380 31.754   15.148  36.656    23.014  28.007    20.120  5.4554 1.8088 4.8922 1.6907 0.5631742      2.475968  
1 1 1 12 14 20 o 6.4634 1.1671 50.349   15.224  64.036    23.031  39.727    20.289  7.2594 1.6266 5.6673 1.6741 1.592084       2.334166  
1 1 1 12 14 21 o 5.8008 1.1538 40.708   14.708  62.889    22.351  23.769    19.533  7.1065 1.6099 4.4951 1.6532 2.611477       2.307584  
1 1 1 12 14 22 o 3.0744 0.9644 1.0638   12.132  -13.1278  20.911  8.2642    14.895  2.8717 1.3609 3.2772 1.3667 -0.4055021     1.928771  
1 1 1 12 14 23 o 5.5418 1.1420 45.903   14.894  25.169    24.298  58.384    18.851  4.3419 1.7714 6.7418 1.4418 -2.399855      2.283988  
1 1 1 12 14 24 o 5.0394 1.2227 38.436   14.506  47.252    23.713  33.164    18.338  5.3497 1.8362 4.7291 1.6149 0.6205564      2.445349  
1 1 1 12 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 14 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 15 0  o 3.6065 1.4585 16.028   18.924  -6.8089   28.540  33.944    25.279  2.7259 1.8339 4.4872 2.2684 -0.000000      0.000000  
1 1 1 12 15 1  o 4.9770 1.0892 25.793   14.018  2.3791    20.089  48.010    19.569  3.5452 1.5359 6.4088 1.5448 -2.863522      2.178406  
1 1 1 12 15 2  o 14.600 0.6714 224.301  19.528  245.160   27.531  203.176   27.705  15.321 0.8984 13.879 0.9981 1.442305       1.342890  
1 1 1 12 15 3  o 3.2026 0.9978 -6.3107  13.147  -20.6876  18.209  9.3452    19.002  2.6022 1.2435 3.8030 1.5608 -1.200772      1.995578  
1 1 1 12 15 4  o 4.0235 1.1091 12.923   13.150  20.996    19.022  5.5336    18.199  4.4840 1.6342 3.5630 1.4999 0.9210577      2.218178  
1 1 1 12 15 5  o 4.8464 1.1552 25.618   14.095  37.867    19.602  12.504    20.283  5.6554 1.6384 4.0373 1.6289 1.618062       2.310332  
1 1 1 12 15 6  o 2.9714 0.9592 -7.4606  12.695  -9.8403   18.264  -5.2358   17.659  2.9156 1.3450 3.0273 1.3678 -0.1116424     1.918369  
1 1 1 12 15 7  o 6.0226 1.1581 43.604   14.333  40.974    20.109  46.321    20.434  5.8319 1.6500 6.2133 1.6257 -0.3814006     2.316292  
1 1 1 12 15 8  o 4.1027 1.1203 15.354   13.092  19.595    19.006  11.525    18.061  4.3622 1.6258 3.8432 1.5418 0.5189874      2.240626  
1 1 1 12 15 9  o 5.1257 1.1483 30.380   14.157  15.566    20.701  43.399    19.405  4.2016 1.6621 6.0499 1.5848 -1.848328      2.296546  
1 1 1 12 15 10 o 8.5365 0.9525 81.793   15.547  67.808    22.627  94.298    21.397  7.6784 1.5272 9.3946 1.1388 -1.716133      1.905015  
1 1 1 12 15 11 o 7.6546 1.0383 66.121   15.521  78.180    22.436  55.052    21.495  8.4541 1.3269 6.8552 1.5974 1.598846       2.076627  
1 1 1 12 15 12 o 3.9550 1.1324 11.662   13.883  13.874    20.486  9.7828    18.880  4.1056 1.6439 3.8044 1.5579 0.3011737      2.264788  
1 1 1 12 15 13 o 14.519 0.6833 221.357  19.816  234.519   28.910  209.693   27.214  14.924 0.9686 14.115 0.9640 0.8086271      1.366547  
1 1 1 12 15 14 o 12.691 0.7386 169.942  18.590  197.026   26.608  144.114   25.984  13.725 0.9693 11.656 1.1146 2.068884       1.477127  
1 1 1 12 15 15 o 3.6679 1.0738 3.0357   13.906  -12.9418  19.779  18.651    19.554  2.9728 1.3813 4.3629 1.6445 -1.390013      2.147626  
1 1 1 12 15 16 f 5.2980 1.2135 32.875   15.016  24.574    21.823  40.339    20.694  4.7764 1.7489 5.8197 1.6827 -1.043379      2.426924  
1 1 1 12 15 17 o 4.5372 1.1909 19.036   14.772  31.584    22.168  9.0147    19.811  5.2290 1.7756 3.8453 1.5876 1.383710       2.381893  
1 1 1 12 15 18 o 8.1483 1.0686 77.482   16.711  73.034    25.767  80.710    21.954  7.7511 1.7082 8.5456 1.2845 -0.7944908     2.137272  
1 1 1 12 15 19 o 5.5464 1.5401 32.346   21.494  24.444    24.365  60.077    45.645  4.7214 1.8218 6.3714 2.4837 -1.649995      3.080217  
1 1 1 12 15 20 o 4.0886 1.1419 9.3673   15.219  34.037    22.904  -10.1375  20.365  5.1583 1.8027 3.0189 1.4023 2.139458       2.283890  
1 1 1 12 15 21 o 5.3151 1.2891 35.718   15.737  59.350    28.212  25.045    18.960  6.2154 1.9990 4.4149 1.6281 1.800444       2.578140  
1 1 1 12 15 22 o 6.3872 1.1879 54.893   16.683  88.274    25.375  29.479    22.141  8.1677 1.6106 4.6068 1.7466 3.560870       2.375899  
1 1 1 12 15 23 o 7.0457 1.1800 69.413   16.271  88.284    25.512  56.473    21.126  7.8701 1.6724 6.2213 1.6650 1.648867       2.359902  
1 1 1 12 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 15 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 16 0  o 15.273 0.9922 252.554  29.655  268.656   41.992  236.534   41.886  15.812 1.3505 14.735 1.4538 -0.000000      0.000000  
1 1 1 12 16 1  f 8.1805 1.0359 76.442   16.479  65.592    23.016  87.854    23.605  7.4475 1.5934 8.9134 1.3241 -1.465930      2.071748  
1 1 1 12 16 2  o 3.9893 1.1306 12.465   13.915  18.508    19.658  6.3960    19.701  4.3071 1.6427 3.6716 1.5539 0.6354251      2.261245  
1 1 1 12 16 3  o 3.3117 1.0070 -8.5341  13.606  -31.4992  18.707  17.259    19.825  2.3841 1.1673 4.2394 1.6412 -1.855345      2.013990  
1 1 1 12 16 4  f 4.0437 1.1388 13.092   14.134  19.926    19.535  5.5858    20.473  4.3961 1.6463 3.6913 1.5740 0.7048349      2.277653  
1 1 1 12 16 5  o 2.9359 0.9430 -9.0016  12.289  1.7338    18.052  -18.2747  16.777  3.3520 1.4540 2.5198 1.2012 0.8321583      1.886040  
1 1 1 12 16 6  o 6.2315 1.1835 46.849   15.171  53.952    21.668  40.018    21.249  6.7192 1.6293 5.7437 1.7171 0.9755716      2.367077  
1 1 1 12 16 7  f 4.8656 1.1886 26.962   14.173  22.506    21.269  30.522    19.008  4.6206 1.7203 5.1106 1.6406 -0.4900365     2.377150  
1 1 1 12 16 8  o 4.1121 0.9697 2.1531   13.544  -39.8129  19.566  40.758    18.766  2.3193 1.1467 5.9049 1.5641 -3.585673      1.939472  
1 1 1 12 16 9  o 3.8276 1.0094 -5.0885  13.516  34.471    20.256  -36.8334  18.146  5.4141 1.6881 2.2412 1.1074 3.172975       2.018899  
1 1 1 12 16 10 o 5.9327 1.1980 42.141   14.916  42.233    21.545  42.056    20.671  5.9291 1.7177 5.9363 1.6706 -0.7155418E-02 2.396086  
1 1 1 12 16 11 o 9.4199 0.8958 97.548   16.729  110.570   23.579  84.349    23.740  10.119 1.1651 8.7210 1.3611 1.397719       1.791642  
1 1 1 12 16 12 o 6.2859 1.1807 46.909   15.126  50.785    21.513  43.119    21.272  6.5559 1.6438 6.0159 1.6953 0.5399208      2.361373  
1 1 1 12 16 13 o 5.6186 1.2115 37.074   15.042  30.134    21.317  43.956    21.227  5.1409 1.7412 6.0962 1.6848 -0.9553585     2.422944  
1 1 1 12 16 14 o 10.413 0.8336 116.229  17.334  108.920   24.412  123.662   24.618  10.062 1.2131 10.764 1.1436 -0.7016039     1.667112  
1 1 1 12 16 15 o 6.8764 1.0839 54.413   15.937  89.275    23.229  23.412    21.905  9.0482 1.2836 4.7046 1.7469 4.343664       2.167823  
1 1 1 12 16 16 o 4.5524 1.0873 18.154   14.656  -13.5191  22.678  40.871    19.205  3.1968 1.4832 5.9079 1.5902 -2.711122      2.174543  
1 1 1 12 16 17 o 6.2811 1.2449 49.284   16.292  45.487    24.571  52.263    21.765  6.0034 1.8571 6.5589 1.6583 -0.5554733     2.489734  
1 1 1 12 16 18 o 4.6742 1.2021 18.319   15.902  45.215    24.673  -0.7913   20.797  5.9372 1.8650 3.4113 1.5171 2.525889       2.404131  
1 1 1 12 16 19 o 3.9581 1.1621 11.114   15.202  20.130    22.882  3.9906    20.339  4.3893 1.7439 3.5269 1.5366 0.8624561      2.324297  
1 1 1 12 16 20 o 3.4042 1.0599 2.6972   14.553  -10.3462  22.483  12.103    19.092  3.0870 1.4468 3.7213 1.5493 -0.6343188     2.119804  
1 1 1 12 16 21 o 3.6512 1.2149 -1.7502  19.276  -1.3691   21.675  -3.1910   42.149  3.2662 1.4913 4.0361 1.9184 -0.7698720     2.429867  
1 1 1 12 16 22 o 5.3657 1.1711 44.075   15.302  25.093    23.382  58.293    20.237  4.2364 1.7341 6.4949 1.5743 -2.258443      2.342141  
1 1 1 12 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 0  o 3.3986 1.4653 13.479   19.176  23.861    27.689  3.9108    26.582  3.8469 2.2227 2.9504 1.9100 -0.000000      0.000000  
1 1 1 12 17 1  o 7.1278 0.9887 63.437   15.399  110.795   21.259  11.151    22.337  10.202 1.0419 4.0535 1.6807 6.148612       1.977426  
1 1 1 12 17 2  o 13.223 0.7308 186.047  19.277  188.803   26.491  182.946   28.104  13.358 0.9916 13.087 1.0737 0.2706585      1.461514  
1 1 1 12 17 3  o 5.3823 1.2319 34.582   15.123  35.219    21.890  34.000    20.917  5.4214 1.7625 5.3433 1.7216 0.7808208E-01  2.463769  
1 1 1 12 17 4  o 6.9293 1.1664 57.038   15.936  59.473    22.113  54.407    22.986  7.1224 1.5923 6.7361 1.7047 0.3863091      2.332727  
1 1 1 12 17 5  o 7.7873 1.1019 70.239   16.555  63.971    23.511  76.402    23.314  7.3816 1.6356 8.1931 1.4771 -0.8114672     2.203847  
1 1 1 12 17 6  o 4.9212 1.2386 26.802   15.339  25.483    21.290  28.225    22.119  4.8286 1.7332 5.0138 1.7701 -0.1852221     2.477288  
1 1 1 12 17 7  o 7.2228 1.1438 61.206   16.170  51.801    22.599  71.072    23.146  6.5847 1.7032 7.8608 1.5273 -1.276072      2.287672  
1 1 1 12 17 8  o 8.6987 0.9656 84.594   16.243  72.413    22.963  96.792    22.979  7.9382 1.5014 9.4592 1.2146 -1.521036      1.931165  
1 1 1 12 17 9  o 7.4838 1.0802 65.821   15.920  89.255    22.652  42.947    22.379  9.0389 1.2530 5.9287 1.7599 3.110140       2.160376  
1 1 1 12 17 10 o 7.2210 1.1074 61.582   16.573  30.286    23.156  94.450    23.730  5.1333 1.8112 9.3087 1.2746 -4.175391      2.214743  
1 1 1 12 17 11 o 6.2815 1.1844 46.426   15.530  59.186    22.074  33.921    21.853  7.1565 1.5841 5.4066 1.7611 1.749969       2.368744  
1 1 1 12 17 12 o 5.0914 1.1794 28.354   15.097  44.542    21.007  11.061    21.712  6.1276 1.6690 4.0552 1.6668 2.072382       2.358725  
1 1 1 12 17 13 o 7.6352 1.1104 68.955   16.544  50.484    24.539  84.349    22.401  6.4487 1.8221 8.8216 1.2697 -2.372920      2.220790  
1 1 1 12 17 14 o 3.4848 1.0648 -2.0876  14.660  -20.8206  21.757  13.488    19.839  2.9101 1.3818 4.0596 1.6204 -1.149527      2.129533  
1 1 1 12 17 15 o 3.4656 1.0892 -3.0739  15.140  2.8543    22.403  -8.0568   20.539  3.7370 1.6204 3.1941 1.4558 0.5429134      2.178326  
1 1 1 12 17 16 o 4.9409 1.2312 27.552   16.347  10.352    24.461  41.433    21.974  4.0957 1.7323 5.7860 1.7499 -1.690351      2.462371  
1 1 1 12 17 17 o 6.9951 1.2415 60.796   17.522  75.000    25.671  48.406    23.976  7.8275 1.6893 6.1627 1.8197 1.664769       2.482954  
1 1 1 12 17 18 o 10.066 0.9604 115.846  19.245  130.416   27.817  102.468   26.655  10.729 1.2963 9.4031 1.4173 1.326025       1.920753  
1 1 1 12 17 19 o 5.2292 1.2011 36.492   16.562  11.480    24.802  56.624    22.251  3.9355 1.7057 6.5230 1.6914 -2.587546      2.402155  
1 1 1 12 17 20 o 11.273 0.8632 145.940  19.270  176.871   29.166  121.979   25.670  12.371 1.1788 10.175 1.2615 2.196534       1.726496  
1 1 1 12 17 21 o 8.3229 1.1291 94.826   18.111  82.671    27.022  104.739   24.403  7.4553 1.8266 9.1904 1.3276 -1.735013      2.258127  
1 1 1 12 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 17 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 0  o 23.071 0.8541 556.827  39.157  555.128   54.948  558.580   55.814  23.041 1.1998 23.100 1.2158 -0.000000      0.000000  
1 1 1 12 18 1  o 5.9840 1.1961 42.873   15.121  35.859    21.984  49.171    20.832  5.5035 1.7641 6.4645 1.6157 -0.9610367     2.392178  
1 1 1 12 18 2  o 7.9158 1.0231 70.425   15.791  61.377    22.006  80.031    22.674  7.2746 1.5594 8.5569 1.3249 -1.282266      2.046199  
1 1 1 12 18 3  o 9.2824 0.9019 93.496   16.720  91.190    22.940  96.108    24.420  9.1751 1.2501 9.3897 1.3004 -0.2146378     1.803821  
1 1 1 12 18 4  o 12.531 0.7497 166.572  18.771  158.082   26.451  175.184   26.642  12.193 1.0847 12.870 1.0350 -0.6769648     1.499311  
1 1 1 12 18 5  o 6.4831 1.0642 48.526   16.612  6.7082    23.756  88.543    23.238  3.9622 1.6926 9.0040 1.2905 -5.041783      2.128424  
1 1 1 12 18 6  o 11.441 0.8489 142.810  19.086  172.351   27.120  113.823   26.865  12.716 1.0664 10.167 1.3212 2.549014       1.697900  
1 1 1 12 18 7  o 5.2385 1.2388 32.344   15.754  22.059    23.009  41.421    21.616  4.6349 1.7750 5.8421 1.7286 -1.207188      2.477594  
1 1 1 12 18 8  o 10.540 0.8680 120.047  18.251  131.919   26.292  109.008   25.354  11.068 1.1878 10.012 1.2661 1.055530       1.736039  
1 1 1 12 18 9  f 10.448 0.8907 118.355  18.426  110.528   27.397  124.821   24.900  10.068 1.3606 10.828 1.1498 -0.7603397     1.781355  
1 1 1 12 18 10 o 6.5490 1.2120 51.393   16.998  30.398    24.025  72.439    24.054  5.1804 1.8430 7.9177 1.5744 -2.737239      2.423959  
1 1 1 12 18 11 o 11.457 0.8276 140.594  18.946  138.522   27.234  142.538   26.375  11.357 1.1990 11.558 1.1410 -0.2011414     1.655165  
1 1 1 12 18 12 f 7.4085 1.1840 66.065   17.157  55.463    25.540  74.784    23.161  6.7263 1.8437 8.0907 1.4861 -1.364462      2.368048  
1 1 1 12 18 13 o 6.9134 1.2294 57.625   16.971  55.999    24.793  59.059    23.280  6.7807 1.7987 7.0461 1.6763 -0.2654295     2.458715  
1 1 1 12 18 14 o 3.3341 1.0677 -11.6466 15.868  6.6434    23.294  -27.4814  21.674  3.9253 1.6764 2.7428 1.3226 1.182519       2.135340  
1 1 1 12 18 15 o 3.9101 1.1503 0.0763   17.335  -32.4389  25.630  27.494    23.535  2.9253 1.4173 4.8948 1.8121 -1.969493      2.300550  
1 1 1 12 18 16 o 6.6406 1.3171 56.855   18.194  57.169    26.141  56.560    25.339  6.6429 1.8819 6.6382 1.8431 0.4716396E-02  2.634101  
1 1 1 12 18 17 o 3.6399 1.1465 1.6870   16.849  0.9558    24.672  2.3262    23.065  3.6617 1.6387 3.6181 1.6039 0.4360104E-01  2.293040  
1 1 1 12 18 18 o 2.6474 0.9033 -26.9856 15.052  -52.6134  23.111  -8.1037   19.837  2.3236 1.1642 2.9712 1.3814 -0.6476228     1.806591  
1 1 1 12 18 19 o 3.7840 1.1419 7.9207   15.817  26.219    23.806  -6.5409   21.163  4.4864 1.7800 3.0816 1.4308 1.404798       2.283743  
1 1 1 12 18 20 o 3.6476 1.1339 10.062   16.400  -1.7502   26.213  17.660    21.023  3.3970 1.5823 3.8983 1.6246 -0.5013220     2.267781  
1 1 1 12 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 18 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 0  o 9.6696 1.4441 114.141  24.384  131.147   35.022  98.141    33.970  10.622 1.8051 8.7174 2.2545 -0.000000      0.000000  
1 1 1 12 19 1  o 10.220 0.8767 114.102  17.846  125.423   25.272  102.843   25.203  10.772 1.1731 9.6694 1.3032 1.102153       1.753446  
1 1 1 12 19 2  o 10.542 0.8884 121.867  18.608  126.142   25.266  116.801   27.506  10.805 1.1692 10.279 1.3379 0.5255384      1.776838  
1 1 1 12 19 3  o 4.9173 1.2545 27.198   15.892  23.095    22.744  31.112    22.214  4.6843 1.7717 5.1504 1.7767 -0.4660664     2.509072  
1 1 1 12 19 4  o 4.1159 1.1892 12.367   15.540  9.0893    21.558  15.913    22.422  3.9292 1.6419 4.3026 1.7208 -0.3733883     2.378477  
1 1 1 12 19 5  o 5.1737 1.2773 30.669   16.376  35.211    22.867  25.888    23.462  5.4523 1.8028 4.8951 1.8099 0.5572104      2.554564  
1 1 1 12 19 6  o 17.751 0.6518 328.456  23.134  338.928   32.796  318.084   32.637  18.043 0.9088 17.459 0.9347 0.5834923      1.303672  
1 1 1 12 19 7  o 4.6878 1.2483 21.807   16.147  15.358    23.438  27.632    22.276  4.3706 1.7553 5.0051 1.7753 -0.6345177     2.496602  
1 1 1 12 19 8  o 12.833 0.7903 175.184  20.243  180.055   29.736  170.977   27.634  12.979 1.1455 12.687 1.0891 0.2921038      1.580578  
1 1 1 12 19 9  o 9.0620 1.0186 90.708   18.442  96.274    26.746  85.662    25.463  9.3310 1.4332 8.7931 1.4479 0.5379524      2.037274  
1 1 1 12 19 10 o 8.9006 1.0569 89.623   18.361  83.662    26.065  95.496    25.869  8.4979 1.5921 9.3032 1.3903 -0.8052893     2.113715  
1 1 1 12 19 11 o 4.7738 1.2317 22.913   16.655  4.0479    24.965  38.044    22.358  3.9254 1.7064 5.6222 1.7766 -1.696832      2.463315  
1 1 1 12 19 12 o 12.886 0.8084 177.434  20.746  176.184   30.664  178.490   28.172  12.804 1.1974 12.968 1.0862 -0.1635008     1.616707  
1 1 1 12 19 13 o 3.5544 1.1374 -5.1041  17.255  -0.3613   25.805  -8.9400   23.207  3.7781 1.6844 3.3306 1.5290 0.4474528      2.274897  
1 1 1 12 19 14 o 6.0739 1.3463 47.542   18.536  56.943    25.974  37.788    26.459  6.6652 1.8716 5.4826 1.9359 1.182546       2.692690  
1 1 1 12 19 15 o 6.2747 1.3219 52.050   19.077  31.564    28.121  69.519    25.967  5.1194 1.9618 7.4300 1.7723 -2.310590      2.643801  
1 1 1 12 19 16 o 7.3326 1.2125 71.048   18.872  40.946    27.391  98.251    26.039  5.4909 1.9664 9.1742 1.4191 -3.683382      2.425010  
1 1 1 12 19 17 o 4.7779 1.2639 30.864   17.405  14.798    26.185  43.580    23.296  4.0534 1.7547 5.5024 1.8196 -1.449076      2.527881  
1 1 1 12 19 18 o 4.4381 1.2436 23.474   16.918  38.513    25.027  10.817    22.959  5.1082 1.8725 3.7679 1.6371 1.340315       2.487241  
1 1 1 12 19 19 o 3.1267 1.0344 -5.3640  16.078  -7.5360   24.177  -3.6420   21.527  3.1447 1.4822 3.1088 1.4433 0.3594112E-01  2.068784  
1 1 1 12 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 19 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 0  o 16.063 1.0398 277.828  32.698  263.048   46.444  292.353   46.044  15.589 1.5230 16.537 1.4161 -0.000000      0.000000  
1 1 1 12 20 1  o 5.7545 1.2856 38.154   17.167  24.715    23.728  52.915    24.868  4.8753 1.8166 6.6337 1.8196 -1.758384      2.571233  
1 1 1 12 20 2  o 9.8919 0.9517 106.717  18.783  102.504   27.091  110.617   26.066  9.6700 1.4008 10.114 1.2886 -0.4438820     1.903339  
1 1 1 12 20 3  o 17.276 0.6834 312.413  23.613  309.408   33.328  315.441   33.460  17.190 0.9694 17.362 0.9636 -0.1714363     1.366858  
1 1 1 12 20 4  o 17.614 0.6866 325.398  24.114  357.979   34.481  294.213   33.734  18.509 0.9315 16.718 1.0089 1.791433       1.373150  
1 1 1 12 20 5  o 3.8153 1.1484 3.4094   15.695  15.069    23.065  -6.6441   21.417  4.3186 1.7389 3.3119 1.5005 1.006678       2.296818  
1 1 1 12 20 6  f 11.887 0.8421 151.969  19.957  140.663   28.449  162.923   28.002  11.412 1.2465 12.362 1.1326 -0.9499807     1.684160  
1 1 1 12 20 7  o 8.0834 1.1015 74.729   17.077  80.625    25.749  70.099    22.818  8.3435 1.6013 7.8234 1.5131 0.5200968      2.203049  
1 1 1 12 20 8  o 9.7450 1.0041 105.568  19.488  95.560    27.565  115.571   27.556  9.2314 1.4930 10.259 1.3431 -1.027063      2.008226  
1 1 1 12 20 9  o 3.5833 1.1245 -1.5487  16.100  1.7138    23.013  -4.6758   22.531  3.7161 1.6263 3.4505 1.5533 0.2656448      2.248965  
1 1 1 12 20 10 o 4.8906 1.2924 25.286   17.003  24.695    24.555  25.830    23.567  4.8726 1.8413 4.9085 1.8141 -0.3595686E-01 2.584870  
1 1 1 12 20 11 o 8.3319 1.1852 82.943   19.065  85.568    27.026  80.342    26.899  8.4860 1.6518 8.1777 1.7001 0.3082571      2.370407  
1 1 1 12 20 12 o 7.8494 1.1960 74.417   19.149  111.858   28.174  42.272    26.106  9.9401 1.4172 5.7588 1.9270 4.181299       2.392061  
1 1 1 12 20 13 o 6.1473 1.3916 49.846   19.533  56.123    27.148  43.110    28.126  6.5445 1.9374 5.7501 1.9983 0.7944317      2.783278  
1 1 1 12 20 14 o 3.5199 1.1321 -9.1807  18.038  9.7045    26.095  -26.4635  24.963  4.0749 1.7579 2.9648 1.4270 1.110113       2.264213  
1 1 1 12 20 15 o 4.3033 1.2450 15.452   18.566  -7.2148   28.366  32.440    24.556  3.5940 1.6644 5.0126 1.8520 -1.418572      2.489967  
1 1 1 12 20 16 o 4.2829 1.2617 18.994   18.477  36.049    27.263  4.5050    25.128  4.9376 1.9210 3.6283 1.6363 1.309349       2.523395  
1 1 1 12 20 17 o 4.4118 1.2936 25.212   18.713  23.737    27.814  26.432    25.293  4.3671 1.8472 4.4564 1.8115 -0.8930349E-01 2.587253  
1 1 1 12 20 18 o 4.2032 1.2564 22.971   18.176  32.005    27.122  15.606    24.488  4.5454 1.8649 3.8610 1.6840 0.6843593      2.512748  
1 1 1 12 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 0  o 6.5524 1.7938 64.522   26.679  105.051   39.185  29.499    36.426  8.8246 2.5584 4.2802 2.5151 -0.000000      0.000000  
1 1 1 12 21 1  o 7.0945 1.2670 60.668   17.981  61.380    25.214  59.932    25.649  7.1502 1.7721 7.0387 1.8114 0.1114578      2.534084  
1 1 1 12 21 2  o 4.7293 1.2674 22.538   16.643  16.904    24.120  27.657    22.993  4.4583 1.7842 5.0003 1.8005 -0.5419884     2.534755  
1 1 1 12 21 3  o 8.4389 1.1605 83.476   18.998  71.328    28.008  93.830    25.857  7.6570 1.8497 9.2207 1.4021 -1.563757      2.321008  
1 1 1 12 21 4  o 8.3534 1.1265 80.575   18.254  77.293    27.484  83.165    24.417  8.0377 1.7586 8.6691 1.4082 -0.6314058     2.252954  
1 1 1 12 21 5  o 9.6770 1.0574 108.238  19.352  88.756    28.823  124.226   26.112  8.6385 1.7287 10.715 1.2184 -2.077011      2.114890  
1 1 1 12 21 6  o 5.7482 1.3128 37.622   18.457  60.499    27.099  17.829    25.207  6.9760 1.8937 4.5204 1.8187 2.455570       2.625605  
1 1 1 12 21 7  o 11.140 0.9002 134.508  20.001  148.188   28.820  121.797   27.781  11.715 1.2301 10.565 1.3147 1.149677       1.800437  
1 1 1 12 21 8  o 4.9986 1.3021 27.305   17.169  30.237    24.526  24.489    24.042  5.1642 1.8595 4.8330 1.8231 0.3312879      2.604104  
1 1 1 12 21 9  o 5.1979 1.2892 31.136   17.395  44.675    24.367  17.065    24.841  5.9722 1.8497 4.4235 1.7964 1.548687       2.578450  
1 1 1 12 21 10 f 13.164 0.8384 191.184  21.786  168.755   31.977  210.612   29.761  12.327 1.2971 14.002 1.0627 -1.675207      1.676841  
1 1 1 12 21 11 o 3.4070 1.1162 -12.6518 18.302  -23.2082  26.109  -2.4542   25.661  3.1432 1.4984 3.6708 1.6547 -0.5276568     2.232308  
1 1 1 12 21 12 o 8.6299 1.2847 94.120   21.472  95.332    30.378  92.911    30.353  8.6989 1.8052 8.5608 1.8283 0.1380777      2.569359  
1 1 1 12 21 13 o 5.7693 1.3966 46.022   19.896  35.247    29.060  55.528    27.296  5.1937 1.9934 6.3449 1.9565 -1.151206      2.793132  
1 1 1 12 21 14 o 5.1679 1.3712 37.010   19.620  50.365    28.523  25.013    27.032  5.7893 2.0123 4.5466 1.8632 1.242681       2.742479  
1 1 1 12 21 15 o 6.1777 1.3744 57.660   19.039  53.800    27.945  61.005    26.010  5.9007 1.9937 6.4548 1.8923 -0.5540609     2.748726  
1 1 1 12 21 16 o 2.9005 0.9902 -26.2680 17.950  -52.0412  26.421  -4.1770   24.461  2.5106 1.2560 3.2904 1.5312 -0.7797873     1.980423  
1 1 1 12 21 17 o 5.7868 1.3346 53.882   19.621  85.408    29.095  27.588    26.572  7.2622 1.9584 4.3114 1.8136 2.950808       2.669157  
1 1 1 12 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 0  o 4.4242 1.7552 29.671   24.799  11.275    33.936  50.753    36.328  3.5030 2.2246 5.3455 2.7155 -0.000000      0.000000  
1 1 1 12 22 1  o 18.571 0.6738 362.223  24.969  337.804   35.474  386.201   35.152  17.915 0.9901 19.226 0.9142 -1.311235      1.347552  
1 1 1 12 22 2  o 3.0664 1.0137 -26.2999 16.498  0.6697    23.207  -53.8567  23.458  3.7048 1.6270 2.4280 1.2098 1.276822       2.027442  
1 1 1 12 22 3  f 3.9527 1.2063 2.4564   17.783  -8.8106   24.755  14.471    25.562  3.4944 1.5948 4.4110 1.8103 -0.9166694     2.412551  
1 1 1 12 22 4  o 11.581 0.9439 149.148  21.384  123.841   31.463  170.874   29.153  10.526 1.4945 12.637 1.1535 -2.110168      1.887887  
1 1 1 12 22 5  o 7.3188 1.3412 66.319   19.881  77.486    29.078  56.516    27.245  7.9310 1.8646 6.7065 1.9283 1.224470       2.682337  
1 1 1 12 22 6  o 5.4528 1.3526 35.019   18.026  45.590    28.504  27.973    23.270  5.9618 2.0135 4.9438 1.8066 1.018003       2.705175  
1 1 1 12 22 7  o 5.9031 1.3197 43.743   18.058  30.416    25.486  57.179    25.590  5.0884 1.8854 6.7178 1.8471 -1.629386      2.639411  
1 1 1 12 22 8  o 9.9045 1.0805 115.844  20.316  101.313   30.727  127.130   27.079  9.0925 1.7532 10.717 1.2634 -1.624027      2.161035  
1 1 1 12 22 9  o 12.460 0.9284 175.298  22.810  148.691   32.819  200.159   31.724  11.403 1.4391 13.517 1.1734 -2.114438      1.856847  
1 1 1 12 22 10 o 14.577 0.8425 234.380  24.543  240.931   35.597  228.445   33.883  14.754 1.2064 14.401 1.1765 0.3532829      1.685047  
1 1 1 12 22 11 o 6.0265 1.3872 50.414   20.033  35.182    29.414  63.592    27.359  5.2000 2.0030 6.8529 1.9196 -1.652928      2.774326  
1 1 1 12 22 12 o 4.5585 1.3007 21.703   19.433  3.4507    28.245  38.107    26.778  3.8590 1.7380 5.2581 1.9355 -1.399170      2.601301  
1 1 1 12 22 13 o 8.1089 1.2712 94.931   20.932  65.372    30.678  120.678   28.632  6.3544 2.0875 9.8634 1.4514 -3.508986      2.542477  
1 1 1 12 22 14 o 14.849 0.8342 257.015  24.627  234.111   35.289  278.760   34.385  14.066 1.2544 15.631 1.0999 -1.565303      1.668331  
1 1 1 12 22 15 o 3.0782 1.0316 -13.4220 17.591  -32.8507  26.734  1.4137    23.361  2.7868 1.3707 3.3696 1.5422 -0.5828054     2.063293  
1 1 1 12 22 16 o 3.1109 1.0494 -10.2381 18.325  -22.1938  28.855  -2.1578   23.722  3.0154 1.4706 3.2063 1.4974 -0.1909013     2.098779  
1 1 1 12 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 22 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 0  o 2.4320 1.2239 -45.4670 25.317  -75.3672  35.470  -14.4128  36.148  2.0013 1.4614 2.8627 1.9636 -0.000000      0.000000  
1 1 1 12 23 1  o 12.275 0.8978 166.730  21.989  159.232   31.617  173.754   30.602  11.958 1.3220 12.592 1.2152 -0.6332874     1.795627  
1 1 1 12 23 2  o 9.3129 1.1585 103.347  20.615  75.087    28.625  133.796   29.713  7.7008 1.8759 10.925 1.3599 -3.224256      2.316963  
1 1 1 12 23 3  o 6.5339 1.3797 55.760   19.693  64.660    27.399  46.249    28.324  7.1078 1.8934 5.9599 2.0072 1.147940       2.759304  
1 1 1 12 23 4  o 6.5790 1.5405 60.856   23.582  65.243    28.106  50.425    43.340  7.0993 1.9292 6.0586 2.4023 1.040705       3.081043  
1 1 1 12 23 5  o 4.1318 1.2586 8.7654   18.736  13.537    28.290  5.0375    25.007  4.3699 1.8564 3.8937 1.6999 0.4762650      2.517141  
1 1 1 12 23 6  o 5.6802 1.3779 42.192   19.267  32.762    30.214  48.654    25.012  5.2217 2.0248 6.1388 1.8693 -0.9170876     2.755763  
1 1 1 12 23 7  o 4.9614 1.3742 26.380   20.326  41.434    29.801  13.284    27.795  5.6136 2.0455 4.3091 1.8356 1.304451       2.748348  
1 1 1 12 23 8  o 4.4621 1.2943 15.101   19.327  35.691    28.559  -2.2964   26.252  5.2637 1.9866 3.6604 1.6596 1.603300       2.588595  
1 1 1 12 23 9  o 5.4395 1.3993 38.068   20.271  56.410    30.275  23.163    27.292  6.2694 2.0744 4.6095 1.8786 1.659928       2.798671  
1 1 1 12 23 10 f 5.1636 1.3709 36.312   20.322  19.077    30.056  50.827    27.582  4.4168 1.8958 5.9104 1.9808 -1.493599      2.741788  
1 1 1 12 23 11 o 4.3718 1.2988 21.193   19.832  36.230    28.409  6.8989    27.698  4.9364 1.9489 3.8072 1.7173 1.129220       2.597560  
1 1 1 12 23 12 o 3.1137 1.0501 -23.3497 19.135  -53.4474  28.352  1.8256    25.931  2.6393 1.3174 3.5881 1.6355 -0.9488537     2.100104  
1 1 1 12 23 13 o 4.4708 1.3087 26.450   19.640  40.846    28.266  13.014    27.308  5.0315 1.9564 3.9100 1.7387 1.121486       2.617376  
1 1 1 12 23 14 o 4.0187 1.1785 1.4844   18.974  53.218    27.982  -42.5478  25.815  5.4847 1.9846 2.5527 1.2714 2.931960       2.356920  
1 1 1 12 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 0  o 11.557 1.5680 168.692  31.261  144.050   46.507  189.003   42.223  10.303 2.6100 12.810 1.7384 -0.000000      0.000000  
1 1 1 12 24 1  o 15.121 0.7993 248.214  24.093  275.618   35.669  225.220   32.673  15.893 1.1222 14.349 1.1385 1.543914       1.598606  
1 1 1 12 24 2  o 3.9471 1.2151 4.9069   18.460  -7.6578   26.730  16.365    25.525  3.5548 1.6353 4.3395 1.7977 -0.7846451     2.430209  
1 1 1 12 24 3  o 4.0749 1.2441 9.5046   18.482  7.5523    27.600  11.092    24.885  4.0703 1.7812 4.0795 1.7373 -0.9156704E-02 2.488125  
1 1 1 12 24 4  o 8.7594 1.2768 97.850   21.627  105.714   30.879  90.279    30.299  9.1786 1.7459 8.3402 1.8634 0.8384237      2.553532  
1 1 1 12 24 5  o 6.2992 1.4637 56.169   21.379  63.598    31.120  49.528    29.422  6.6630 2.0948 5.9355 2.0449 0.7274714      2.927412  
1 1 1 12 24 6  o 4.7761 1.3634 26.044   20.664  14.078    30.929  35.691    27.771  4.3556 1.8963 5.1965 1.9595 -0.8408737     2.726880  
1 1 1 12 24 7  o 4.3765 1.3009 12.374   20.616  39.852    30.443  -10.9017  28.018  5.3045 2.0392 3.4484 1.6159 1.856046       2.601820  
1 1 1 12 24 8  o 3.8220 1.1820 -7.1917  19.356  37.146    28.896  -43.2772  26.068  5.0032 1.9686 2.6408 1.3089 2.362337       2.364033  
1 1 1 12 24 9  o 4.6795 1.3195 27.411   20.090  6.0720    29.255  46.455    27.637  3.8603 1.7509 5.4987 1.9746 -1.638335      2.639053  
1 1 1 12 24 10 o 3.7802 1.1858 -2.9459  19.691  32.029    28.419  -35.2428  27.309  4.7315 1.9214 2.8289 1.3902 1.902619       2.371589  
1 1 1 12 24 11 o 3.7091 1.1942 6.1964   19.569  0.8781    28.839  10.735    26.640  3.6043 1.6723 3.8139 1.7051 -0.2096412     2.388336  
1 1 1 12 24 12 o 9.0234 1.2559 117.997  22.127  148.419   32.370  91.313    30.316  10.534 1.5365 7.5130 1.9870 3.020819       2.511781  
1 1 1 12 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 24 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 0  o 6.1453 1.5758 59.061   28.527  -15.5461  42.655  119.437   38.372  2.9750 2.0632 9.3156 2.3825 -0.000000      0.000000  
1 1 1 12 25 1  o 4.2498 1.2960 14.891   20.105  23.617    29.487  7.3106    27.483  4.5739 1.9165 3.9257 1.7451 0.6482158      2.591974  
1 1 1 12 25 2  o 5.1116 1.3352 34.870   19.820  54.630    27.136  12.274    29.018  6.1055 1.9602 4.1176 1.8135 1.987962       2.670416  
1 1 1 12 25 3  o 7.7573 1.3061 84.764   20.381  64.411    28.558  105.891   29.096  6.5324 1.9991 8.9822 1.6814 -2.449796      2.612174  
1 1 1 12 25 4  o 4.4666 1.3123 24.226   19.529  14.619    26.856  35.007    28.450  4.0426 1.7634 4.8906 1.9441 -0.8479147     2.624685  
1 1 1 12 25 5  o 4.5444 1.3195 26.019   19.617  37.724    28.063  14.834    27.433  5.0215 1.9503 4.0672 1.7779 0.9542723      2.639040  
1 1 1 12 25 6  o 6.0188 1.4278 56.556   20.299  54.674    29.456  58.258    28.013  5.8803 2.0449 6.1572 1.9932 -0.2768712     2.855622  
1 1 1 12 25 7  o 5.4691 1.4426 48.317   21.178  46.861    30.039  49.756    29.861  5.3949 2.0371 5.5433 2.0433 -0.1484604     2.885298  
1 1 1 12 25 8  o 3.6485 1.1891 2.3786   20.150  -0.7013   29.419  5.1005    27.657  3.6038 1.6778 3.6931 1.6856 -0.8923602E-01 2.378272  
1 1 1 12 25 9  o 6.1800 1.2613 61.107   20.997  14.503    31.358  98.984    28.270  4.0135 1.8173 8.3464 1.7495 -4.332957      2.522517  
1 1 1 12 25 10 o 3.9603 1.2588 16.930   20.769  20.728    30.681  13.717    28.216  4.0871 1.8284 3.8334 1.7309 0.2536223      2.517693  
1 1 1 12 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 25 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 0  o 3.5433 1.6358 8.0008   30.458  -29.9582  43.349  45.012    42.804  2.6982 1.9135 4.3884 2.6537 -0.000000      0.000000  
1 1 1 12 26 1  o 3.7532 1.1991 2.1200   19.429  22.786    29.354  -13.9936  25.920  4.3567 1.8718 3.1498 1.4992 1.206868       2.398218  
1 1 1 12 26 2  o 5.7045 1.3943 50.984   20.933  74.474    29.873  28.319    29.343  6.8609 2.0326 4.5482 1.9091 2.312622       2.788544  
1 1 1 12 26 3  o 3.5089 1.1863 -11.2389 23.016  -6.3007   28.708  -20.1228  38.506  3.4458 1.6213 3.5720 1.7322 -0.1261835     2.372572  
1 1 1 12 26 4  o 3.7306 1.2171 3.9757   21.088  4.9110    31.156  3.1851    28.646  3.7961 1.7532 3.6651 1.6886 0.1310368      2.434103  
1 1 1 12 26 5  o 5.0643 1.3930 41.486   21.956  18.863    32.116  61.338    30.085  4.1719 1.8682 5.9566 2.0669 -1.784691      2.786074  
1 1 1 12 26 6  o 5.3365 1.4292 47.400   21.824  74.771    33.131  26.421    29.006  6.3463 2.1706 4.3266 1.8599 2.019726       2.858458  
1 1 1 12 26 7  o 3.7071 1.2100 7.9253   20.926  12.356    30.288  3.8780    28.946  3.8361 1.7558 3.5780 1.6653 0.2580485      2.419931  
1 1 1 12 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 26 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 0  o 3.3815 1.6019 13.916   30.450  36.452    44.265  -6.3266   41.953  3.8616 2.4868 2.9014 2.0200 -0.000000      0.000000  
1 1 1 12 27 1  o 3.8601 1.2321 10.950   20.541  32.317    30.604  -6.5674   27.711  4.4459 1.9108 3.2742 1.5561 1.171671       2.464207  
1 1 1 12 27 2  o 3.9028 1.2410 16.186   20.241  12.121    27.812  20.764    29.514  3.7557 1.7049 4.0499 1.8038 -0.2941451     2.482008  
1 1 1 12 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 27 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 28 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 29 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 30 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 31 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 32 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 32 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 32 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 32 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 12 32 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 1  0  o 2.1728 1.0193 -4.6608  11.756  -2.0582   16.672  -7.2348   16.580  2.2754 1.4873 2.0701 1.3942 -0.000000      0.000000  
1 1 1 13 1  1  o 27.400 0.4863 747.848  26.136  777.962   41.588  728.191   33.600  27.846 0.7467 26.954 0.6233 0.8921070      0.9726647 
1 1 1 13 1  2  o 22.835 0.5896 499.820  23.545  573.198   47.880  476.416   27.041  23.869 1.0030 21.802 0.6202 2.067324       1.179222  
1 1 1 13 1  3  o 23.981 0.6055 567.916  25.132  597.691   50.909  558.321   28.899  24.362 1.0448 23.600 0.6122 0.7617874      1.211002  
1 1 1 13 1  4  o 21.739 0.5988 458.325  22.725  509.120   46.005  441.931   26.136  22.484 1.0231 20.995 0.6224 1.489416       1.197531  
1 1 1 13 1  5  f 18.496 0.7621 344.997  28.185  341.831   40.159  348.071   39.566  18.411 1.0906 18.582 1.0647 -0.1709785     1.524142  
1 1 1 13 1  6  o 8.6047 0.7860 72.740   11.305  78.533    24.209  71.125    12.784  8.7953 1.3762 8.4141 0.7597 0.3811979      1.571977  
1 1 1 13 1  7  o 12.750 0.6644 153.628  14.569  184.362   30.661  144.666   16.557  13.498 1.1357 12.002 0.6898 1.496927       1.328785  
1 1 1 13 1  8  o 13.016 0.6884 154.772  14.954  201.588   33.421  143.053   16.721  14.101 1.1851 11.932 0.7007 2.169109       1.376734  
1 1 1 13 1  9  o 27.474 0.5426 759.541  29.813  757.612   42.257  761.452   42.068  27.438 0.7700 27.509 0.7646 -0.7065964E-01 1.085170  
1 1 1 13 1  10 o 12.610 0.6104 161.541  15.317  176.963   21.435  145.449   21.896  13.236 0.8097 11.984 0.9136 1.252641       1.220764  
1 1 1 13 1  11 o 20.470 0.5459 423.861  22.350  423.311   31.462  424.422   31.754  20.458 0.7689 20.483 0.7751 -0.2495575E-01 1.091838  
1 1 1 13 1  12 o 13.030 0.6194 173.551  16.105  181.270   22.398  165.288   23.173  13.341 0.8395 12.718 0.9110 0.6221914      1.238801  
1 1 1 13 1  13 o 2.7675 0.8755 -6.0863  10.082  -11.7692  13.913  0.1992    14.632  2.4697 1.1512 3.0653 1.3194 -0.5955915     1.750966  
1 1 1 13 1  14 o 14.404 0.6033 214.097  17.287  229.142   23.877  197.526   25.059  14.962 0.7979 13.846 0.9050 1.116138       1.206511  
1 1 1 13 1  15 o 7.1629 0.9088 55.509   12.621  55.670    16.825  55.303    19.084  7.2661 1.1578 7.0597 1.4011 0.2063818      1.817552  
1 1 1 13 1  16 o 7.9599 0.8309 66.640   13.160  58.294    17.816  76.662    19.522  7.4049 1.2030 8.5150 1.1463 -1.110167      1.661702  
1 1 1 13 1  17 o 6.5614 0.9937 48.605   12.617  43.976    17.031  54.235    18.782  6.2101 1.4042 6.9127 1.4064 -0.7026501     1.987359  
1 1 1 13 1  18 f 5.3462 1.0697 33.111   11.922  32.856    16.162  33.415    17.657  5.3362 1.4682 5.3562 1.5559 -0.1991987E-01 2.139303  
1 1 1 13 1  19 o 6.8595 0.9806 57.082   13.418  84.533    18.439  26.185    19.562  8.9182 1.0338 4.8008 1.6666 4.117388       1.961229  
1 1 1 13 1  20 f 4.8110 1.1310 25.951   13.209  33.906    17.875  16.382    19.605  5.3959 1.5649 4.2261 1.6332 1.169869       2.261925  
1 1 1 13 1  21 o 9.8891 0.8105 104.797  16.008  101.669   21.962  108.342   23.383  9.7432 1.1270 10.035 1.1650 -0.2919140     1.620970  
1 1 1 13 1  22 o 3.1873 1.0094 -4.1632  13.226  -4.5356   18.027  -3.7289   19.466  3.1110 1.3959 3.2635 1.4584 -0.1525364     2.018788  
1 1 1 13 1  23 o 4.3758 1.1854 18.187   14.531  20.147    19.589  15.788    21.669  4.4571 1.6526 4.2946 1.7000 0.1624713      2.370883  
1 1 1 13 1  24 f 8.6824 1.0412 86.077   17.362  91.134    23.158  79.586    26.236  9.1461 1.2660 8.2186 1.6534 0.9275846      2.082448  
1 1 1 13 1  25 f 12.867 0.8163 181.803  20.669  203.885   28.246  156.347   30.327  13.828 1.0213 11.906 1.2736 1.922439       1.632527  
1 1 1 13 1  26 o 4.8393 1.2489 27.145   16.337  36.398    22.007  15.785    24.384  5.3928 1.7679 4.2859 1.7645 1.106928       2.497788  
1 1 1 13 1  27 o 4.2079 1.2369 17.209   17.130  20.180    21.990  12.624    27.316  4.2870 1.7076 4.1289 1.7898 0.1580963      2.473745  
1 1 1 13 1  28 o 4.4166 1.2799 22.542   17.750  12.130    22.555  39.482    28.769  3.7848 1.6335 5.0485 1.9708 -1.263721      2.559748  
1 1 1 13 1  29 o 4.2215 1.2608 20.920   18.393  4.3038    23.513  47.120    29.525  3.3856 1.5487 5.0575 1.9899 -1.671830      2.521545  
1 1 1 13 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 2  0  o 25.954 0.7632 680.603  39.405  646.288   56.123  713.967   55.340  25.297 1.1142 26.611 1.0434 -0.000000      0.000000  
1 1 1 13 2  1  o 31.140 0.5465 973.540  34.035  991.676   48.338  955.710   47.930  31.429 0.7690 30.852 0.7768 0.5764256      1.093048  
1 1 1 13 2  2  o 9.1500 0.8087 85.306   13.982  81.848    23.835  87.121    17.264  8.9933 1.3252 9.3066 0.9275 -0.3132553     1.617493  
1 1 1 13 2  3  o 15.864 0.5504 252.738  17.461  256.435   24.706  249.048   24.682  15.980 0.7730 15.748 0.7837 0.2327652      1.100775  
1 1 1 13 2  4  o 19.210 0.5374 370.582  20.644  359.911   29.047  381.473   29.344  18.930 0.7672 19.490 0.7528 -0.5603809     1.074851  
1 1 1 13 2  5  o 16.900 0.6363 282.894  18.340  296.461   37.913  278.749   20.955  17.132 1.1065 16.669 0.6286 0.4629860      1.272607  
1 1 1 13 2  6  o 5.5224 0.9914 35.079   10.023  19.605    22.246  39.020    11.227  4.8214 1.7657 6.2234 0.9020 -1.401987      1.982731  
1 1 1 13 2  7  o 15.671 0.6867 257.468  17.693  230.786   36.970  265.395   20.150  15.081 1.2257 16.260 0.6196 -1.179490      1.373443  
1 1 1 13 2  8  o 5.4779 1.0489 33.277   10.481  19.803    25.022  36.144    11.542  4.9724 1.8630 5.9835 0.9645 -1.011069      2.097881  
1 1 1 13 2  9  o 4.4279 1.0788 18.997   10.334  10.019    23.845  21.073    11.467  4.3793 1.7664 4.4765 1.2388 -0.9719181E-01 2.157505  
1 1 1 13 2  10 o 6.0996 1.1202 39.051   11.672  37.329    27.772  39.420    12.863  5.9818 1.9872 6.2175 1.0344 -0.2356849     2.240311  
1 1 1 13 2  11 o 9.0261 0.9382 86.468   13.487  84.060    28.522  87.162    15.307  8.7829 1.6850 9.2693 0.8257 -0.4864693     1.876451  
1 1 1 13 2  12 o 12.363 0.8276 168.497  16.241  144.350   34.785  175.228   18.366  11.593 1.5002 13.132 0.6993 -1.539116      1.655205  
1 1 1 13 2  13 o 12.737 0.7590 166.482  16.225  169.840   33.915  165.485   18.476  12.707 1.3345 12.767 0.7236 -0.5998325E-01 1.518014  
1 1 1 13 2  14 o 11.790 0.7943 149.631  15.615  137.600   31.938  153.410   17.900  11.316 1.4111 12.264 0.7298 -0.9478531     1.588675  
1 1 1 13 2  15 o 8.1989 1.0293 75.738   13.528  72.185    28.478  76.774    15.373  7.7881 1.8548 8.6098 0.8928 -0.8217354     2.058503  
1 1 1 13 2  16 f 2.6667 0.9017 -24.0445 11.451  -3.6833   21.780  -31.8236  13.462  3.4717 1.5477 1.8617 0.9258 1.609967       1.803446  
1 1 1 13 2  17 o 4.1565 0.9466 16.545   10.906  32.694    14.373  -5.3756   16.745  5.3587 1.3436 2.9543 1.3337 2.404330       1.893133  
1 1 1 13 2  18 o 7.1755 0.9603 60.590   13.132  78.174    17.882  40.001    19.349  8.5669 1.0436 5.7840 1.6123 2.782912       1.920564  
1 1 1 13 2  19 o 13.753 0.6610 198.754  18.158  194.678   24.962  203.334   26.461  13.616 0.9166 13.889 0.9526 -0.2729979     1.321944  
1 1 1 13 2  20 o 3.6562 1.0231 5.6948   13.011  21.379    16.226  -22.5433  21.773  4.4349 1.5191 2.8776 1.3709 1.557384       2.046180  
1 1 1 13 2  21 o 4.1284 1.0476 11.034   13.526  34.311    18.508  -15.6447  19.815  5.3810 1.6012 2.8757 1.3512 2.505204       2.095109  
1 1 1 13 2  22 f 12.845 0.7366 174.870  18.777  191.725   26.002  156.501   27.145  13.545 0.9598 12.146 1.1175 1.399918       1.473107  
1 1 1 13 2  23 o 4.7081 1.1589 23.651   14.296  34.466    18.972  9.4415    21.747  5.4321 1.6222 3.9841 1.6556 1.448074       2.317898  
1 1 1 13 2  24 o 17.718 0.6755 328.655  23.902  322.978   32.835  335.054   34.860  17.573 0.9343 17.863 0.9758 -0.2899380     1.350911  
1 1 1 13 2  25 o 7.5338 1.1941 68.662   17.667  53.535    24.098  86.239    25.976  6.5333 1.7909 8.5343 1.5800 -2.001091      2.388277  
1 1 1 13 2  26 o 7.3658 1.2361 70.016   18.221  84.112    24.905  53.782    26.727  8.3822 1.5424 6.3493 1.9321 2.032915       2.472255  
1 1 1 13 2  27 o 4.5534 1.2873 26.986   17.752  28.784    23.602  24.644    26.938  4.6388 1.7922 4.4679 1.8485 0.1709309      2.574674  
1 1 1 13 2  28 o 3.5234 1.1373 2.6122   17.568  -0.7828   23.067  7.3022    27.112  3.3141 1.5225 3.7326 1.6900 -0.4185107     2.274653  
1 1 1 13 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 2  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 3  0  o 3.6294 1.1679 11.566   13.126  -16.0997  18.949  37.082    18.198  1.9831 1.3753 5.2758 1.8880 -0.000000      0.000000  
1 1 1 13 3  1  o 9.3818 0.6636 88.593   12.452  88.754    17.566  88.430    17.653  9.3906 0.9353 9.3731 0.9417 0.1752377E-01  1.327222  
1 1 1 13 3  2  f 22.960 0.6368 523.425  27.916  507.625   34.425  553.769   47.707  22.480 0.7657 23.440 1.0177 -0.9595509     1.273529  
1 1 1 13 3  3  o 15.641 0.5559 246.122  17.369  259.456   24.506  232.663   24.621  16.070 0.7625 15.213 0.8092 0.8568602      1.111864  
1 1 1 13 3  4  o 3.0993 0.8970 2.2364   9.1973  -5.0216   13.472  8.5719    12.587  2.7410 1.2199 3.4575 1.3155 -0.7164536     1.794083  
1 1 1 13 3  5  o 17.563 0.5518 310.097  19.353  334.245   27.711  287.104   27.041  18.233 0.7599 16.893 0.8003 1.339567       1.103642  
1 1 1 13 3  6  o 19.316 0.5480 375.202  21.137  404.508   30.253  347.253   29.544  20.056 0.7542 18.577 0.7952 1.479305       1.095973  
1 1 1 13 3  7  o 10.850 0.6393 118.709  13.869  114.960   19.542  122.514   19.687  10.676 0.9152 11.024 0.8929 -0.3474302     1.278660  
1 1 1 13 3  8  o 14.089 0.7029 200.207  16.611  202.435   34.821  199.551   18.900  14.092 1.2355 14.086 0.6709 0.6196022E-02  1.405851  
1 1 1 13 3  9  o 6.6012 1.0694 49.505   11.784  38.360    26.366  52.288    13.174  6.0243 1.9320 7.1781 0.9176 -1.153820      2.138824  
1 1 1 13 3  10 o 9.3287 0.8167 77.495   13.008  113.659   28.657  68.109    14.599  10.469 1.3687 8.1886 0.8914 2.280042       1.633404  
1 1 1 13 3  11 o 2.9077 0.9206 -2.2966  9.7259  -22.6736  22.615  2.3277    10.773  3.0213 1.4269 2.7941 1.1636 0.2271886      1.841154  
1 1 1 13 3  12 o 6.1475 1.1498 37.745   11.907  50.098    27.868  34.986    13.169  6.6018 1.9649 5.6932 1.1947 0.9086719      2.299552  
1 1 1 13 3  13 f 5.5905 1.1054 38.250   12.434  20.641    26.251  43.342    14.117  4.8411 1.8846 6.3400 1.1560 -1.498854      2.210842  
1 1 1 13 3  14 o 7.3861 1.0900 65.910   13.286  50.610    28.077  70.324    15.081  6.5234 1.9792 8.2488 0.9141 -1.725483      2.180079  
1 1 1 13 3  15 o 7.8309 1.0792 66.736   13.666  71.845    29.719  65.366    15.390  7.7378 1.9275 7.9241 0.9711 -0.1862631     2.158338  
1 1 1 13 3  16 o 5.5022 1.1197 36.460   12.201  27.939    25.436  39.006    13.906  5.0707 1.8826 5.9336 1.2127 -0.8629637     2.239360  
1 1 1 13 3  17 o 6.7646 1.0937 59.813   12.833  36.939    28.011  65.890    14.438  5.5842 1.9897 7.9449 0.9086 -2.360629      2.187382  
1 1 1 13 3  18 o 6.6422 1.1421 46.229   12.581  65.309    28.735  41.705    13.993  7.1621 1.9525 6.1224 1.1856 1.039685       2.284270  
1 1 1 13 3  19 f 5.5036 0.9700 43.862   12.805  -16.2939  29.875  57.400    14.173  3.6174 1.6863 7.3898 0.9589 -3.772439      1.939931  
1 1 1 13 3  20 o 4.2341 1.1271 18.014   12.020  3.9299    27.765  21.262    13.335  4.0959 1.7896 4.3723 1.3707 -0.2763581     2.254212  
1 1 1 13 3  21 o 11.762 0.9112 146.545  17.799  160.508   37.989  142.618   20.147  11.827 1.6060 11.697 0.8612 0.1304302      1.822325  
1 1 1 13 3  22 o 8.9889 1.1434 80.879   16.335  115.992   37.666  72.745    18.129  9.7019 2.0074 8.2760 1.0953 1.425909       2.286710  
1 1 1 13 3  23 o 10.930 0.9778 128.014  17.854  138.634   37.639  124.931   20.281  10.933 1.7214 10.926 0.9281 0.6608963E-02  1.955635  
1 1 1 13 3  24 o 17.896 0.8174 344.992  24.298  338.943   50.597  346.806   27.701  17.449 1.4499 18.343 0.7551 -0.8942242     1.634713  
1 1 1 13 3  25 o 6.2331 1.4076 44.469   16.346  64.370    39.580  40.377    17.949  6.6595 2.3660 5.8067 1.5257 0.8527665      2.815256  
1 1 1 13 3  26 o 7.1069 1.3756 64.689   17.004  76.073    40.956  62.319    18.691  6.8963 2.4106 7.3175 1.3260 -0.4211807     2.751189  
1 1 1 13 3  27 o 6.3460 1.4318 45.955   16.975  105.282   39.692  32.675    18.779  7.7808 2.3516 4.9112 1.6342 2.869521       2.863636  
1 1 1 13 3  28 o 7.3179 1.1902 99.211   18.846  36.371    44.023  113.313   20.854  4.6957 2.1367 9.9401 1.0490 -5.244382      2.380332  
1 1 1 13 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 4  0  o 34.116 0.7904 1174.38  53.781  1155.63   76.694  1192.51   75.437  33.842 1.1360 34.390 1.0993 -0.000000      0.000000  
1 1 1 13 4  1  o 14.186 0.7098 201.803  18.760  199.659   22.673  206.458   33.408  14.090 0.8046 14.282 1.1696 -0.1925583     1.419592  
1 1 1 13 4  2  o 25.959 0.5337 677.382  27.707  680.154   39.102  674.588   39.265  26.013 0.7516 25.905 0.7579 0.1077690      1.067353  
1 1 1 13 4  3  o 6.7374 0.8359 47.339   10.870  38.799    15.574  55.451    15.179  6.0649 1.3213 7.4098 1.0242 -1.344865      1.671802  
1 1 1 13 4  4  o 26.109 0.5373 685.526  28.058  684.755   39.797  686.288   39.563  26.094 0.7626 26.124 0.7572 -0.3022385E-01 1.074667  
1 1 1 13 4  5  o 26.683 0.5407 716.054  28.851  698.884   40.566  733.626   41.040  26.358 0.7695 27.008 0.7598 -0.6491909     1.081389  
1 1 1 13 4  6  o 25.569 0.5427 657.893  27.751  648.845   39.294  666.898   39.198  25.392 0.7738 25.745 0.7613 -0.3534088     1.085459  
1 1 1 13 4  7  o 2.9746 0.9044 -2.3425  9.8845  4.6820    14.595  -8.2949   13.435  3.3662 1.3731 2.5831 1.1773 0.7831044      1.808712  
1 1 1 13 4  8  o 10.602 0.6962 115.227  14.339  82.516    19.831  151.068   20.758  8.9890 1.1031 12.214 0.8497 -3.225342      1.392424  
1 1 1 13 4  9  o 17.035 0.5762 294.039  19.618  281.631   27.717  306.494   27.770  16.670 0.8313 17.399 0.7980 -0.7293434     1.152365  
1 1 1 13 4  10 o 13.336 0.6306 181.582  16.789  167.398   23.501  196.363   23.992  12.796 0.9183 13.876 0.8645 -1.080162      1.261182  
1 1 1 13 4  11 o 9.9018 0.8349 90.595   13.873  126.310   31.025  81.670    15.510  10.878 1.4261 8.9260 0.8688 1.951530       1.669895  
1 1 1 13 4  12 o 5.0007 1.1373 25.547   11.303  27.742    24.775  24.970    12.702  5.2144 1.8698 4.7870 1.2952 0.4273686      2.274614  
1 1 1 13 4  13 o 14.802 0.7690 241.238  18.778  204.822   38.115  252.910   21.579  13.836 1.3774 15.768 0.6843 -1.931490      1.537966  
1 1 1 13 4  14 o 17.693 0.7225 336.597  21.277  310.036   43.648  344.876   24.369  16.994 1.2842 18.392 0.6625 -1.397701      1.445025  
1 1 1 13 4  15 o 9.0768 0.9480 88.119   14.096  93.822    29.173  86.382    16.100  9.0214 1.6787 9.1322 0.8815 -0.1108599     1.896044  
1 1 1 13 4  16 o 4.3768 1.1170 20.899   12.244  2.3945    27.461  25.490    13.678  4.0155 1.7665 4.7380 1.3675 -0.7224283     2.233923  
1 1 1 13 4  17 o 8.8787 1.0706 101.100  14.643  69.996    29.963  110.859   16.784  7.4236 1.9812 10.334 0.8121 -2.910263      2.141187  
1 1 1 13 4  18 o 4.4612 1.0205 24.423   12.021  -19.2202  28.656  33.744    13.243  3.4493 1.6220 5.4731 1.2387 -2.023734      2.040910  
1 1 1 13 4  19 o 6.6878 1.1546 58.993   13.693  34.993    31.873  64.426    15.164  5.5395 2.0968 7.8360 0.9676 -2.296570      2.309235  
1 1 1 13 4  20 o 4.7946 1.0432 29.514   12.765  -14.5724  29.477  39.690    14.162  3.6286 1.6861 5.9606 1.2288 -2.332011      2.086343  
1 1 1 13 4  21 o 7.3374 1.2030 68.881   14.630  50.605    34.143  72.992    16.192  6.3305 2.2016 8.3443 0.9702 -2.013816      2.405938  
1 1 1 13 4  22 o 4.7513 1.2774 21.222   13.468  24.003    34.627  20.726    14.620  5.1480 2.1091 4.3546 1.4416 0.7933607      2.554718  
1 1 1 13 4  23 f 6.8130 1.2512 54.836   15.026  55.265    34.375  54.735    16.707  6.4964 2.2111 7.1295 1.1717 -0.6331482     2.502338  
1 1 1 13 4  24 o 4.2665 1.1005 19.510   13.738  -36.9615  35.281  29.602    14.915  3.4864 1.6827 5.0466 1.4186 -1.560201      2.200912  
1 1 1 13 4  25 o 4.2027 1.2783 7.2611   13.818  30.932    37.369  3.5121    14.872  5.2529 2.1756 3.1525 1.3428 2.100451       2.556586  
1 1 1 13 4  26 o 4.3589 1.1586 22.695   13.875  -9.5294   35.002  28.703    15.113  3.8648 1.8094 4.8529 1.4475 -0.9880056     2.317202  
1 1 1 13 4  27 o 4.4877 1.1990 26.750   13.817  4.4265    39.223  29.912    14.763  4.1284 1.9272 4.8470 1.4270 -0.7185125     2.397962  
1 1 1 13 4  28 o 7.6247 1.2803 103.824  18.222  74.278    45.699  109.410   19.870  5.5021 2.3489 9.7473 1.0193 -4.245159      2.560567  
1 1 1 13 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 5  0  f 28.287 0.7700 810.523  43.274  743.169   61.570  876.279   60.835  27.104 1.1404 29.471 1.0350 -0.000000      0.000000  
1 1 1 13 5  1  o 19.819 0.6430 385.607  24.302  430.026   42.095  363.401   29.764  20.631 1.0202 19.006 0.7830 1.625731       1.286021  
1 1 1 13 5  2  o 25.272 0.5350 642.275  27.041  649.456   38.410  635.219   38.076  25.412 0.7557 25.132 0.7575 0.2804222      1.070034  
1 1 1 13 5  3  o 18.776 0.5430 354.704  20.379  340.934   28.762  368.586   28.879  18.408 0.7813 19.144 0.7543 -0.7359219     1.085943  
1 1 1 13 5  4  o 33.607 0.5597 1136.90  37.614  1121.13   53.252  1152.61   53.136  33.373 0.7978 33.841 0.7851 -0.4688873     1.119325  
1 1 1 13 5  5  o 40.587 0.5896 1660.51  47.859  1636.74   67.515  1684.52   67.853  40.293 0.8378 40.880 0.8299 -0.5869827     1.179248  
1 1 1 13 5  6  o 34.174 0.5661 1179.14  38.672  1137.27   54.610  1221.26   54.772  33.560 0.8136 34.788 0.7872 -1.228012      1.132130  
1 1 1 13 5  7  o 15.485 0.5741 242.957  17.756  255.674   24.986  229.982   25.238  15.901 0.7857 15.069 0.8374 0.8314533      1.148275  
1 1 1 13 5  8  f 6.3392 0.9255 43.656   11.528  29.023    16.686  57.020    15.945  5.2101 1.5123 7.4684 1.0675 -2.258254      1.851084  
1 1 1 13 5  9  o 13.131 0.6106 175.829  16.027  182.650   22.698  169.046   22.633  13.390 0.8476 12.873 0.8791 0.5172787      1.221146  
1 1 1 13 5  10 o 4.7841 1.0620 24.567   11.308  27.301    16.616  22.209    15.433  4.9955 1.5241 4.5727 1.4793 0.4228091      2.123981  
1 1 1 13 5  11 f 10.262 0.7278 109.476  14.802  96.564    21.430  121.255   20.469  9.6532 1.1100 10.871 0.9415 -1.217467      1.455509  
1 1 1 13 5  12 o 6.3676 1.0001 45.101   12.380  44.659    18.210  45.481    16.881  6.3163 1.4692 6.4189 1.3573 -0.1026263     2.000243  
1 1 1 13 5  13 o 9.2982 1.0004 101.153  13.961  84.204    30.291  105.724   15.731  8.4468 1.8447 10.149 0.7750 -1.702634      2.000875  
1 1 1 13 5  14 o 15.274 0.7718 254.337  19.059  229.105   40.353  261.582   21.623  14.534 1.3882 16.014 0.6751 -1.479859      1.543668  
1 1 1 13 5  15 o 5.0332 1.1692 28.803   12.281  24.021    27.583  29.985    13.715  4.9194 1.9271 5.1469 1.3246 -0.2275286     2.338472  
1 1 1 13 5  16 o 6.0463 1.0881 49.343   12.760  19.211    29.509  56.273    14.152  4.7703 1.9499 7.3222 0.9663 -2.551925      2.176197  
1 1 1 13 5  17 o 3.3766 1.0726 -0.8116  11.211  4.7430    28.147  -1.8590   12.222  4.1017 1.7967 2.6516 1.1719 1.450059       2.145137  
1 1 1 13 5  18 o 6.1372 1.1866 39.521   12.497  56.248    28.999  35.707    13.849  6.6422 2.0106 5.6322 1.2609 1.009987       2.373238  
1 1 1 13 5  19 o 7.3486 1.1851 61.280   13.984  65.941    32.935  60.255    15.446  7.1426 2.1384 7.5546 1.0223 -0.4120283     2.370146  
1 1 1 13 5  20 o 6.8411 1.1819 53.225   13.705  59.010    31.186  51.840    15.258  6.7228 2.0943 6.9594 1.0962 -0.2366238     2.363823  
1 1 1 13 5  21 o 5.3367 1.3175 25.630   13.970  49.527    33.492  20.597    15.371  6.3028 2.1812 4.3707 1.4786 1.932068       2.635100  
1 1 1 13 5  22 o 5.4467 1.1650 39.241   14.132  1.0776    35.658  46.353    15.393  4.4248 1.9759 6.4687 1.2348 -2.043894      2.329984  
1 1 1 13 5  23 o 5.6022 1.2739 36.421   14.138  32.699    34.142  37.191    15.533  5.4837 2.1452 5.7207 1.3747 -0.2370157     2.547868  
1 1 1 13 5  24 o 3.3958 1.1041 -1.1023  13.087  -24.9492  36.564  2.4013    14.015  3.7575 1.7862 3.0342 1.2982 0.7232869      2.208145  
1 1 1 13 5  25 o 4.1539 1.1834 16.061   12.041  8.0124    34.127  17.206    12.868  4.3646 1.9421 3.9432 1.3527 0.4213431      2.366809  
1 1 1 13 5  26 o 5.1551 1.2869 35.645   14.221  33.924    40.257  35.890    15.201  4.9483 2.1587 5.3620 1.4018 -0.4136386     2.573873  
1 1 1 13 5  27 o 5.1565 1.0200 43.409   13.387  -28.5554  42.053  51.524    14.122  3.5748 1.7502 6.7381 1.0479 -3.163302      2.039958  
1 1 1 13 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 5  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 6  0  o 3.9624 1.3085 16.471   15.036  42.330    21.647  -7.6346   20.901  5.5645 2.0844 2.3603 1.5823 -0.000000      0.000000  
1 1 1 13 6  1  o 16.495 0.5587 273.938  18.431  274.667   26.311  273.235   25.826  16.516 0.7965 16.475 0.7838 0.4133034E-01  1.117480  
1 1 1 13 6  2  o 4.7629 1.0379 23.272   10.867  23.839    15.331  22.698    15.404  4.8084 1.4633 4.7173 1.4723 0.9102058E-01  2.075809  
1 1 1 13 6  3  o 18.447 0.5500 342.831  20.290  347.259   28.821  338.481   28.569  18.565 0.7762 18.328 0.7794 0.2367039      1.099967  
1 1 1 13 6  4  o 8.4000 0.7717 71.876   12.950  74.812    18.159  68.837    18.473  8.5791 1.0583 8.2209 1.1235 0.3582010      1.543489  
1 1 1 13 6  5  o 16.835 0.5631 286.635  18.947  291.181   26.439  281.835   27.167  16.976 0.7787 16.694 0.8137 0.2825317      1.126280  
1 1 1 13 6  6  o 5.0109 0.9362 24.961   10.973  4.9966    15.307  46.065    15.738  3.4302 1.4035 6.5915 1.2393 -3.161375      1.872316  
1 1 1 13 6  7  o 9.8391 0.7070 98.732   13.908  102.219   19.858  95.375    19.485  10.011 0.9918 9.6671 1.0078 0.3440189      1.413969  
1 1 1 13 6  8  o 11.283 0.6684 131.427  14.822  160.829   21.150  103.052   20.778  12.561 0.8419 10.006 1.0383 2.555525       1.336719  
1 1 1 13 6  9  o 19.571 0.5650 390.948  22.098  412.025   31.671  370.952   30.849  20.091 0.7882 19.052 0.8096 1.038303       1.129905  
1 1 1 13 6  10 o 12.044 0.6467 148.656  15.562  156.198   22.049  141.170   21.967  12.355 0.8923 11.732 0.9362 0.6227942      1.293309  
1 1 1 13 6  11 o 6.1414 1.0333 42.571   12.578  35.783    18.098  48.912    17.493  5.6264 1.5560 6.6564 1.3599 -1.030016      2.066555  
1 1 1 13 6  12 o 4.0155 1.0613 14.537   11.552  11.119    16.498  17.826    16.180  3.8016 1.4901 4.2294 1.5117 -0.4278212     2.122623  
1 1 1 13 6  13 o 2.9822 0.9375 -3.4259  11.187  -4.1821   16.621  -2.7996   15.126  3.0240 1.3498 2.9404 1.3014 0.8364606E-01  1.874976  
1 1 1 13 6  14 o 8.0838 0.9123 72.302   14.152  59.370    20.263  84.617    19.774  7.2373 1.4504 8.9303 1.1071 -1.692961      1.824660  
1 1 1 13 6  15 o 13.411 0.6705 188.830  17.965  185.111   25.809  192.326   25.023  13.266 0.9727 13.556 0.9230 -0.2893553     1.340929  
1 1 1 13 6  16 o 8.9118 1.1350 108.974  15.255  65.069    32.358  121.522   17.298  7.0065 2.1245 10.817 0.7996 -3.810585      2.269983  
1 1 1 13 6  17 o 4.9451 1.1787 29.082   12.844  15.412    30.567  32.014    14.155  4.6033 1.9412 5.2868 1.3376 -0.6834478     2.357454  
1 1 1 13 6  18 o 7.3979 1.1254 62.760   13.345  63.010    30.321  62.700    14.862  7.0628 2.0353 7.7329 0.9610 -0.6700706     2.250728  
1 1 1 13 6  19 o 4.6060 1.1429 24.530   12.487  -0.0860   31.753  29.033    13.581  4.1619 1.8611 5.0502 1.3272 -0.8883290     2.285833  
1 1 1 13 6  20 o 4.4229 1.2123 14.457   11.955  30.329    29.710  11.391    13.059  5.2793 2.0181 3.5665 1.3440 1.712850       2.424662  
1 1 1 13 6  21 o 7.6893 1.1821 90.029   15.744  29.291    37.180  103.300   17.379  5.4115 2.1976 9.9671 0.8718 -4.555626      2.364260  
1 1 1 13 6  22 o 9.6649 0.9833 85.554   15.743  140.155   36.668  73.215    17.431  11.023 1.6632 8.3067 1.0492 2.716434       1.966522  
1 1 1 13 6  23 o 3.2789 0.9630 3.0971   11.634  -84.0295  33.979  14.668    12.383  2.7849 1.3976 3.7728 1.3251 -0.9879296     1.925935  
1 1 1 13 6  24 o 6.9794 1.2784 62.840   14.776  54.855    39.540  64.136    15.930  6.2255 2.3401 7.7333 1.0300 -1.507790      2.556731  
1 1 1 13 6  25 o 5.6928 1.2400 43.889   13.740  27.825    39.818  46.061    14.639  5.0363 2.1721 6.3494 1.1967 -1.313089      2.479911  
1 1 1 13 6  26 f 3.1925 0.9535 8.9076   6.8284  -45.8036  39.250  10.615    6.9342  3.2976 1.6293 3.0873 0.9909 0.2103314      1.906940  
1 1 1 13 6  27 o 9.1830 1.3493 133.393  17.530  116.149   46.388  136.265   18.934  7.2151 2.5616 11.151 0.8490 -3.935914      2.698642  
1 1 1 13 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 6  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 7  0  o 28.943 0.7789 850.676  44.854  793.396   63.525  907.629   63.343  27.951 1.1407 29.935 1.0610 -0.000000      0.000000  
1 1 1 13 7  1  o 9.3722 0.7369 90.425   13.349  120.341   19.294  62.956    18.489  10.900 0.8851 7.8448 1.1784 3.054714       1.473783  
1 1 1 13 7  2  o 28.226 0.5459 804.928  30.819  807.761   43.527  802.080   43.641  28.277 0.7697 28.176 0.7744 0.1013870      1.091854  
1 1 1 13 7  3  o 8.3493 0.7569 71.051   12.625  66.616    17.475  75.895    18.260  8.0753 1.0820 8.6232 1.0588 -0.5479460     1.513843  
1 1 1 13 7  4  o 9.0407 0.7366 83.530   13.303  86.432    18.619  80.503    19.015  9.2067 1.0112 8.8748 1.0713 0.3318930      1.473142  
1 1 1 13 7  5  o 11.513 0.6490 134.815  14.938  137.797   21.020  131.772   21.234  11.644 0.9026 11.381 0.9329 0.2636681      1.298047  
1 1 1 13 7  6  o 17.891 0.6828 311.196  23.070  281.694   27.799  376.471   41.350  16.645 0.8351 19.136 1.0804 -2.491545      1.365506  
1 1 1 13 7  7  f 13.166 0.6147 177.311  16.168  189.860   23.182  165.427   22.559  13.626 0.8507 12.707 0.8877 0.9194336      1.229495  
1 1 1 13 7  8  f 9.5296 0.7538 96.599   13.726  64.944    19.397  128.347   19.426  7.8666 1.2329 11.193 0.8678 -3.326107      1.507640  
1 1 1 13 7  9  o 4.2374 1.0104 16.971   10.687  7.7313    14.941  26.649    15.291  3.5255 1.4065 4.9494 1.4509 -1.423932      2.020728  
1 1 1 13 7  10 o 11.505 0.6654 136.592  15.293  145.335   22.231  128.738   21.070  11.855 0.9376 11.155 0.9444 0.7000904      1.330826  
1 1 1 13 7  11 o 5.9934 1.0403 40.190   12.358  44.690    18.303  36.420    16.753  6.2994 1.4782 5.6873 1.4641 0.6121278      2.080557  
1 1 1 13 7  12 o 6.7812 0.9855 51.193   12.882  52.966    19.088  49.711    17.456  6.8716 1.4352 6.6909 1.3510 0.1806960      1.971083  
1 1 1 13 7  13 o 5.1461 1.1119 29.989   12.514  33.899    18.328  26.573    17.129  5.4247 1.5879 4.8675 1.5568 0.5571523      2.223770  
1 1 1 13 7  14 o 7.3009 0.9643 59.969   13.551  63.880    19.696  56.455    18.672  7.5356 1.3568 7.0663 1.3706 0.4693351      1.928609  
1 1 1 13 7  15 o 11.338 0.7430 137.267  16.712  126.073   24.495  147.015   22.858  10.853 1.1285 11.823 0.9666 -0.9707623     1.485927  
1 1 1 13 7  16 o 6.3775 1.0418 47.754   13.076  40.528    18.998  54.258    18.025  5.8402 1.5857 6.9148 1.3518 -1.074599      2.083688  
1 1 1 13 7  17 o 9.4115 0.8338 96.575   15.412  80.062    22.377  111.478   21.258  8.5594 1.3072 10.264 1.0356 -1.704243      1.667670  
1 1 1 13 7  18 o 14.070 0.8521 228.589  18.812  185.606   39.872  240.898   21.337  12.817 1.5555 15.323 0.6962 -2.506180      1.704201  
1 1 1 13 7  19 o 7.8903 1.1929 71.959   14.451  76.115    34.819  71.094    15.884  7.5693 2.1810 8.2114 0.9672 -0.6421399     2.385799  
1 1 1 13 7  20 o 13.367 0.8496 194.106  18.379  186.021   39.355  196.361   20.784  12.914 1.5237 13.820 0.7520 -0.9060154     1.699174  
1 1 1 13 7  21 o 6.2192 1.1949 50.412   13.699  25.458    36.358  54.541    14.789  5.2491 2.1571 7.1893 1.0285 -1.940264      2.389773  
1 1 1 13 7  22 o 4.6664 1.2516 14.376   11.900  42.316    32.048  9.9079    12.816  5.8910 2.1250 3.4418 1.3231 2.449184       2.503290  
1 1 1 13 7  23 o 8.9327 1.3032 104.670  16.918  88.131    42.250  107.828   18.463  7.7512 2.4414 10.114 0.9127 -2.362942      2.606458  
1 1 1 13 7  24 o 8.7345 1.1588 71.478   15.921  134.003   38.920  58.913    17.447  10.158 1.9868 7.3105 1.1933 2.847875       2.317646  
1 1 1 13 7  25 o 3.2322 1.0912 -4.4567  11.760  -9.3941   37.997  -3.9336   12.367  3.9533 1.8617 2.5110 1.1387 1.442298       2.182333  
1 1 1 13 7  26 o 4.0619 1.1782 17.065   11.282  17.468    36.710  17.023    11.856  4.3430 1.9664 3.7807 1.2983 0.5623350      2.356334  
1 1 1 13 7  27 f 3.5570 1.0021 14.643   12.046  -69.3895  40.985  22.589    12.603  2.9643 1.4938 4.1498 1.3363 -1.185506      2.004262  
1 1 1 13 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 8  0  o 8.7507 1.3472 91.892   19.866  131.515   28.784  55.849    27.452  11.143 1.3433 6.3582 2.3356 -0.000000      0.000000  
1 1 1 13 8  1  o 14.747 0.5813 220.371  17.131  220.588   24.707  220.171   23.774  14.750 0.8375 14.743 0.8063 0.6573677E-02  1.162552  
1 1 1 13 8  2  o 12.569 0.6343 161.046  15.838  139.006   22.272  183.595   22.528  11.684 0.9531 13.455 0.8372 -1.771420      1.268566  
1 1 1 13 8  3  o 15.741 0.5886 251.488  18.476  226.577   25.781  277.790   26.492  14.931 0.8633 16.551 0.8003 -1.620250      1.177201  
1 1 1 13 8  4  o 20.770 0.5547 438.196  23.039  442.952   32.489  433.386   32.675  20.886 0.7778 20.654 0.7910 0.2321625      1.109358  
1 1 1 13 8  5  o 9.3737 0.7363 90.743   13.683  75.839    18.945  106.997   19.785  8.5493 1.1080 10.198 0.9700 -1.648688      1.472621  
1 1 1 13 8  6  o 17.565 0.5755 315.179  20.190  318.837   29.388  311.908   27.785  17.652 0.8324 17.477 0.7949 0.1753960      1.150995  
1 1 1 13 8  7  o 10.648 0.7138 116.856  15.103  134.369   21.683  100.353   21.049  11.442 0.9475 9.8544 1.0680 1.587925       1.427693  
1 1 1 13 8  8  o 13.173 0.8221 165.307  19.544  146.194   22.635  221.295   38.740  11.909 0.9504 14.438 1.3416 -2.529695      1.644107  
1 1 1 13 8  9  o 4.1896 1.0808 16.706   11.771  17.409    16.355  15.950    16.956  4.2254 1.5188 4.1538 1.5381 0.7162857E-01  2.161558  
1 1 1 13 8  10 o 5.1023 1.0471 27.358   11.919  43.346    17.986  14.840    15.915  6.1971 1.4728 4.0074 1.4889 2.189694       2.094273  
1 1 1 13 8  11 o 8.3032 0.8115 72.798   13.467  76.636    19.435  69.254    18.677  8.5160 1.1411 8.0904 1.1543 0.4255514      1.623084  
1 1 1 13 8  12 o 6.1408 1.0457 42.808   12.656  45.526    18.749  40.533    17.153  6.3098 1.5065 5.9718 1.4506 0.3379273      2.091340  
1 1 1 13 8  13 o 13.438 0.6644 189.107  17.842  199.343   25.645  179.505   24.839  13.796 0.9294 13.079 0.9496 0.7174082      1.328703  
1 1 1 13 8  14 o 4.5624 1.1084 22.418   12.219  27.320    18.297  18.473    16.415  4.8977 1.6123 4.2271 1.5214 0.6706643      2.216767  
1 1 1 13 8  15 o 9.3641 0.8345 96.602   15.295  80.943    22.599  109.837   20.776  8.5611 1.3198 10.167 1.0217 -1.606040      1.669093  
1 1 1 13 8  16 o 11.742 0.7238 146.905  16.907  134.726   24.404  158.145   23.444  11.229 1.0866 12.255 0.9565 -1.025601      1.447665  
1 1 1 13 8  17 o 5.9108 1.0682 39.117   13.515  61.896    20.150  20.488    18.222  7.3947 1.4140 4.4269 1.6015 2.967874       2.136398  
1 1 1 13 8  18 o 3.9505 1.1047 12.533   13.239  5.0559    19.413  19.034    18.101  3.6024 1.5343 4.2986 1.5897 -0.6962590     2.209304  
1 1 1 13 8  19 o 11.575 0.7522 141.473  17.346  143.267   25.734  139.979   23.483  11.616 1.1077 11.535 1.0180 0.8185959E-01  1.504379  
1 1 1 13 8  20 o 6.0205 1.2547 43.728   13.852  36.144    35.349  45.103    15.056  5.6552 2.1909 6.3859 1.2234 -0.7307277     2.509348  
1 1 1 13 8  21 o 7.2838 1.2349 70.618   14.486  47.888    37.654  74.567    15.693  6.1334 2.2879 8.4342 0.9303 -2.300803      2.469798  
1 1 1 13 8  22 o 10.163 1.1638 117.727  17.842  123.477   40.517  116.344   19.873  9.8050 2.1273 10.520 0.9445 -0.7149382     2.327555  
1 1 1 13 8  23 o 4.7729 1.2948 14.965   12.612  51.728    34.738  9.3832    13.536  6.1380 2.2127 3.4078 1.3453 2.730202       2.589578  
1 1 1 13 8  24 o 5.0833 1.3439 15.199   13.311  73.504    38.049  7.0680    14.209  6.8989 2.3264 3.2678 1.3464 3.631050       2.687871  
1 1 1 13 8  25 o 3.8072 1.1968 7.6256   12.430  27.648    35.968  4.9100    13.246  4.6284 2.0292 2.9860 1.2694 1.642429       2.393552  
1 1 1 13 8  26 o 3.6375 1.2196 -3.0323  12.960  39.980    42.342  -7.4787   13.614  4.8459 2.1593 2.4291 1.1344 2.416818       2.439129  
1 1 1 13 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 8  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 9  0  o 15.257 0.8891 243.994  26.435  208.289   37.250  280.219   37.520  14.055 1.3540 16.459 1.1528 -0.000000      0.000000  
1 1 1 13 9  1  o 9.5174 0.7579 94.464   14.288  107.849   20.064  80.694    20.351  10.233 0.9804 8.8018 1.1561 1.431310       1.515770  
1 1 1 13 9  2  o 6.6186 0.9897 48.536   12.670  53.639    17.327  42.673    18.573  7.0463 1.2765 6.1909 1.5129 0.8554187      1.979478  
1 1 1 13 9  3  o 9.4014 0.7565 92.945   14.024  103.673   19.144  80.522    20.600  10.030 0.9544 8.7729 1.1741 1.257053       1.513028  
1 1 1 13 9  4  o 7.9710 0.8307 66.279   13.231  62.757    18.303  70.134    19.150  7.7478 1.1812 8.1943 1.1685 -0.4465704     1.661465  
1 1 1 13 9  5  o 6.4714 1.0128 46.090   12.792  52.357    17.993  39.685    18.191  6.9530 1.3425 5.9898 1.5169 0.9631538      2.025675  
1 1 1 13 9  6  o 23.274 0.5590 553.691  25.950  515.511   37.059  590.422   36.349  22.465 0.8248 24.083 0.7547 -1.618181      1.117974  
1 1 1 13 9  7  o 4.3723 1.0438 20.048   10.956  15.546    16.538  23.569    14.626  4.0999 1.5188 4.6447 1.4322 -0.5448222     2.087569  
1 1 1 13 9  8  o 3.8787 1.1370 6.1294   12.954  14.589    25.224  3.0993    15.096  4.5097 1.8176 3.2477 1.3666 1.261982       2.274002  
1 1 1 13 9  9  o 10.642 0.7190 118.238  15.248  132.448   22.023  105.154   21.132  11.274 0.9767 10.011 1.0554 1.262418       1.438039  
1 1 1 13 9  10 f 12.094 0.6657 151.844  16.087  152.941   23.296  150.843   22.241  12.126 0.9606 12.061 0.9220 0.6517982E-01  1.331469  
1 1 1 13 9  11 o 4.0042 1.0583 14.509   11.596  19.884    16.377  9.1057    16.420  4.3558 1.5242 3.6527 1.4685 0.7031651      2.116528  
1 1 1 13 9  12 o 9.1990 0.8145 90.568   14.752  112.045   21.509  71.491    20.271  10.282 1.0460 8.1161 1.2488 2.165828       1.628984  
1 1 1 13 9  13 o 10.341 0.7638 113.578  15.777  113.415   22.878  113.727   21.785  10.318 1.1086 10.364 1.0510 -0.4642200E-01 1.527628  
1 1 1 13 9  14 o 4.5798 1.1237 23.301   12.582  27.126    18.501  20.009    17.161  4.8397 1.6222 4.3199 1.5555 0.5197701      2.247478  
1 1 1 13 9  15 o 4.7494 1.0653 23.405   13.183  2.5287    18.950  42.981    18.351  3.4526 1.4937 6.0461 1.5194 -2.593557      2.130659  
1 1 1 13 9  16 o 11.175 0.7822 132.499  17.378  153.013   25.284  114.132   23.925  12.025 1.0513 10.325 1.1586 1.700281       1.564424  
1 1 1 13 9  17 o 3.3250 1.0112 1.2584   12.257  8.1712    18.030  -4.6813   16.713  3.6731 1.5154 2.9768 1.3392 0.6963062      2.022321  
1 1 1 13 9  18 o 8.8450 0.8758 85.723   15.274  76.634    22.666  93.283    20.672  8.3408 1.3587 9.3492 1.1055 -1.008321      1.751682  
1 1 1 13 9  19 o 5.7462 1.1461 39.226   13.779  34.275    21.360  42.755    18.034  5.4054 1.7395 6.0869 1.4927 -0.6814604     2.292184  
1 1 1 13 9  20 o 3.4618 1.0478 3.5228   12.667  2.7290    20.379  4.0225    16.171  3.5892 1.5509 3.3343 1.4093 0.2548411      2.095594  
1 1 1 13 9  21 o 8.3671 1.0158 84.985   15.336  53.894    24.135  106.037   19.860  6.6887 1.7748 10.045 0.9885 -3.356607      2.031554  
1 1 1 13 9  22 o 17.180 0.8310 315.757  22.476  330.814   50.870  312.105   25.053  16.986 1.4974 17.374 0.7210 -0.3878269     1.661954  
1 1 1 13 9  23 o 10.480 1.1386 121.358  17.237  145.694   42.261  116.502   18.879  10.467 2.0918 10.492 0.8997 -0.2413464E-01 2.277111  
1 1 1 13 9  24 o 5.7481 1.2640 42.766   13.560  43.752    36.825  42.611    14.585  5.4605 2.1977 6.0357 1.2494 -0.5752296     2.528059  
1 1 1 13 9  25 o 4.6548 1.0309 33.030   12.735  -40.5741  41.054  40.867    13.396  3.4327 1.6904 5.8770 1.1807 -2.444253      2.061877  
1 1 1 13 9  26 o 6.3574 1.3091 59.116   14.650  79.175    39.787  55.970    15.757  5.9666 2.3208 6.7483 1.2121 -0.7816849     2.618255  
1 1 1 13 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 10 0  o 3.9525 1.4182 16.581   17.556  43.664    24.898  -10.1970  24.757  5.4127 2.2810 2.4924 1.6860 -0.000000      0.000000  
1 1 1 13 10 1  f 5.3367 1.0812 30.393   13.010  45.759    18.436  15.150    18.362  6.4531 1.4623 4.2203 1.5929 2.232891       2.162299  
1 1 1 13 10 2  o 4.3377 1.1072 17.496   12.448  21.948    17.385  12.814    17.831  4.6315 1.5725 4.0440 1.5590 0.5874267      2.214311  
1 1 1 13 10 3  o 13.355 0.6456 183.420  17.198  191.820   23.873  174.357   24.798  13.688 0.8720 13.021 0.9522 0.6669645      1.291149  
1 1 1 13 10 4  o 5.5309 1.0561 33.538   12.854  16.796    18.021  50.878    18.341  4.2689 1.5847 6.7928 1.3967 -2.523916      2.112293  
1 1 1 13 10 5  o 4.5590 1.0834 20.377   12.376  32.709    17.816  8.8789    17.204  5.3903 1.5621 3.7278 1.5015 1.662486       2.166736  
1 1 1 13 10 6  o 3.7779 1.0356 10.406   11.412  16.423    16.113  4.3496    16.165  4.1488 1.5052 3.4069 1.4226 0.7418313      2.071105  
1 1 1 13 10 7  o 10.166 0.7372 108.051  14.988  107.405   21.083  108.711   21.312  10.136 1.0400 10.195 1.0452 -0.5921936E-01 1.474485  
1 1 1 13 10 8  o 3.6262 1.0311 8.6893   11.402  9.3455    17.018  8.1548    15.358  3.7191 1.4950 3.5333 1.4203 0.1858122      2.062112  
1 1 1 13 10 9  o 7.8186 0.9325 67.856   13.929  55.352    20.418  78.741    19.050  6.9913 1.5048 8.6460 1.1017 -1.654783      1.864994  
1 1 1 13 10 10 o 11.532 0.9020 128.951  19.231  186.040   36.750  107.422   22.568  13.010 1.4124 10.055 1.1223 2.955509       1.803975  
1 1 1 13 10 11 o 3.3758 0.9978 5.2959   11.256  4.6062    16.458  5.9019    15.428  3.3805 1.4249 3.3710 1.3972 0.9518623E-02  1.995619  
1 1 1 13 10 12 o 3.3310 0.9800 -0.8916  11.762  16.460    17.410  -15.4596  15.953  4.1321 1.5529 2.5299 1.1959 1.602222       1.959994  
1 1 1 13 10 13 o 15.471 0.6426 251.021  19.843  273.979   28.643  229.833   27.516  16.169 0.8858 14.773 0.9313 1.395454       1.285247  
1 1 1 13 10 14 o 10.463 0.7669 117.155  16.016  108.429   22.490  126.136   22.815  10.045 1.1194 10.881 1.0484 -0.8356791     1.533706  
1 1 1 13 10 15 o 13.909 0.6702 204.004  18.499  183.057   26.815  223.025   25.553  13.175 1.0176 14.643 0.8725 -1.468004      1.340450  
1 1 1 13 10 16 o 4.7027 1.1432 24.655   13.103  20.633    19.393  28.032    17.773  4.4643 1.6465 4.9410 1.5864 -0.4767418     2.286383  
1 1 1 13 10 17 o 3.6929 1.0663 8.6028   12.737  1.1634    19.156  14.499    17.053  3.4147 1.4894 3.9710 1.5263 -0.5563712     2.132571  
1 1 1 13 10 18 o 8.2663 0.9091 73.965   14.981  72.947    21.957  74.851    20.492  8.1855 1.3412 8.3470 1.2275 -0.1615601     1.818136  
1 1 1 13 10 19 o 8.6604 0.9508 85.878   15.302  65.779    23.237  101.265   20.332  7.5264 1.5934 9.7944 1.0379 -2.268006      1.901610  
1 1 1 13 10 20 o 3.7698 1.0977 9.0291   13.320  2.6913    21.798  12.806    16.827  3.6747 1.5959 3.8650 1.5077 -0.1902564     2.195438  
1 1 1 13 10 21 o 12.387 0.8218 174.712  19.083  124.084   29.164  212.616   25.234  10.534 1.3843 14.240 0.8860 -3.706779      1.643598  
1 1 1 13 10 22 o 9.9495 0.9082 112.311  17.442  98.860    27.256  121.640   22.699  9.2789 1.4687 10.620 1.0687 -1.341329      1.816377  
1 1 1 13 10 23 o 2.8597 0.9358 -6.6715  11.336  -6.5656   21.519  -6.7121   13.336  3.2091 1.4729 2.5103 1.1549 0.6988540      1.871690  
1 1 1 13 10 24 o 6.3288 1.1419 68.090   15.414  14.353    43.895  75.649    16.463  4.4164 2.0539 8.2412 0.9988 -3.824792      2.283887  
1 1 1 13 10 25 o 5.1613 1.2515 40.002   14.513  33.399    39.273  41.046    15.619  4.6713 2.0807 5.6514 1.3912 -0.9801059     2.502916  
1 1 1 13 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 11 0  o 3.7417 1.4963 17.594   18.667  33.903    26.442  1.3881    26.358  4.5665 2.3174 2.9169 1.8934 -0.000000      0.000000  
1 1 1 13 11 1  o 9.1914 0.8129 88.753   14.923  87.126    21.544  90.255    20.690  9.0970 1.1841 9.2857 1.1141 -0.1886806     1.625839  
1 1 1 13 11 2  o 10.100 0.7631 106.971  15.289  92.498    21.713  121.206   21.533  9.3872 1.1565 10.812 0.9958 -1.424794      1.526159  
1 1 1 13 11 3  o 3.0571 0.9412 -5.0971  11.401  7.7221    16.403  -17.0788  15.858  3.6120 1.4622 2.5022 1.1857 1.109760       1.882489  
1 1 1 13 11 4  o 5.2437 1.0892 30.789   12.182  29.109    17.056  32.540    17.406  5.1094 1.5409 5.3779 1.5398 -0.2684598     2.178379  
1 1 1 13 11 5  o 3.4965 0.9907 2.4157   11.628  -12.2629  15.937  19.125    17.004  2.6512 1.2345 4.3418 1.5499 -1.690563      1.981466  
1 1 1 13 11 6  o 11.337 0.7090 134.147  16.030  121.117   22.320  148.028   23.037  10.752 1.0380 11.923 0.9661 -1.170977      1.418022  
1 1 1 13 11 7  o 4.8135 1.0969 25.367   12.200  31.275    17.244  19.446    17.262  5.2532 1.5410 4.3738 1.5616 0.8793821      2.193890  
1 1 1 13 11 8  o 7.2995 0.9300 59.542   13.016  46.696    18.938  71.042    17.919  6.3941 1.5057 8.2049 1.0920 -1.810824      1.860020  
1 1 1 13 11 9  o 6.3996 1.0383 48.440   13.766  27.797    20.256  66.154    18.764  4.9569 1.6973 7.8424 1.1963 -2.885531      2.076522  
1 1 1 13 11 10 o 3.8107 1.0583 11.472   12.134  3.4561    18.482  17.544    16.086  3.4773 1.4894 4.1441 1.5039 -0.6668646     2.116605  
1 1 1 13 11 11 o 9.3746 0.8101 93.850   15.152  99.422    22.390  89.142    20.582  9.6203 1.1637 9.1288 1.1273 0.4915323      1.620165  
1 1 1 13 11 12 o 6.4595 1.0771 48.841   13.648  52.479    20.279  45.829    18.451  6.6669 1.5502 6.2521 1.4957 0.4148383      2.154114  
1 1 1 13 11 13 o 3.9258 1.1007 12.734   12.762  15.026    19.449  11.001    16.913  4.1067 1.6153 3.7449 1.4957 0.3618522      2.201432  
1 1 1 13 11 14 o 3.6693 1.0610 7.7682   12.484  13.593    18.150  2.5386    17.198  3.9946 1.5637 3.3440 1.4346 0.6505919      2.122090  
1 1 1 13 11 15 o 9.1366 0.8477 89.976   15.477  94.639    21.981  85.392    21.795  9.3867 1.1708 8.8866 1.2263 0.5000553      1.695493  
1 1 1 13 11 16 o 5.4004 1.1163 33.506   13.450  48.358    19.608  20.307    18.485  6.4087 1.5473 4.3922 1.6094 2.016541       2.232534  
1 1 1 13 11 17 o 5.2514 1.1578 29.959   13.687  43.575    21.169  20.178    17.941  6.0834 1.6831 4.4194 1.5905 1.664031       2.315682  
1 1 1 13 11 18 o 6.2225 1.1454 45.632   14.380  43.588    21.331  47.334    19.468  6.0578 1.6943 6.3871 1.5416 -0.3293142     2.290705  
1 1 1 13 11 19 o 5.3331 1.1943 33.716   14.323  30.559    21.521  36.227    19.191  5.1315 1.7495 5.5347 1.6263 -0.4031639     2.388604  
1 1 1 13 11 20 o 5.3908 1.2935 34.890   16.576  26.798    29.047  38.798    20.185  5.0712 1.9801 5.7105 1.6649 -0.6393523     2.587051  
1 1 1 13 11 21 o 12.555 0.7668 172.661  18.719  155.292   29.077  184.953   24.461  11.882 1.2236 13.228 0.9246 -1.345542      1.533658  
1 1 1 13 11 22 o 6.9725 1.0877 55.389   14.233  72.527    24.423  46.576    17.514  7.6824 1.6395 6.2626 1.4297 1.419876       2.175325  
1 1 1 13 11 23 o 7.5877 1.1380 70.659   16.240  87.958    27.226  61.105    20.234  8.1772 1.7193 6.9983 1.4913 1.178913       2.275936  
1 1 1 13 11 24 o 2.6424 0.9003 -19.7092 11.866  0.2867    22.385  -27.5236  13.994  3.3476 1.5234 1.9372 0.9600 1.410344       1.800666  
1 1 1 13 11 25 o 3.5979 1.0235 12.565   13.496  -22.0599  25.336  26.281    15.946  2.8505 1.3875 4.3454 1.5050 -1.494839      2.046983  
1 1 1 13 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 11 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 12 0  o 3.6510 1.4381 9.3008   19.091  40.562    27.206  -21.0279  26.797  4.9820 2.3801 2.3199 1.6150 -0.000000      0.000000  
1 1 1 13 12 1  o 8.1881 0.9519 73.444   14.909  93.369    21.652  55.476    20.561  9.3874 1.1532 6.9887 1.5147 2.398707       1.903756  
1 1 1 13 12 2  o 13.664 0.6544 194.000  17.839  210.281   25.343  178.010   25.116  14.252 0.8891 13.075 0.9604 1.176253       1.308801  
1 1 1 13 12 3  o 5.1975 1.1404 30.585   13.190  26.204    18.951  34.701    18.369  4.8866 1.6418 5.5083 1.5832 -0.6217437     2.280806  
1 1 1 13 12 4  f 4.1980 1.1311 15.683   13.213  12.914    18.608  18.499    18.764  4.0256 1.5811 4.3703 1.6180 -0.3447156     2.262286  
1 1 1 13 12 5  o 12.769 0.6870 169.334  17.476  149.592   24.067  191.350   25.416  11.966 1.0056 13.572 0.9363 -1.606199      1.374055  
1 1 1 13 12 6  o 4.7992 1.0564 23.257   12.597  5.8919    17.526  41.817    18.118  3.5563 1.4828 6.0422 1.5050 -2.485872      2.112716  
1 1 1 13 12 7  f 9.8160 0.7814 102.666  15.308  96.805    21.865  108.300   21.438  9.5171 1.1487 10.115 1.0597 -0.5978260     1.562893  
1 1 1 13 12 8  o 12.026 0.7195 153.214  17.233  168.557   24.377  137.887   24.364  12.664 0.9625 11.389 1.0696 1.274729       1.438927  
1 1 1 13 12 9  f 3.0714 0.9716 -4.5501  12.288  0.3825    17.974  -8.8783   16.837  3.3062 1.4423 2.8367 1.3023 0.4694989      1.943288  
1 1 1 13 12 10 o 3.5592 1.0588 5.2473   12.903  11.318    18.911  -0.0399   17.649  3.8777 1.5699 3.2407 1.4211 0.6369452      2.117581  
1 1 1 13 12 11 o 9.4314 0.8319 96.680   15.597  88.825    22.587  103.838   21.563  9.0158 1.2527 9.8471 1.0949 -0.8313150     1.663703  
1 1 1 13 12 12 o 4.5548 1.1188 20.334   13.027  35.714    19.932  8.8658    17.211  5.4640 1.6697 3.6455 1.4895 1.818490       2.237545  
1 1 1 13 12 13 o 3.6214 1.0515 3.2731   13.007  18.990    19.197  -10.0646  17.685  4.3669 1.6327 2.8759 1.3256 1.491038       2.103049  
1 1 1 13 12 14 o 4.3340 1.0581 13.183   12.914  38.469    19.622  -6.1353   17.151  5.7035 1.6355 2.9646 1.3430 2.738863       2.116236  
1 1 1 13 12 15 o 5.9468 1.1835 43.005   15.129  31.070    21.955  53.796    20.877  5.1440 1.7668 6.7495 1.5753 -1.605488      2.367084  
1 1 1 13 12 16 o 3.2556 1.0182 -2.2608  13.118  -6.8866   19.685  1.4342    17.594  3.1745 1.4384 3.3366 1.4414 -0.1621268     2.036334  
1 1 1 13 12 17 o 9.5865 0.8530 100.062  16.101  84.411    23.355  114.239   22.229  8.7912 1.3283 10.382 1.0705 -1.590714      1.706025  
1 1 1 13 12 18 o 11.603 0.7955 143.586  18.429  149.142   27.036  138.764   25.187  11.798 1.1458 11.407 1.1040 0.3906307      1.591085  
1 1 1 13 12 19 o 7.3630 1.0740 63.385   15.415  49.211    23.051  74.852    20.733  6.4036 1.7500 8.3225 1.2456 -1.918905      2.148038  
1 1 1 13 12 20 o 14.095 0.7300 214.156  20.367  185.346   29.274  241.184   28.354  13.090 1.1182 15.101 0.9388 -2.011498      1.460057  
1 1 1 13 12 21 o 4.7792 1.2094 26.214   14.375  31.205    23.020  23.023    18.405  5.0609 1.8037 4.4976 1.6117 0.5633440      2.418894  
1 1 1 13 12 22 o 12.389 0.7929 171.736  19.237  158.724   29.511  181.352   25.368  11.834 1.2468 12.944 0.9799 -1.109952      1.585812  
1 1 1 13 12 23 o 11.184 0.9680 157.156  19.453  115.063   30.085  187.397   25.500  9.3509 1.6700 13.018 0.9795 -3.666698      1.935996  
1 1 1 13 12 24 o 4.0747 1.0162 19.983   13.519  -20.8037  24.907  37.016    16.096  2.8939 1.4009 5.2555 1.4725 -2.361595      2.032375  
1 1 1 13 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 13 0  f 3.7258 1.5369 20.495   18.970  20.974    25.630  19.915    28.211  3.7244 2.1444 3.7271 2.2024 -0.000000      0.000000  
1 1 1 13 13 1  o 8.6703 0.9100 82.582   15.165  72.881    22.425  90.757    20.586  8.0718 1.4420 9.2689 1.1105 -1.197116      1.820092  
1 1 1 13 13 2  o 9.9088 0.8166 104.217  16.037  122.894   23.199  87.123    22.194  10.798 1.0742 9.0198 1.2303 1.778123       1.633294  
1 1 1 13 13 3  o 4.7676 1.1625 24.120   13.864  15.094    19.521  33.304    19.693  4.1714 1.6248 5.3638 1.6631 -1.192321      2.325061  
1 1 1 13 13 4  f 8.7924 0.8984 83.654   15.766  76.871    21.961  90.867    22.649  8.4057 1.3063 9.1791 1.2337 -0.7734137     1.796794  
1 1 1 13 13 5  o 6.5190 1.1176 49.940   14.459  54.723    20.302  45.017    20.597  6.8766 1.5168 6.1613 1.6418 0.7153425      2.235261  
1 1 1 13 13 6  o 5.8536 1.1138 40.963   13.441  34.067    20.516  46.148    17.791  5.3691 1.7024 6.3382 1.4367 -0.9691453     2.227592  
1 1 1 13 13 7  o 17.503 0.6174 318.583  21.602  333.007   30.943  304.870   30.171  17.896 0.8645 17.110 0.8817 0.7858429      1.234796  
1 1 1 13 13 8  o 5.8027 1.1250 39.775   13.436  40.735    19.466  38.901    18.569  5.8604 1.6109 5.7450 1.5710 0.1153579      2.250081  
1 1 1 13 13 9  o 6.0061 1.0956 43.615   13.611  31.455    19.990  54.126    18.584  5.1473 1.6848 6.8648 1.4010 -1.717529      2.191189  
1 1 1 13 13 10 o 4.7508 1.0760 23.012   13.766  -1.1404   20.193  43.983    18.816  3.3937 1.5028 6.1080 1.5405 -2.714348      2.152089  
1 1 1 13 13 11 o 3.5360 1.0435 5.3108   12.690  -4.0769   19.122  12.698    16.963  3.2081 1.4387 3.8638 1.5119 -0.6557069     2.087048  
1 1 1 13 13 12 o 7.9754 1.0308 72.206   15.929  64.500    23.353  78.912    21.783  7.4267 1.6180 8.5241 1.2777 -1.097415      2.061649  
1 1 1 13 13 13 o 6.8501 1.1384 54.854   15.275  60.317    22.887  50.465    20.512  7.1462 1.6366 6.5540 1.5827 0.5921750      2.276702  
1 1 1 13 13 14 o 3.7213 1.0672 3.5834   13.130  23.326    20.506  -10.1365  17.094  4.6391 1.6958 2.8036 1.2961 1.835454       2.134400  
1 1 1 13 13 15 o 5.7834 1.2086 39.257   14.953  42.733    21.738  36.135    20.600  6.0089 1.7209 5.5580 1.6973 0.4508419      2.417119  
1 1 1 13 13 16 o 5.9035 1.1946 41.221   14.878  46.824    21.497  36.070    20.612  6.2778 1.6794 5.5292 1.6994 0.7485785      2.389171  
1 1 1 13 13 17 o 5.0924 1.4614 13.441   18.718  3.9351    20.688  56.354    43.956  3.6594 1.5718 6.5253 2.4642 -2.865882      2.922788  
1 1 1 13 13 18 o 5.0084 1.1903 28.181   14.852  15.252    22.157  38.731    20.015  4.2867 1.7120 5.7301 1.6543 -1.443444      2.380651  
1 1 1 13 13 19 o 3.9165 1.0761 10.923   13.652  -10.6080  21.625  25.190    17.604  3.1567 1.4588 4.6764 1.5823 -1.519773      2.152183  
1 1 1 13 13 20 o 6.0022 1.1978 43.034   15.689  64.276    23.679  26.413    20.946  7.2404 1.6694 4.7640 1.7181 2.476402       2.395526  
1 1 1 13 13 21 o 3.9561 1.1658 12.632   15.216  10.944    23.547  13.842    19.938  3.9682 1.6899 3.9439 1.6063 0.2435327E-01  2.331569  
1 1 1 13 13 22 o 3.8586 1.1070 15.645   13.797  4.4549    22.896  22.025    17.290  3.5258 1.5782 4.1914 1.5529 -0.6656349     2.214094  
1 1 1 13 13 23 o 3.9518 1.1657 17.362   15.115  18.340    23.984  16.717    19.467  4.0399 1.7124 3.8638 1.5820 0.1760559      2.331365  
1 1 1 13 13 24 o 3.7605 1.1333 8.3715   14.762  37.948    25.607  -6.3516   18.067  4.7498 1.8579 2.7712 1.2982 1.978581       2.266521  
1 1 1 13 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 13 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 14 0  o 2.9796 1.3715 2.5951   19.711  4.0784    28.766  1.2821    27.063  3.0634 1.9846 2.8959 1.8936 -0.000000      0.000000  
1 1 1 13 14 1  o 4.1533 1.1602 14.661   14.268  11.713    19.770  17.865    20.611  3.9660 1.6053 4.3405 1.6754 -0.3745394     2.320349  
1 1 1 13 14 2  o 9.3785 0.8405 94.783   15.763  95.760    22.539  93.848    22.053  9.4215 1.1961 9.3354 1.1811 0.8603573E-01  1.681026  
1 1 1 13 14 3  f 6.3817 1.1441 48.237   14.676  43.162    20.893  53.179    20.620  6.0148 1.6749 6.7486 1.5591 -0.7338562     2.288241  
1 1 1 13 14 4  o 4.4493 1.0914 16.371   13.872  38.250    19.609  -5.5496   19.628  5.6944 1.6355 3.2043 1.4455 2.490060       2.182719  
1 1 1 13 14 5  o 4.1058 1.1107 12.160   13.737  27.567    19.755  -2.2638   19.114  4.9271 1.6762 3.2844 1.4579 1.642707       2.221475  
1 1 1 13 14 6  o 6.4300 1.1131 48.775   14.507  64.171    21.074  34.910    19.999  7.4583 1.4651 5.4016 1.6762 2.056618       2.226232  
1 1 1 13 14 7  o 11.091 0.8019 132.954  17.731  124.650   25.445  140.792   24.722  10.714 1.1874 11.467 1.0780 -0.7526360     1.603748  
1 1 1 13 14 8  o 6.9431 1.1104 56.649   15.208  71.921    22.117  42.954    20.945  7.9213 1.4495 5.9649 1.6827 1.956377       2.220884  
1 1 1 13 14 9  o 6.5307 1.1179 51.401   14.941  33.815    21.412  68.090    20.859  5.3238 1.7437 7.7375 1.3994 -2.413738      2.235825  
1 1 1 13 14 10 o 8.1243 1.0099 73.846   16.069  77.420    23.016  70.447    22.446  8.3912 1.3714 7.8574 1.4827 0.5338478      2.019715  
1 1 1 13 14 11 o 5.4899 1.2183 35.740   14.936  32.749    22.055  38.275    20.299  5.2953 1.7712 5.6845 1.6732 -0.3892031     2.436563  
1 1 1 13 14 12 o 9.0234 0.9588 92.401   16.308  114.250   22.753  69.320    23.385  10.340 1.1002 7.7069 1.5705 2.633171       1.917511  
1 1 1 13 14 13 o 4.0535 1.1564 12.794   14.473  15.065    20.667  10.608    20.274  4.1787 1.6583 3.9283 1.6122 0.2503958      2.312770  
1 1 1 13 14 14 o 5.3133 1.2073 32.664   14.609  29.430    21.452  35.461    19.950  5.1088 1.7467 5.5178 1.6670 -0.4089580     2.414508  
1 1 1 13 14 15 o 2.9544 0.9208 -19.4721 13.226  -63.8707  20.553  11.910    17.280  2.0580 1.0397 3.8508 1.5200 -1.792734      1.841585  
1 1 1 13 14 16 o 9.7736 0.9075 104.134  17.540  102.821   26.694  105.131   23.268  9.6556 1.3823 9.8916 1.1762 -0.2360125     1.814971  
1 1 1 13 14 17 o 6.7287 1.2059 53.718   16.187  56.879    24.178  51.150    21.791  6.8828 1.7520 6.5745 1.6576 0.3082762      2.411876  
1 1 1 13 14 18 o 9.0888 1.0464 99.622   17.427  65.508    25.891  127.878   23.563  7.2652 1.7928 10.912 1.0797 -3.647273      2.092825  
1 1 1 13 14 19 o 8.3549 1.4263 59.587   23.242  23.040    26.269  191.306   49.870  4.7011 1.8683 12.009 2.1556 -7.307647      2.852572  
1 1 1 13 14 20 o 4.2711 1.2034 14.844   16.040  32.394    24.325  1.3410    21.336  5.0619 1.8475 3.4802 1.5427 1.581653       2.406891  
1 1 1 13 14 21 f 6.4184 1.1537 64.435   18.416  15.927    32.973  86.425    22.201  4.2847 1.9076 8.5521 1.2980 -4.267423      2.307341  
1 1 1 13 14 22 f 4.1006 1.1967 19.439   15.841  17.961    24.590  20.488    20.711  4.0808 1.7321 4.1205 1.6518 -0.3976822E-01 2.393425  
1 1 1 13 14 23 o 3.8506 1.1449 13.937   14.762  33.061    24.371  2.8548    18.552  4.5733 1.8052 3.1279 1.4087 1.445476       2.289805  
1 1 1 13 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 14 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 15 0  o 5.0345 1.5721 35.492   21.801  72.163    31.112  0.1156    30.558  7.0669 2.4425 3.0021 1.9800 -0.000000      0.000000  
1 1 1 13 15 1  o 9.8065 0.8882 105.042  17.376  95.547    24.193  115.158   24.971  9.3210 1.2978 10.292 1.2131 -0.9709911     1.776479  
1 1 1 13 15 2  o 4.2488 1.1383 12.841   14.674  -5.0642   20.139  33.103    21.423  3.2369 1.4618 5.2607 1.7452 -2.023834      2.276560  
1 1 1 13 15 3  o 6.8865 1.0976 55.842   14.748  60.023    21.449  52.093    20.310  7.1404 1.5467 6.6325 1.5577 0.5079417      2.195122  
1 1 1 13 15 4  o 6.1984 1.1174 44.898   14.885  23.714    20.358  69.227    21.817  4.6469 1.6910 7.7498 1.4612 -3.102925      2.234864  
1 1 1 13 15 5  o 7.3548 1.0596 62.318   15.025  56.254    20.356  69.575    22.269  6.9480 1.5082 7.7616 1.4887 -0.8136077     2.119136  
1 1 1 13 15 6  o 7.2469 1.0613 61.151   14.846  59.363    21.719  62.719    20.339  7.0971 1.5716 7.3967 1.4266 -0.2996736     2.122531  
1 1 1 13 15 7  o 5.8704 1.2068 41.596   15.016  41.695    21.221  41.495    21.249  5.8778 1.7053 5.8630 1.7080 0.1479578E-01  2.413518  
1 1 1 13 15 8  o 4.1599 1.1565 14.554   14.166  19.255    20.497  10.255    19.601  4.4284 1.6802 3.8914 1.5897 0.5370498      2.313052  
1 1 1 13 15 9  o 3.7168 0.9921 -8.9200  13.919  -50.8686  19.752  32.464    19.619  2.1588 1.0808 5.2748 1.6639 -3.116009      1.984143  
1 1 1 13 15 10 o 6.9242 1.0884 57.473   15.538  31.264    22.543  81.195    21.447  5.1931 1.7899 8.6553 1.2390 -3.462251      2.176893  
1 1 1 13 15 11 o 3.1715 0.9882 -10.0006 13.756  -35.1811  20.224  11.675    18.764  2.4526 1.2035 3.8904 1.5677 -1.437793      1.976396  
1 1 1 13 15 12 o 5.8835 1.1820 42.277   15.298  26.708    23.371  53.949    20.236  4.9404 1.8097 6.8266 1.5211 -1.886204      2.364037  
1 1 1 13 15 13 o 9.0755 1.0048 91.743   17.459  113.370   25.161  71.660    24.247  10.271 1.2249 7.8799 1.5933 2.391195       2.009682  
1 1 1 13 15 14 o 12.839 0.7617 174.879  19.534  170.514   28.106  178.958   27.169  12.662 1.1099 13.017 1.0436 -0.3548069     1.523460  
1 1 1 13 15 15 o 8.8636 1.0470 90.003   17.773  78.056    26.375  99.940    24.056  8.1322 1.6773 9.5949 1.2536 -1.462705      2.093996  
1 1 1 13 15 16 o 8.3139 1.0554 78.226   17.096  74.731    24.944  81.321    23.476  8.0182 1.6114 8.6097 1.3634 -0.5915155     2.110773  
1 1 1 13 15 17 o 8.5995 1.0489 84.973   17.614  85.194    25.794  84.781    24.110  8.5053 1.5743 8.6937 1.3866 -0.1884022     2.097899  
1 1 1 13 15 18 o 4.8251 1.1750 24.318   16.552  -7.0253   25.732  46.439    21.618  3.5355 1.6183 6.1148 1.7041 -2.579371      2.350016  
1 1 1 13 15 19 o 7.3476 1.1860 66.074   18.059  98.066    26.974  40.084    24.312  9.1596 1.4725 5.5356 1.8596 3.623979       2.371991  
1 1 1 13 15 20 o 4.0642 1.2004 15.815   16.148  17.588    24.674  14.487    21.357  4.1858 1.7535 3.9425 1.6397 0.2432678      2.400717  
1 1 1 13 15 21 o 5.8202 1.4510 58.430   22.293  63.644    24.600  34.476    52.726  6.7090 1.7972 4.9314 2.2786 1.777556       2.902082  
1 1 1 13 15 22 o 2.9986 0.9927 -17.1000 14.855  14.867    23.746  -37.6516  19.040  3.8195 1.6622 2.1777 1.0858 1.641748       1.985466  
1 1 1 13 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 0  f 6.3818 1.5857 59.934   21.518  91.970    31.220  30.941    29.700  8.5207 2.1169 4.2429 2.3614 -0.000000      0.000000  
1 1 1 13 16 1  o 4.4120 1.1883 18.777   14.747  11.720    20.384  26.528    21.362  3.9773 1.6226 4.8467 1.7365 -0.8693678     2.376547  
1 1 1 13 16 2  o 4.9733 1.2405 27.699   15.757  18.279    22.099  37.442    22.473  4.3950 1.7240 5.5516 1.7840 -1.156538      2.480938  
1 1 1 13 16 3  o 15.278 0.6815 246.148  20.822  250.593   29.552  241.766   29.344  15.420 0.9582 15.137 0.9693 0.2829723      1.362989  
1 1 1 13 16 4  o 7.1977 1.1099 60.193   15.566  73.361    22.912  48.906    21.212  7.9924 1.4881 6.4030 1.6470 1.589419       2.219734  
1 1 1 13 16 5  o 9.2572 0.9627 95.313   17.130  114.058   24.491  77.359    23.969  10.297 1.1892 8.2170 1.5143 2.080220       1.925399  
1 1 1 13 16 6  o 10.635 0.8636 122.666  18.201  138.528   25.524  106.258   25.961  11.400 1.1195 9.8692 1.3152 1.531078       1.727147  
1 1 1 13 16 7  o 5.5386 1.1946 35.814   15.365  20.123    22.073  50.565    21.402  4.5354 1.7381 6.5418 1.6392 -2.006459      2.389105  
1 1 1 13 16 8  o 3.0175 0.9924 -14.2767 14.539  -6.9638   21.150  -20.8284  20.019  3.2716 1.4857 2.7635 1.3160 0.5080795      1.984725  
1 1 1 13 16 9  o 4.0422 1.1439 10.197   15.048  -5.4678   21.674  24.775    20.908  3.3480 1.5138 4.7363 1.7152 -1.388355      2.287720  
1 1 1 13 16 10 o 7.4668 1.1384 65.072   16.513  77.503    24.363  54.508    22.458  8.1811 1.5456 6.7525 1.6718 1.428569       2.276800  
1 1 1 13 16 11 f 10.617 0.8490 120.748  18.014  119.726   25.911  121.705   25.061  10.558 1.2271 10.676 1.1737 -0.1182804     1.698033  
1 1 1 13 16 12 o 8.9555 0.9619 87.377   17.166  95.052    25.640  81.144    23.108  9.2988 1.3787 8.6122 1.3416 0.6865330      1.923727  
1 1 1 13 16 13 o 4.8028 1.2580 24.307   16.010  25.048    23.568  23.672    21.816  4.8665 1.8111 4.7391 1.7466 0.1274519      2.516050  
1 1 1 13 16 14 o 15.160 0.7156 242.803  21.671  258.764   31.003  227.555   30.304  15.665 0.9896 14.655 1.0339 1.009657       1.431157  
1 1 1 13 16 15 o 10.188 0.9025 112.947  18.279  107.904   26.909  117.267   24.907  9.9248 1.3556 10.450 1.1917 -0.5256701     1.804938  
1 1 1 13 16 16 o 3.5358 1.1001 -5.6281  15.530  15.364    24.034  -20.6772  20.350  4.2996 1.7588 2.7720 1.3219 1.527565       2.200211  
1 1 1 13 16 17 o 8.8945 1.1595 102.902  19.252  55.184    29.038  140.332   25.718  6.4309 2.0238 11.358 1.1321 -4.927222      2.318906  
1 1 1 13 16 18 o 12.674 0.8576 179.139  21.652  175.814   31.810  182.010   29.556  12.499 1.2726 12.849 1.1501 -0.3501816     1.715284  
1 1 1 13 16 19 o 3.4122 1.0946 -2.8786  15.569  8.5478    25.701  -9.5027   19.569  3.8929 1.7108 2.9315 1.3660 0.9613998      2.189235  
1 1 1 13 16 20 o 6.0972 1.3168 52.894   17.516  66.587    26.984  42.922    23.028  6.7323 1.9137 5.4622 1.8093 1.270138       2.633531  
1 1 1 13 16 21 o 5.1794 1.3512 45.207   18.999  33.750    38.836  48.812    21.784  4.6256 2.0640 5.7332 1.7442 -1.107585      2.702332  
1 1 1 13 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 16 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 0  o 5.2453 1.7863 45.087   22.750  30.289    30.890  62.628    33.630  4.2547 2.3928 6.2359 2.6530 -0.000000      0.000000  
1 1 1 13 17 1  o 8.7055 0.9678 83.257   16.850  83.958    23.884  82.563    23.775  8.7436 1.3658 8.6674 1.3715 0.7615376E-01  1.935567  
1 1 1 13 17 2  o 8.8624 1.0042 88.842   16.933  68.052    24.003  109.435   23.890  7.6301 1.6229 10.095 1.1833 -2.464694      2.008429  
1 1 1 13 17 3  o 5.4657 1.1975 33.269   15.776  14.142    21.956  53.681    22.682  4.2161 1.6970 6.7152 1.6901 -2.499122      2.395052  
1 1 1 13 17 4  o 3.2436 1.0367 -7.4351  14.517  -15.1679  20.133  0.9392    20.951  2.9325 1.3727 3.5546 1.5538 -0.6221075     2.073328  
1 1 1 13 17 5  o 4.2239 1.1058 13.360   14.387  -10.0392  21.549  32.176    19.324  3.2035 1.4717 5.2443 1.6510 -2.040802      2.211698  
1 1 1 13 17 6  o 14.125 0.7151 211.178  20.197  208.247   28.689  214.059   28.438  14.019 1.0233 14.232 0.9991 -0.2129726     1.430138  
1 1 1 13 17 7  o 3.6978 1.0637 1.2330   13.843  24.126    20.358  -18.4544  18.879  4.6819 1.6930 2.7138 1.2881 1.968083       2.127306  
1 1 1 13 17 8  o 8.8354 1.0178 88.016   17.543  93.687    24.628  82.174    24.996  9.2316 1.3339 8.4392 1.5376 0.7924194      2.035564  
1 1 1 13 17 9  o 10.144 0.9162 111.947  18.407  95.110    25.986  128.900   26.076  9.3127 1.3952 10.975 1.1880 -1.662688      1.832443  
1 1 1 13 17 10 f 4.4526 1.2033 17.819   15.459  7.3595    22.113  27.820    21.621  3.9146 1.6510 4.9905 1.7511 -1.075872      2.406635  
1 1 1 13 17 11 o 3.0799 1.0014 -12.6466 14.585  -25.9758  21.621  -1.5170   19.757  2.7857 1.3375 3.3742 1.4907 -0.5885088     2.002779  
1 1 1 13 17 12 o 9.8814 0.9460 108.112  18.378  89.010    26.378  126.133   25.620  8.9288 1.4771 10.834 1.1824 -1.905027      1.892077  
1 1 1 13 17 13 o 9.4545 0.9726 98.864   18.359  93.181    26.045  104.476   25.882  9.1527 1.4228 9.7562 1.3265 -0.6035328     1.945200  
1 1 1 13 17 14 o 5.6167 1.2785 37.647   16.850  26.185    24.276  48.302    23.407  4.9252 1.8371 6.3083 1.7785 -1.383071      2.556945  
1 1 1 13 17 15 o 6.1333 1.3034 48.431   17.643  38.397    27.026  55.883    23.291  5.5354 1.9563 6.7312 1.7229 -1.195757      2.606816  
1 1 1 13 17 16 o 6.1053 1.2915 48.557   18.764  23.663    28.140  68.489    25.180  4.7747 1.9214 7.4358 1.7263 -2.661115      2.582979  
1 1 1 13 17 17 o 6.0370 1.2424 40.156   19.367  88.045    29.306  3.0278    25.804  8.2711 1.8209 3.8030 1.6907 4.468115       2.484777  
1 1 1 13 17 18 o 3.5177 1.1315 -2.8891  17.556  8.7979    25.835  -12.9156  23.930  3.8997 1.7145 3.1358 1.4769 0.7639253      2.262900  
1 1 1 13 17 19 o 8.9362 1.0942 101.094  19.154  106.916   28.126  96.060    26.156  9.2225 1.5249 8.6500 1.5697 0.5725727      2.188429  
1 1 1 13 17 20 o 6.0247 1.2310 56.341   18.075  26.928    26.895  80.570    24.409  4.3891 1.8340 7.6602 1.6425 -3.271121      2.462022  
1 1 1 13 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 17 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 0  o 4.0514 1.5944 23.062   21.167  44.237    30.176  2.5519    29.698  5.0598 2.4934 3.0431 1.9877 -0.000000      0.000000  
1 1 1 13 18 1  o 8.7192 1.0552 90.370   17.130  118.698   23.582  58.726    24.924  10.518 1.1211 6.9209 1.7879 3.596710       2.110334  
1 1 1 13 18 2  o 5.1969 1.2203 29.931   16.022  12.543    22.446  47.990    22.876  4.1288 1.6956 6.2649 1.7554 -2.136133      2.440621  
1 1 1 13 18 3  o 4.2067 1.2002 14.599   15.585  11.984    23.174  16.759    21.060  4.1376 1.7134 4.2758 1.6812 -0.1382728     2.400436  
1 1 1 13 18 4  o 6.2296 1.2397 47.472   17.242  67.128    24.126  26.952    24.651  7.5130 1.6507 4.9462 1.8499 2.566817       2.479346  
1 1 1 13 18 5  o 8.4636 1.1001 82.872   18.049  70.400    25.904  94.640    25.163  7.6626 1.7311 9.2647 1.3580 -1.602068      2.200221  
1 1 1 13 18 6  o 14.918 0.7127 234.153  21.231  251.707   30.343  217.314   29.718  15.486 0.9797 14.350 1.0355 1.136510       1.425470  
1 1 1 13 18 7  o 6.6619 1.2534 53.073   17.300  65.091    24.510  41.142    24.422  7.4521 1.6841 5.8717 1.8569 1.580399       2.506878  
1 1 1 13 18 8  o 15.498 0.7084 252.672  21.908  274.323   31.307  231.893   30.670  16.174 0.9678 14.822 1.0346 1.352369       1.416730  
1 1 1 13 18 9  f 4.3391 1.2171 15.291   16.030  7.3767    22.798  23.028    22.543  3.9545 1.6725 4.7238 1.7686 -0.7692597     2.434200  
1 1 1 13 18 10 o 5.0155 1.2649 27.069   16.299  37.227    23.844  18.158    22.332  5.5891 1.8405 4.4418 1.7357 1.147238       2.529867  
1 1 1 13 18 11 o 8.9175 1.0525 90.400   18.260  81.659    25.916  99.018    25.733  8.3605 1.6083 9.4745 1.3580 -1.113951      2.104971  
1 1 1 13 18 12 o 15.318 0.7317 247.809  22.399  258.964   31.706  236.696   31.648  15.681 1.0110 14.956 1.0580 0.7252560      1.463403  
1 1 1 13 18 13 o 12.061 0.8753 158.802  21.073  163.577   30.924  154.662   28.794  12.206 1.2668 11.917 1.2081 0.2891102      1.750501  
1 1 1 13 18 14 o 6.3236 1.3556 50.615   18.950  65.952    28.173  37.941    25.610  7.1461 1.9271 5.5011 1.9071 1.644965       2.711249  
1 1 1 13 18 15 o 5.1709 1.3100 28.301   18.866  54.226    27.722  5.9353    25.749  6.3905 1.9719 3.9513 1.7250 2.439253       2.619929  
1 1 1 13 18 16 o 4.1212 1.2472 7.0976   19.066  27.925    28.188  -10.4664  25.886  4.8559 1.9336 3.3865 1.5757 1.469432       2.494328  
1 1 1 13 18 17 o 4.9912 1.1833 24.294   18.616  -21.3204  26.872  66.385    25.813  3.0983 1.4886 6.8840 1.8397 -3.785701      2.366503  
1 1 1 13 18 18 f 4.4513 1.2584 24.262   18.039  7.6456    27.464  36.870    23.923  3.8403 1.7231 5.0623 1.8345 -1.221989      2.516816  
1 1 1 13 18 19 o 4.4137 1.1644 19.467   17.389  -18.0891  25.422  52.486    23.837  2.9829 1.4369 5.8445 1.8327 -2.861595      2.328788  
1 1 1 13 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 0  o 5.9599 1.6628 54.424   23.918  87.000    33.129  18.959    34.566  8.0964 2.3567 3.8234 2.3464 -0.000000      0.000000  
1 1 1 13 19 1  o 3.7271 1.1502 1.1732   16.262  5.5241    22.098  -3.9663   24.017  3.8434 1.6369 3.6107 1.6163 0.2327302      2.300428  
1 1 1 13 19 2  o 11.408 0.8544 140.097  19.272  116.962   27.165  163.540   27.345  10.390 1.3073 12.426 1.1003 -2.036244      1.708752  
1 1 1 13 19 3  o 8.2716 1.1215 77.548   18.104  63.239    24.870  93.680    26.406  7.3151 1.7275 9.2280 1.4308 -1.912827      2.243051  
1 1 1 13 19 4  o 4.6019 1.2609 19.179   16.646  12.628    22.545  27.032    24.682  4.1878 1.7072 5.0160 1.8560 -0.8281207     2.521774  
1 1 1 13 19 5  o 9.4295 1.0051 98.112   18.929  101.812   27.651  94.848    25.968  9.5829 1.4427 9.2761 1.3997 0.3068552      2.010132  
1 1 1 13 19 6  o 12.171 0.8620 159.756  20.874  179.098   29.773  141.057   29.274  12.944 1.1500 11.397 1.2843 1.547035       1.723924  
1 1 1 13 19 7  o 4.4388 1.2320 14.656   16.305  29.958    25.073  3.4432    21.463  5.1759 1.8777 3.7017 1.5956 1.474211       2.464072  
1 1 1 13 19 8  o 11.542 0.8928 144.783  20.560  140.633   29.798  148.555   28.405  11.347 1.3130 11.737 1.2101 -0.3901958     1.785607  
1 1 1 13 19 9  o 12.316 0.8223 161.774  20.157  177.983   30.391  149.042   26.934  12.848 1.1828 11.785 1.1427 1.062344       1.644590  
1 1 1 13 19 10 o 5.6749 1.3541 38.598   18.345  33.708    26.583  43.045    25.348  5.4002 1.9368 5.9497 1.8929 -0.5494828     2.708212  
1 1 1 13 19 11 f 7.1662 1.3111 62.733   19.033  77.007    28.416  51.118    25.633  7.9281 1.8293 6.4043 1.8788 1.523813       2.622289  
1 1 1 13 19 12 o 6.4523 1.4044 54.687   19.987  50.049    29.851  58.457    26.909  6.1586 2.0606 6.7460 1.9087 -0.5873785     2.808831  
1 1 1 13 19 13 o 6.6198 1.3910 58.159   20.051  48.982    29.392  66.148    27.424  6.0680 2.0446 7.1715 1.8866 -1.103496      2.782064  
1 1 1 13 19 14 o 3.6277 1.1306 -12.0843 18.635  -53.9893  27.981  21.317    24.981  2.7122 1.3463 4.5433 1.8166 -1.831139      2.261128  
1 1 1 13 19 15 o 5.1095 1.3631 28.395   20.278  56.795    30.875  6.8529    26.890  6.2632 2.0957 3.9558 1.7438 2.307452       2.726279  
1 1 1 13 19 16 o 3.7509 1.1388 0.2231   17.967  -36.4161  26.592  30.997    24.371  2.7772 1.3662 4.7247 1.8223 -1.947578      2.277547  
1 1 1 13 19 17 f 4.0024 1.2128 11.222   18.740  -11.2157  27.444  30.826    25.652  3.3095 1.5657 4.6953 1.8525 -1.385813      2.425504  
1 1 1 13 19 18 o 4.3623 1.1965 12.693   18.617  58.066    27.101  -27.8515  25.618  5.9267 1.9627 2.7979 1.3691 3.128795       2.393054  
1 1 1 13 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 0  o 4.2926 1.6755 18.732   23.508  57.929    36.862  -8.1335   30.518  5.7881 2.7699 2.7972 1.8861 -0.000000      0.000000  
1 1 1 13 20 1  o 10.299 0.9752 117.856  19.708  96.070    28.339  138.261   27.425  9.2592 1.5303 11.339 1.2093 -2.080088      1.950461  
1 1 1 13 20 2  o 5.2586 1.3572 30.639   18.754  23.612    26.371  37.828    26.675  4.8751 1.8913 5.6421 1.9469 -0.7670908     2.714338  
1 1 1 13 20 3  o 3.4052 1.0999 -9.0385  16.685  -9.9963   23.133  -7.9999   24.089  3.3385 1.5304 3.4719 1.5801 -0.1334841     2.199767  
1 1 1 13 20 4  o 22.772 0.6271 540.276  28.546  531.515   40.756  548.714   39.995  22.574 0.9027 22.970 0.8706 -0.3954315     1.254131  
1 1 1 13 20 5  o 3.2752 1.0731 -14.8545 16.922  -25.0077  23.882  -4.6172   23.981  2.9873 1.4266 3.5632 1.6035 -0.5758636     2.146230  
1 1 1 13 20 6  o 8.9057 1.1104 91.678   19.174  81.394    27.651  101.203   26.611  8.2552 1.7301 9.5562 1.3923 -1.301037      2.220762  
1 1 1 13 20 7  o 7.3136 1.2636 63.212   18.678  88.167    28.310  43.974    24.856  8.6362 1.6995 5.9910 1.8703 2.645213       2.527123  
1 1 1 13 20 8  o 5.3925 1.3475 33.774   18.395  26.043    27.893  39.723    24.470  5.0340 1.9473 5.7509 1.8630 -0.7168846     2.694977  
1 1 1 13 20 9  o 10.183 1.0569 117.864  20.808  139.554   30.204  98.270    28.707  11.226 1.3453 9.1389 1.6304 2.087259       2.113751  
1 1 1 13 20 10 o 11.925 0.9202 157.635  21.825  159.922   32.659  155.789   29.338  11.942 1.3674 11.909 1.2318 0.3310108E-01  1.840450  
1 1 1 13 20 11 o 5.7790 1.4319 43.415   20.411  44.566    29.952  42.418    27.889  5.8286 2.0596 5.7294 1.9899 0.9927416E-01  2.863863  
1 1 1 13 20 12 o 10.769 1.0584 133.393  22.693  146.760   34.129  122.801   30.382  11.225 1.5202 10.313 1.4730 0.9124556      2.116749  
1 1 1 13 20 13 o 7.3022 1.4326 73.408   21.765  84.804    31.790  63.353    29.861  7.8783 2.0108 6.7261 2.0412 1.152196       2.865277  
1 1 1 13 20 14 o 3.9575 1.2318 6.1645   19.736  -11.7420  30.011  19.810    26.198  3.5394 1.6629 4.3756 1.8177 -0.8361692     2.463586  
1 1 1 13 20 15 f 4.2876 1.2941 20.314   19.700  15.567    28.273  24.793    27.466  4.1214 1.8032 4.4538 1.8566 -0.3323665     2.588106  
1 1 1 13 20 16 o 4.7169 1.3191 31.900   19.097  19.663    28.010  42.529    26.106  4.1989 1.8163 5.2349 1.9134 -1.036087      2.638197  
1 1 1 13 20 17 o 4.0023 1.1881 15.204   18.205  -13.3429  27.443  37.641    24.330  3.1530 1.5120 4.8517 1.8330 -1.698754      2.376158  
1 1 1 13 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 20 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 0  o 3.0333 1.4205 -20.5788 23.440  25.027    35.818  -54.7395  31.000  4.0560 2.4400 2.0105 1.4551 -0.000000      0.000000  
1 1 1 13 21 1  o 12.593 0.8636 173.324  21.481  194.748   29.680  149.757   31.129  13.511 1.0984 11.676 1.3330 1.834770       1.727256  
1 1 1 13 21 2  o 3.1426 1.0473 -26.4837 17.702  -48.8764  24.904  -3.6176   25.166  2.6122 1.2920 3.6729 1.6486 -1.060705      2.094534  
1 1 1 13 21 3  o 6.3686 1.3739 49.826   19.102  57.481    28.349  43.461    25.852  6.7765 1.9724 5.9607 1.9132 0.8158317      2.747865  
1 1 1 13 21 4  o 17.413 0.7161 319.533  24.916  313.747   35.743  325.003   34.751  17.238 1.0368 17.587 0.9880 -0.3492947     1.432107  
1 1 1 13 21 5  o 4.1417 1.2280 8.7974   17.537  -1.3946   25.440  18.027    24.209  3.7746 1.6784 4.5088 1.7930 -0.7341321     2.455974  
1 1 1 13 21 6  o 6.5026 1.3031 50.839   18.799  76.874    27.922  29.252    25.425  7.9272 1.8020 5.0780 1.8828 2.849223       2.606153  
1 1 1 13 21 7  o 5.1660 1.3242 31.594   18.029  22.385    26.796  39.212    24.371  4.7236 1.8839 5.6085 1.8615 -0.8849025     2.648405  
1 1 1 13 21 8  o 13.151 0.8523 189.930  22.336  205.154   31.422  174.380   31.757  13.743 1.1432 12.559 1.2643 1.183281       1.704525  
1 1 1 13 21 9  f 7.5467 1.3330 74.382   20.627  54.359    29.805  92.788    28.577  6.3636 2.0555 8.7298 1.6979 -2.366148      2.666080  
1 1 1 13 21 10 o 3.8236 1.2143 -8.1658  20.027  18.274    30.109  -29.1456  26.820  4.5911 1.9308 3.0562 1.4731 1.534915       2.428584  
1 1 1 13 21 11 o 4.3607 1.2853 14.272   19.914  -7.0754   30.278  30.546    26.435  3.7390 1.7273 4.9824 1.9039 -1.243431      2.570657  
1 1 1 13 21 12 f 4.6895 1.3783 23.943   21.116  27.847    32.412  21.065    27.833  4.8699 2.0223 4.5092 1.8734 0.3606877      2.756671  
1 1 1 13 21 13 o 9.7156 1.2357 127.221  23.094  132.610   33.790  122.498   31.635  9.8683 1.7774 9.5629 1.7172 0.3054399      2.471395  
1 1 1 13 21 14 f 5.4891 1.3997 45.648   20.834  64.374    29.492  26.994    29.435  6.4084 2.0421 4.5698 1.9148 1.838568       2.799397  
1 1 1 13 21 15 o 4.2526 1.2111 11.628   19.667  -33.0356  28.743  50.946    26.968  2.9085 1.4287 5.5966 1.9561 -2.688093      2.422293  
1 1 1 13 21 16 o 4.5208 1.2718 28.706   19.692  -0.6875   28.854  54.331    26.941  3.4603 1.6273 5.5813 1.9549 -2.120972      2.543541  
1 1 1 13 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 21 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 0  o 3.9264 1.6886 18.051   25.734  -0.9175   34.713  41.194    38.343  3.1238 2.0767 4.7290 2.6633 -0.000000      0.000000  
1 1 1 13 22 1  o 5.8140 1.3816 42.857   19.004  46.352    27.168  39.507    26.593  6.0112 1.9640 5.6169 1.9436 0.3943229      2.763111  
1 1 1 13 22 2  o 12.269 0.9292 166.615  22.472  204.097   32.780  133.385   30.865  13.670 1.1990 10.868 1.4200 2.802076       1.858456  
1 1 1 13 22 3  o 4.4410 1.2155 4.0008   18.057  46.258    27.858  -26.6154  23.712  5.9787 1.9904 2.9033 1.3958 3.075479       2.431047  
1 1 1 13 22 4  f 4.2883 1.3518 2.2761   22.553  -6.1594   28.174  17.322    37.628  3.7243 1.7004 4.8524 2.1021 -1.128105      2.703676  
1 1 1 13 22 5  o 2.8748 0.9750 -25.7129 16.345  -37.9937  24.677  -16.1133  21.818  2.7459 1.3436 3.0036 1.4133 -0.2577176     1.950088  
1 1 1 13 22 6  o 10.721 1.0098 131.006  21.623  138.157   30.661  123.931   30.500  11.048 1.3876 10.393 1.4673 0.6556005      2.019515  
1 1 1 13 22 7  o 6.8651 1.3699 61.926   19.641  59.757    27.860  64.069    27.693  6.7269 1.9545 7.0032 1.9199 -0.2763071     2.739736  
1 1 1 13 22 8  o 5.1991 1.3105 28.300   20.301  -5.3251   29.311  59.304    28.145  3.7613 1.7236 6.6369 1.9744 -2.875633      2.620929  
1 1 1 13 22 9  o 4.8386 1.3355 25.926   20.113  5.3148    29.889  42.983    27.191  4.0554 1.8101 5.6219 1.9642 -1.566469      2.671043  
1 1 1 13 22 10 f 11.656 1.0076 160.535  23.392  152.579   33.882  167.782   32.335  11.282 1.5016 12.031 1.3439 -0.7489281     2.015138  
1 1 1 13 22 11 o 7.8488 1.2905 89.956   21.263  58.296    31.021  118.016   29.204  5.9879 2.0976 9.7097 1.5038 -3.721780      2.581016  
1 1 1 13 22 12 o 5.5959 1.4049 47.946   20.628  32.016    29.292  63.620    29.055  4.7842 1.9476 6.4076 2.0253 -1.623364      2.809841  
1 1 1 13 22 13 o 4.0589 1.2684 15.633   20.260  12.676    28.411  18.692    28.898  3.9539 1.7648 4.1639 1.8224 -0.2099247     2.536824  
1 1 1 13 22 14 o 5.0826 1.3959 44.114   20.341  51.925    29.944  37.422    27.718  5.3879 2.0340 4.7773 1.9124 0.6106257      2.791842  
1 1 1 13 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 22 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 0  o 9.9820 1.7406 131.882  30.059  130.400   41.580  133.503   43.505  9.9754 2.4036 9.9887 2.5181 -0.000000      0.000000  
1 1 1 13 23 1  f 4.9610 1.2827 24.576   18.566  0.4361    26.034  49.559    26.485  3.7768 1.6873 6.1452 1.9326 -2.368358      2.565485  
1 1 1 13 23 2  o 4.8533 1.1421 10.322   18.101  -38.6814  25.294  61.765    25.916  2.7687 1.3559 6.9379 1.8383 -4.169206      2.284256  
1 1 1 13 23 3  o 3.0850 1.0410 -31.3902 18.661  -4.4730   26.153  -59.3090  26.635  3.6191 1.6469 2.5509 1.2739 1.068236       2.082042  
1 1 1 13 23 4  o 8.9912 1.2338 101.481  21.518  77.232    30.682  124.952   30.186  7.5906 1.9949 10.392 1.4524 -2.801126      2.467601  
1 1 1 13 23 5  o 6.1491 1.4105 51.421   19.865  59.062    29.227  44.859    27.083  6.5318 2.0263 5.7665 1.9626 0.7652159      2.820912  
1 1 1 13 23 6  o 3.4052 1.1294 -13.6873 19.323  -8.1127   28.670  -18.3269  26.155  3.6069 1.6714 3.2035 1.5193 0.4034195      2.258752  
1 1 1 13 23 7  o 5.7002 1.3377 38.506   19.901  75.402    30.471  11.061    26.280  7.3321 2.0155 4.0683 1.7596 3.263724       2.675497  
1 1 1 13 23 8  o 7.9752 1.3644 91.788   22.071  69.764    31.958  111.871   30.519  6.6981 2.1248 9.2522 1.7123 -2.554103      2.728900  
1 1 1 13 23 9  o 8.0012 1.3559 91.697   21.367  107.600   32.304  79.329    28.488  8.6471 1.9181 7.3554 1.9171 1.291684       2.711887  
1 1 1 13 23 10 o 3.3823 1.1296 -11.0699 20.035  -6.4192   28.938  -15.3514  27.766  3.5149 1.6455 3.2497 1.5481 0.2651992      2.259267  
1 1 1 13 23 11 o 3.5210 1.1540 -7.1820  19.934  17.561    29.062  -29.1648  27.393  4.1292 1.8168 2.9128 1.4233 1.216323       2.307924  
1 1 1 13 23 12 o 4.3494 1.2958 23.122   20.175  44.790    29.360  3.7355    27.771  5.1023 1.9911 3.5965 1.6590 1.505765       2.591677  
1 1 1 13 23 13 o 4.2706 1.3149 27.414   21.063  25.592    30.895  28.996    28.792  4.2143 1.8628 4.3269 1.8563 -0.1126328     2.629818  
1 1 1 13 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 23 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 0  o 5.9206 2.0210 67.403   30.101  94.836    43.728  42.698    41.497  7.2625 3.0194 4.5788 2.6873 -0.000000      0.000000  
1 1 1 13 24 1  o 3.5811 1.1713 -6.9498  19.753  -10.9488  27.257  -2.5273   28.664  3.4306 1.6031 3.7316 1.7080 -0.3010015     2.342505  
1 1 1 13 24 2  o 5.6940 1.3964 44.115   20.394  64.360    29.715  26.088    28.040  6.6816 2.0381 4.7063 1.9095 1.975348       2.792829  
1 1 1 13 24 3  o 3.4423 1.1272 -12.4704 19.490  -38.8749  29.344  8.3743    26.072  2.9674 1.4548 3.9171 1.7222 -0.9496984     2.254448  
1 1 1 13 24 4  o 5.1703 1.4096 37.556   20.877  52.262    31.118  25.520    28.152  5.7751 2.0924 4.5656 1.8894 1.209526       2.819178  
1 1 1 13 24 5  o 5.2394 1.4192 41.500   20.835  53.561    31.368  31.978    27.871  5.7164 2.0962 4.7624 1.9137 0.9539728      2.838336  
1 1 1 13 24 6  f 3.3324 1.1117 -10.6061 19.384  -16.1523  28.244  -5.6682   26.651  3.2502 1.5520 3.4145 1.5921 -0.1642511     2.223370  
1 1 1 13 24 7  o 6.1593 1.3849 56.077   21.096  87.487    30.982  28.926    28.805  7.6676 1.9996 4.6510 1.9167 3.016607       2.769843  
1 1 1 13 24 8  o 4.9144 1.3486 32.081   21.414  2.3049    30.644  60.498    29.937  3.7592 1.7370 6.0696 2.0634 -2.310371      2.697228  
1 1 1 13 24 9  f 4.2299 1.2555 10.939   20.664  50.054    29.726  -25.6357  28.745  5.4271 2.0311 3.0326 1.4765 2.394482       2.511098  
1 1 1 13 24 10 o 3.7690 1.2114 9.7086   20.023  3.1943    28.146  16.384    28.491  3.5731 1.6558 3.9649 1.7687 -0.3918874     2.422799  
1 1 1 13 24 11 o 3.7056 1.1996 6.0895   20.588  26.538    29.595  -13.0852  28.659  4.2379 1.8497 3.1734 1.5278 1.064503       2.399125  
1 1 1 13 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 24 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 0  o 6.1783 1.9229 75.517   30.597  114.696   42.780  34.489    43.777  8.2753 2.8660 4.0814 2.5644 -0.000000      0.000000  
1 1 1 13 25 1  o 4.4701 1.2391 15.826   19.631  52.130    27.273  -23.2046  28.278  5.8259 1.9695 3.1144 1.5040 2.711476       2.478114  
1 1 1 13 25 2  o 6.6075 1.4442 68.219   20.973  72.025    30.889  64.963    28.567  6.7296 2.0823 6.4854 2.0018 0.2442055      2.888500  
1 1 1 13 25 3  o 4.5719 1.4239 26.569   25.257  32.537    29.918  11.768    47.116  4.7478 1.9546 4.3961 2.0711 0.3517632      2.847777  
1 1 1 13 25 4  o 4.4481 1.3338 23.114   20.800  41.355    31.556  9.1016    27.658  5.0605 2.0353 3.8356 1.7244 1.224846       2.667567  
1 1 1 13 25 5  o 2.9878 1.0334 -30.4985 20.687  -40.8987  30.383  -21.5104  28.246  2.8859 1.4273 3.0897 1.4947 -0.2037969     2.066729  
1 1 1 13 25 6  o 2.8729 1.0007 -35.1330 20.373  -30.7966  29.164  -39.2663  28.473  2.9564 1.4496 2.7894 1.3799 0.1670611      2.001379  
1 1 1 13 25 7  o 5.3841 1.4182 50.909   20.959  64.014    29.913  38.270    29.375  5.9962 2.0621 4.7719 1.9474 1.224270       2.836333  
1 1 1 13 25 8  o 3.9216 1.2524 16.235   20.920  14.440    30.320  17.865    28.902  3.8837 1.7695 3.9596 1.7727 -0.7598639E-01 2.504768  
1 1 1 13 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 25 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 0  o 3.6840 1.7006 27.717   31.208  15.324    46.702  37.715    41.949  3.4161 2.3122 3.9518 2.4944 -0.000000      0.000000  
1 1 1 13 26 1  f 4.6112 1.3782 35.527   21.852  34.569    30.224  36.575    31.632  4.5809 1.9310 4.6415 1.9670 -0.6060696E-01 2.756371  
1 1 1 13 26 2  o 5.6292 1.4651 59.221   21.690  61.732    31.290  56.897    30.094  5.7135 2.0938 5.5448 2.0499 0.1686916      2.930188  
1 1 1 13 26 3  o 5.7391 1.4455 59.049   23.205  94.559    34.035  28.203    31.721  7.1631 2.1804 4.3151 1.8984 2.848028       2.891000  
1 1 1 13 26 4  o 3.6479 1.1807 0.1355   21.282  -36.1737  31.670  30.029    28.736  2.9312 1.4511 4.3645 1.8630 -1.433251      2.361395  
1 1 1 13 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 26 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 27 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 28 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 29 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 30 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 31 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 31 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 31 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 31 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 31 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 13 31 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 1  0  o 44.173 0.8634 1965.95  76.145  1954.89   108.075 1976.86   107.299 44.047 1.2290 44.298 1.2132 -0.000000      0.000000  
1 1 1 14 1  1  o 48.028 0.7248 2315.23  69.626  0.0000    0.0000  2315.23   69.626  ?      ?      48.028 0.7248 ?              ?         
1 1 1 14 1  2  o 11.562 0.7286 127.710  16.175  160.003   28.046  111.616   19.799  12.593 1.1136 10.531 0.9400 2.061585       1.457291  
1 1 1 14 1  3  o 4.4271 1.0500 17.775   9.2607  18.551    21.502  17.599    10.261  4.7290 1.7353 4.1253 1.1826 0.6037931      2.099946  
1 1 1 14 1  4  o 5.0877 1.0355 28.786   10.277  15.248    22.920  32.193    11.498  4.6203 1.7710 5.5552 1.0737 -0.9349031     2.071083  
1 1 1 14 1  5  o 20.538 0.6336 426.897  22.242  420.917   45.141  428.814   25.559  20.403 1.1062 20.672 0.6182 -0.2686310     1.267242  
1 1 1 14 1  6  o 13.864 0.6770 183.455  15.874  213.955   34.032  174.974   17.945  14.530 1.1710 13.198 0.6798 1.332376       1.354084  
1 1 1 14 1  7  o 24.057 0.6222 566.299  25.817  617.111   52.974  550.472   29.565  24.699 1.0724 23.415 0.6313 1.283726       1.244425  
1 1 1 14 1  8  o 22.979 0.6392 525.133  25.095  548.244   51.666  517.998   28.709  23.251 1.1111 22.708 0.6321 0.5432396      1.278300  
1 1 1 14 1  9  o 3.3615 0.9444 4.5131   9.6991  -1.7633   12.834  12.872    14.810  2.8122 1.2230 3.9107 1.4394 -1.098490      1.888781  
1 1 1 14 1  10 o 18.564 0.5666 348.859  21.032  339.232   29.546  358.747   29.944  18.303 0.8071 18.826 0.7953 -0.5225163     1.133139  
1 1 1 14 1  11 o 5.7430 1.0171 36.298   11.851  44.971    16.587  27.254    16.938  6.4508 1.3298 5.0352 1.5393 1.415606       2.034198  
1 1 1 14 1  12 o 16.973 0.5828 294.536  19.779  297.968   27.840  291.039   28.105  17.076 0.8152 16.869 0.8330 0.2076969      1.165523  
1 1 1 14 1  13 o 12.655 0.6443 164.927  16.276  168.172   22.481  161.354   23.593  12.799 0.8783 12.512 0.9429 0.2868719      1.288545  
1 1 1 14 1  14 o 10.684 0.7102 119.643  15.012  134.310   20.775  103.617   21.716  11.411 0.9103 9.9575 1.0904 1.454026       1.420433  
1 1 1 14 1  15 o 8.2550 0.8602 74.383   13.587  85.039    18.626  62.264    19.864  9.0145 1.0331 7.4956 1.3757 1.518861       1.720432  
1 1 1 14 1  16 o 5.0491 1.0903 28.922   11.995  26.418    16.226  31.939    17.810  4.8354 1.5114 5.2629 1.5718 -0.4275270     2.180532  
1 1 1 14 1  17 o 7.3874 1.2097 66.538   16.761  57.706    30.737  70.275    19.995  6.7204 2.0768 8.0543 1.2413 -1.333865      2.419468  
1 1 1 14 1  18 o 11.056 0.7279 130.030  16.047  117.283   22.327  143.652   23.080  10.472 1.0660 11.641 0.9913 -1.168859      1.455757  
1 1 1 14 1  19 o 9.7108 0.7909 101.112  15.345  101.499   21.260  100.690   22.169  9.7463 1.0907 9.6754 1.1457 0.7093430E-01  1.581803  
1 1 1 14 1  20 o 3.7845 1.1132 5.1038   14.050  -3.8548   18.296  17.980    21.935  3.1566 1.4120 4.4124 1.7213 -1.255815      2.226358  
1 1 1 14 1  21 o 9.4011 0.8844 97.802   16.305  112.881   22.443  80.945    23.730  10.273 1.0923 8.5288 1.3912 1.744583       1.768724  
1 1 1 14 1  22 o 9.1480 0.9335 91.335   16.911  93.400    22.615  88.716    25.471  9.3235 1.2128 8.9726 1.4194 0.3509979      1.866950  
1 1 1 14 1  23 o 9.3954 1.0218 103.976  17.519  127.292   23.233  73.244    26.673  10.959 1.0599 7.8316 1.7473 3.127692       2.043667  
1 1 1 14 1  24 o 10.289 0.9116 113.842  18.580  106.548   24.368  123.970   28.714  9.9392 1.2259 10.639 1.3495 -0.7001095     1.823117  
1 1 1 14 1  25 o 5.2956 1.2851 34.535   16.363  36.001    21.216  32.383    25.706  5.4086 1.7329 5.1825 1.8980 0.2260451      2.570104  
1 1 1 14 1  26 o 4.6005 1.2664 23.947   16.734  25.935    21.881  21.147    25.973  4.6802 1.7444 4.5207 1.8365 0.1595149      2.532891  
1 1 1 14 1  27 o 3.0229 1.0204 -17.8549 16.881  -27.9016  22.186  -4.0418   26.015  2.6289 1.2837 3.4168 1.5864 -0.7879536     2.040757  
1 1 1 14 1  28 o 4.7449 1.3218 34.704   18.659  38.880    24.764  29.219    28.379  4.9942 1.8569 4.4955 1.8817 0.4987202      2.643612  
1 1 1 14 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 1  34 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 2  0  o 27.616 0.7751 769.933  42.649  771.058   60.833  768.846   59.810  27.634 1.1047 27.598 1.0874 -0.000000      0.000000  
1 1 1 14 2  1  o 22.060 0.6441 474.841  27.090  442.841   33.112  539.621   47.112  20.990 0.7888 23.131 1.0184 -2.140963      1.288120  
1 1 1 14 2  2  f 19.337 0.5468 375.795  21.145  367.923   29.757  383.824   30.053  19.132 0.7777 19.542 0.7689 -0.4101791     1.093635  
1 1 1 14 2  3  o 13.131 0.5954 173.510  15.635  173.740   22.209  173.284   22.013  13.139 0.8452 13.123 0.8387 0.1663971E-01  1.190708  
1 1 1 14 2  4  o 5.6739 0.8702 35.597   9.2074  26.420    16.194  39.981    11.193  5.0482 1.4967 6.2996 0.8884 -1.251484      1.740500  
1 1 1 14 2  5  o 25.532 0.6310 650.245  27.581  670.037   56.458  644.041   31.610  25.734 1.0970 25.330 0.6240 0.4039345      1.262028  
1 1 1 14 2  6  o 12.788 0.7410 168.537  15.554  159.681   33.049  171.057   17.628  12.527 1.3192 13.049 0.6755 -0.5221653     1.482031  
1 1 1 14 2  7  o 27.856 0.6183 751.147  30.109  848.151   61.021  719.930   34.616  28.942 1.0542 26.769 0.6466 2.173927       1.236674  
1 1 1 14 2  8  o 23.864 0.6427 572.364  26.333  585.550   53.532  568.155   30.245  23.966 1.1168 23.761 0.6364 0.2052517      1.285433  
1 1 1 14 2  9  o 12.133 0.7805 147.485  15.593  156.270   33.851  145.119   17.567  12.280 1.3783 11.985 0.7329 0.2946386      1.561066  
1 1 1 14 2  10 o 3.1474 0.9686 -0.4611  10.901  -30.7122  24.968  6.6638    12.117  3.0545 1.4587 3.2402 1.2748 -0.1856985     1.937270  
1 1 1 14 2  11 o 8.1331 1.0301 60.166   13.538  95.269    31.260  52.062    15.020  9.1816 1.7665 7.0846 1.0600 2.096946       2.060112  
1 1 1 14 2  12 o 4.5634 1.1607 19.548   11.794  17.280    26.442  20.111    13.178  4.7623 1.8802 4.3645 1.3617 0.3977780      2.321476  
1 1 1 14 2  13 o 5.5154 1.1554 35.836   12.485  23.223    28.822  38.749    13.852  5.0619 1.9735 5.9688 1.2019 -0.9069505     2.310741  
1 1 1 14 2  14 o 10.374 1.0716 138.152  15.834  89.186    33.925  151.788   17.903  8.5721 2.0131 12.176 0.7352 -3.603376      2.143180  
1 1 1 14 2  15 o 8.7656 0.8980 70.269   13.832  110.499   29.307  58.738    15.690  10.048 1.4584 7.4835 1.0483 2.564237       1.796055  
1 1 1 14 2  16 o 4.4515 1.1576 12.090   11.687  40.654    25.993  4.8521    13.085  5.7802 1.9226 3.1228 1.2899 2.657423       2.315193  
1 1 1 14 2  17 o 6.1499 1.1834 45.988   13.444  39.660    29.596  47.634    15.091  5.7272 2.0447 6.5725 1.1920 -0.8452621     2.366803  
1 1 1 14 2  18 o 8.0034 0.9168 70.354   14.050  53.269    18.947  91.230    20.943  6.7991 1.4382 9.2077 1.1373 -2.408587      1.833554  
1 1 1 14 2  19 o 4.4525 1.0073 19.517   12.308  37.787    16.316  -4.6097   18.750  5.7393 1.4274 3.1657 1.4218 2.573521       2.014684  
1 1 1 14 2  20 o 8.3849 0.9523 77.240   15.479  64.651    20.869  92.635    23.078  7.5335 1.4375 9.2364 1.2493 -1.702839      1.904538  
1 1 1 14 2  21 o 17.388 0.6539 318.210  22.584  347.756   31.315  286.184   32.602  18.289 0.8561 16.486 0.9888 1.802576       1.307888  
1 1 1 14 2  22 o 3.6086 1.0194 -2.9091  14.063  24.691    18.672  -39.0861  21.377  4.7240 1.6289 2.4932 1.2262 2.230751       2.038870  
1 1 1 14 2  23 o 14.672 0.7304 229.448  21.177  239.542   28.307  216.618   31.913  15.114 0.9364 14.231 1.1213 0.8836813      1.460884  
1 1 1 14 2  24 o 3.4593 1.0959 -2.9025  15.499  0.7788    19.840  -8.6681   24.829  3.4458 1.5090 3.4728 1.5896 -0.2692175E-01 2.191758  
1 1 1 14 2  25 o 12.100 0.8665 162.268  20.642  166.934   27.264  156.001   31.598  12.416 1.0979 11.783 1.3408 0.6328335      1.732961  
1 1 1 14 2  26 o 8.5264 1.2131 91.831   19.753  90.942    25.966  93.053    30.433  8.6332 1.5613 8.4195 1.8572 0.2137213      2.426272  
1 1 1 14 2  27 o 4.3520 1.2729 22.657   18.198  26.928    23.534  16.306    28.700  4.5316 1.7786 4.1724 1.8214 0.3591843      2.545771  
1 1 1 14 2  28 o 4.6965 1.3182 33.053   18.371  22.105    23.823  49.115    28.856  4.1068 1.7218 5.2862 1.9965 -1.179451      2.636383  
1 1 1 14 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 3  0  o 18.987 0.7904 365.945  29.759  382.210   42.820  350.751   41.386  19.400 1.1120 18.573 1.1236 -0.000000      0.000000  
1 1 1 14 3  1  o 12.398 0.6113 155.069  15.124  165.857   21.302  144.102   21.477  12.837 0.8297 11.958 0.8980 0.8781099      1.222619  
1 1 1 14 3  2  o 21.438 0.6900 471.171  27.477  484.523   33.460  443.518   48.153  21.950 0.7622 20.927 1.1505 1.023855       1.380067  
1 1 1 14 3  3  o 31.893 0.5584 1023.20  35.613  1051.99   50.685  995.120   50.049  32.337 0.7837 31.448 0.7957 0.8891716      1.116866  
1 1 1 14 3  4  o 13.671 0.5960 188.324  16.285  183.453   23.220  193.039   22.845  13.495 0.8603 13.847 0.8249 -0.3521833     1.191912  
1 1 1 14 3  5  o 19.016 0.5556 364.545  21.088  339.972   29.952  388.699   29.696  18.375 0.8150 19.658 0.7553 -1.282240      1.111210  
1 1 1 14 3  6  o 21.872 0.5569 482.363  24.291  436.915   34.130  529.018   34.580  20.820 0.8196 22.924 0.7542 -2.103434      1.113851  
1 1 1 14 3  7  o 2.9303 0.9103 -3.6996  10.371  -7.6495   14.785  0.1255    14.550  2.7615 1.2493 3.0991 1.3243 -0.3375816     1.820615  
1 1 1 14 3  8  o 17.121 0.6764 292.546  19.616  309.060   40.948  287.628   22.346  17.352 1.1799 16.890 0.6615 0.4625607      1.352715  
1 1 1 14 3  9  o 6.1066 1.1616 35.133   11.979  51.090    28.108  31.592    13.242  6.7833 1.9610 5.4298 1.2458 1.353547       2.323258  
1 1 1 14 3  10 o 12.300 0.8056 158.451  16.156  155.357   34.721  159.306   18.252  12.082 1.4369 12.519 0.7290 -0.4362869     1.611226  
1 1 1 14 3  11 o 7.8070 1.0556 71.124   13.396  56.571    27.609  75.606    15.321  7.0205 1.9138 8.5935 0.8914 -1.573034      2.111218  
1 1 1 14 3  12 o 10.621 0.9983 133.138  15.707  103.819   33.807  141.209   17.738  9.4841 1.8487 11.758 0.7543 -2.273815      1.996671  
1 1 1 14 3  13 o 9.5494 0.8800 88.972   14.594  113.201   30.439  81.739    16.630  10.208 1.4910 8.8911 0.9352 1.316626       1.760021  
1 1 1 14 3  14 o 5.0631 1.1143 31.341   12.757  6.0080    28.398  37.746    14.279  4.2777 1.8396 5.8484 1.2581 -1.570667      2.228680  
1 1 1 14 3  15 o 9.5827 0.9371 91.679   15.056  115.935   32.876  85.241    16.937  10.127 1.6232 9.0383 0.9369 1.088765       1.874166  
1 1 1 14 3  16 o 3.9852 1.0983 14.560   11.979  -6.2385   28.123  19.171    13.240  3.7828 1.7161 4.1875 1.3712 -0.4046683     2.196635  
1 1 1 14 3  17 o 3.6177 1.0995 5.3734   11.770  7.5051    26.894  4.8684    13.090  4.1288 1.7829 3.1066 1.2872 1.022163       2.198977  
1 1 1 14 3  18 o 6.9933 1.1775 61.413   14.166  50.015    31.718  64.253    15.833  6.2061 2.1238 7.7806 1.0174 -1.574502      2.354972  
1 1 1 14 3  19 o 4.5265 1.2311 18.482   13.084  22.523    30.721  17.587    14.461  4.9541 2.0026 4.0990 1.4324 0.8551097      2.462172  
1 1 1 14 3  20 o 4.2279 1.1808 16.341   13.209  8.9738    29.394  18.205    14.787  4.3230 1.8653 4.1327 1.4482 0.1902604      2.361506  
1 1 1 14 3  21 o 7.2318 1.2377 62.733   15.466  56.730    34.410  64.253    17.313  6.6797 2.2116 7.7838 1.1121 -1.104064      2.475498  
1 1 1 14 3  22 o 7.1227 1.2648 65.966   16.204  45.358    37.348  70.746    17.986  6.0858 2.2769 8.1597 1.1021 -2.073947      2.529579  
1 1 1 14 3  23 o 5.8324 1.2249 45.240   15.966  14.873    34.463  53.540    18.016  4.7784 2.0399 6.8863 1.3564 -2.107946      2.449701  
1 1 1 14 3  24 o 13.085 1.0091 197.382  21.375  183.922   44.767  201.356   24.328  12.318 1.8171 13.851 0.8782 -1.532762      2.018171  
1 1 1 14 3  25 o 8.4338 1.3541 85.300   18.377  102.135   43.023  81.543    20.324  8.2554 2.4375 8.6122 1.1799 -0.3568125     2.708116  
1 1 1 14 3  26 o 5.0075 1.3268 33.172   16.822  19.519    41.166  35.909    18.431  4.7215 2.1146 5.2935 1.6030 -0.5720067     2.653546  
1 1 1 14 3  27 o 3.7160 1.2170 3.3734   16.820  10.745    40.572  1.8436    18.483  4.2493 1.9756 3.1828 1.4218 1.066488       2.434070  
1 1 1 14 3  28 o 4.6969 1.3712 36.172   19.051  43.907    44.178  34.404    21.115  4.6856 2.1353 4.7082 1.7208 -0.2263021E-01 2.742430  
1 1 1 14 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 4  0  o 19.159 0.7853 373.653  29.802  356.832   42.767  389.532   41.552  18.724 1.1521 19.595 1.0675 -0.000000      0.000000  
1 1 1 14 4  1  o 17.252 0.5650 299.001  19.421  337.023   28.112  264.284   26.862  18.304 0.7679 16.201 0.8290 2.103062       1.130036  
1 1 1 14 4  2  o 9.4689 0.8664 86.317   15.405  104.820   27.970  78.260    18.457  10.141 1.3791 8.7974 1.0490 1.343163       1.732749  
1 1 1 14 4  3  o 16.251 0.5702 265.935  18.529  262.065   26.288  269.755   26.121  16.132 0.8148 16.370 0.7978 -0.2372990     1.140347  
1 1 1 14 4  4  o 9.4702 0.7162 91.143   13.483  80.305    19.169  101.754   18.967  8.9034 1.0765 10.037 0.9449 -1.133636      1.432354  
1 1 1 14 4  5  o 7.5111 0.8784 59.370   12.610  45.346    17.880  73.246    17.786  6.5269 1.4108 8.4952 1.0468 -1.968276      1.756793  
1 1 1 14 4  6  o 15.718 0.5804 249.964  18.232  239.280   25.776  260.663   25.793  15.378 0.8381 16.058 0.8031 -0.6800900     1.160768  
1 1 1 14 4  7  o 11.158 0.6737 126.700  15.027  121.926   21.217  131.505   21.287  10.944 0.9694 11.372 0.9359 -0.4285984     1.347440  
1 1 1 14 4  8  o 17.900 0.5773 324.960  20.661  314.672   29.150  335.346   29.290  17.612 0.8276 18.188 0.8052 -0.5762749     1.154640  
1 1 1 14 4  9  o 6.1786 1.0257 42.049   12.453  42.130    17.868  41.973    17.366  6.1794 1.4676 6.1778 1.4332 0.1605034E-02  2.051350  
1 1 1 14 4  10 o 4.4468 1.1278 13.660   10.599  33.110    24.349  9.1131    11.772  5.5257 1.8610 3.3678 1.2744 2.157840       2.255539  
1 1 1 14 4  11 o 7.1417 1.1368 61.898   13.525  45.157    30.094  66.134    15.140  6.2726 2.0679 8.0108 0.9450 -1.738271      2.273568  
1 1 1 14 4  12 o 22.104 0.6896 509.725  25.752  497.580   52.706  513.534   29.515  21.725 1.2130 22.483 0.6564 -0.7582912     1.379218  
1 1 1 14 4  13 o 4.9110 1.0282 30.374   12.850  -13.6409  27.842  42.288    14.485  3.6087 1.6633 6.2134 1.2092 -2.604729      2.056391  
1 1 1 14 4  14 o 13.203 0.8245 181.681  17.976  190.890   38.492  179.113   20.329  13.197 1.4583 13.208 0.7696 -0.1061344E-01 1.648931  
1 1 1 14 4  15 o 8.8281 1.1467 116.198  15.651  48.336    32.831  136.155   17.804  6.1745 2.1583 11.482 0.7753 -5.307218      2.293311  
1 1 1 14 4  16 f 11.228 0.9392 144.066  16.928  126.124   35.478  149.355   19.262  10.442 1.6987 12.013 0.8017 -1.570943      1.878418  
1 1 1 14 4  17 o 7.5704 1.1396 66.212   14.716  68.624    30.297  65.467    16.836  7.3118 2.0096 7.8290 1.0752 -0.5171347     2.279163  
1 1 1 14 4  18 o 7.2786 1.1954 58.951   14.337  68.001    32.868  56.824    15.933  7.2502 2.1276 7.3070 1.0902 -0.5672312E-01 2.390706  
1 1 1 14 4  19 o 3.0569 1.0166 -8.1736  11.591  -13.8424  29.270  -7.1192   12.623  3.6490 1.6901 2.4649 1.1301 1.184114       2.033180  
1 1 1 14 4  20 o 3.4225 1.0761 1.4754   12.015  -5.0235   28.524  2.8772    13.248  3.8305 1.7339 3.0144 1.2749 0.8160400      2.152191  
1 1 1 14 4  21 o 5.5708 1.0533 42.458   14.782  -18.2110  33.471  57.158    16.476  3.8167 1.7812 7.3249 1.1246 -3.508225      2.106505  
1 1 1 14 4  22 o 5.6311 1.2308 40.807   14.612  14.469    36.941  45.693    15.910  4.8727 2.0968 6.3896 1.2894 -1.516871      2.461586  
1 1 1 14 4  23 o 3.4728 1.0569 1.6755   13.761  -52.6318  33.192  12.949    15.122  3.1508 1.5452 3.7949 1.4424 -0.6441402     2.113771  
1 1 1 14 4  24 o 11.371 1.0578 139.719  19.382  164.176   43.390  133.622   21.664  11.526 1.8823 11.217 0.9657 0.3093357      2.115554  
1 1 1 14 4  25 o 3.9447 1.2411 7.0939   14.680  5.6884    40.117  7.3112    15.774  4.4909 2.0421 3.3986 1.4110 1.092311       2.482124  
1 1 1 14 4  26 o 6.1669 1.4277 47.162   16.376  88.370    40.085  38.906    17.942  6.9223 2.3868 5.4115 1.5674 1.510812       2.855419  
1 1 1 14 4  27 o 4.4651 1.2213 28.736   15.956  -3.6885   42.121  34.168    17.241  3.9310 1.8820 4.9993 1.5571 -1.068346      2.442641  
1 1 1 14 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 4  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 5  0  o 24.575 0.7785 612.390  38.044  597.781   54.690  626.087   52.958  24.280 1.1319 24.870 1.0692 -0.000000      0.000000  
1 1 1 14 5  1  o 12.544 0.6271 158.930  15.723  152.810   22.263  165.019   22.208  12.301 0.9050 12.788 0.8683 -0.4869375     1.254185  
1 1 1 14 5  2  o 27.071 0.5485 738.641  29.696  727.400   42.020  749.856   41.972  26.863 0.7821 27.278 0.7693 -0.4150009     1.097059  
1 1 1 14 5  3  o 7.7545 0.8324 61.266   12.890  56.659    17.917  66.209    18.560  7.4494 1.2026 8.0597 1.1514 -0.6102443     1.664898  
1 1 1 14 5  4  o 17.050 0.5784 294.574  19.672  316.355   27.670  272.314   27.973  17.697 0.7818 16.403 0.8527 1.293539       1.156813  
1 1 1 14 5  5  f 10.486 0.9195 113.977  17.086  114.670   20.043  112.135   32.679  10.620 0.9436 10.351 1.5785 0.2691994      1.839038  
1 1 1 14 5  6  o 30.674 0.5643 952.907  34.583  899.831   48.730  1006.77   49.088  29.804 0.8175 31.545 0.7781 -1.740282      1.128577  
1 1 1 14 5  7  o 6.3603 0.9412 43.376   11.834  30.802    16.658  56.192    16.816  5.3337 1.4992 7.3870 1.1382 -2.053286      1.882329  
1 1 1 14 5  8  o 7.6583 0.8634 62.136   12.741  75.783    18.502  49.828    17.571  8.5501 1.0820 6.7665 1.3458 1.783567       1.726766  
1 1 1 14 5  9  o 4.4570 1.0468 18.919   11.592  7.8048    16.043  31.060    16.769  3.6093 1.4513 5.3047 1.5088 -1.695380      2.093540  
1 1 1 14 5  10 o 10.248 0.7350 108.607  15.057  113.779   21.649  103.762   20.954  10.487 1.0322 10.010 1.0467 0.4769917      1.470061  
1 1 1 14 5  11 o 8.5693 0.8164 77.005   13.986  79.928    20.115  74.270    19.460  8.7273 1.1524 8.4112 1.1568 0.3161011      1.632838  
1 1 1 14 5  12 o 10.355 0.7568 112.459  15.651  121.415   22.624  104.238   21.674  10.759 1.0514 9.9520 1.0889 0.8068781      1.513659  
1 1 1 14 5  13 o 6.4208 1.1117 55.900   13.288  21.591    30.920  63.672    14.716  5.0120 2.0150 7.8295 0.9398 -2.817436      2.223402  
1 1 1 14 5  14 o 14.365 0.8576 241.678  19.331  186.679   40.350  258.061   22.023  12.863 1.5685 15.866 0.6940 -3.003461      1.715168  
1 1 1 14 5  15 o 5.6004 1.2281 30.328   13.045  54.576    28.490  23.895    14.674  6.5940 1.9921 4.6067 1.4368 1.987257       2.456245  
1 1 1 14 5  16 o 5.0661 1.2475 27.748   13.203  33.313    30.707  26.487    14.623  5.3429 2.0495 4.7893 1.4228 0.5535426      2.494945  
1 1 1 14 5  17 o 8.3336 1.1223 71.186   14.950  99.566    34.190  64.477    16.623  8.8961 1.9733 7.7711 1.0696 1.125072       2.244514  
1 1 1 14 5  18 f 4.8050 1.2280 19.313   12.664  40.488    28.560  14.131    14.129  5.7850 2.0135 3.8251 1.4062 1.959916       2.455923  
1 1 1 14 5  19 o 3.1727 0.9640 0.9793   11.550  -64.2144  31.240  11.301    12.430  2.8395 1.4117 3.5060 1.3132 -0.6664531     1.928064  
1 1 1 14 5  20 o 9.9136 0.9176 85.777   15.590  153.487   34.899  68.895    17.426  11.759 1.4840 8.0685 1.0799 3.690212       1.835283  
1 1 1 14 5  21 o 10.635 1.1221 131.618  17.459  122.542   39.828  133.776   19.424  9.9167 2.0748 11.354 0.8554 -1.436829      2.244196  
1 1 1 14 5  22 o 12.013 1.0984 169.029  18.858  154.804   43.804  172.266   20.893  11.137 2.0419 12.890 0.8104 -1.753590      2.196848  
1 1 1 14 5  23 o 8.4876 1.2172 84.384   16.165  88.924    36.918  83.307    17.980  8.1227 2.2125 8.8525 1.0155 -0.7297707     2.434469  
1 1 1 14 5  24 o 10.402 1.2415 131.417  18.241  130.150   44.062  131.678   20.038  9.6357 2.3152 11.169 0.8971 -1.532898      2.482953  
1 1 1 14 5  25 o 5.6470 1.4017 37.282   16.016  59.128    39.125  32.884    17.554  6.1573 2.3249 5.1368 1.5664 1.020546       2.803353  
1 1 1 14 5  26 o 7.7386 1.3884 82.457   17.788  100.591   44.714  79.048    19.388  7.1899 2.5184 8.2873 1.1697 -1.097382      2.776839  
1 1 1 14 5  27 o 4.3676 1.2222 27.440   15.040  5.3201    43.671  30.416    16.019  4.0298 1.9258 4.7054 1.5056 -0.6755686     2.444483  
1 1 1 14 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 6  0  o 18.263 0.8087 341.721  29.205  316.903   41.303  366.537   41.302  17.576 1.1875 18.951 1.0981 -0.000000      0.000000  
1 1 1 14 6  1  o 6.4965 0.9594 45.669   12.443  25.182    17.569  66.285    17.624  4.9378 1.5764 8.0553 1.0939 -3.117558      1.918791  
1 1 1 14 6  2  o 22.994 0.5498 534.552  25.271  513.561   35.488  556.149   35.995  22.532 0.7875 23.455 0.7673 -0.9224243     1.099506  
1 1 1 14 6  3  o 18.934 0.5629 362.935  21.309  371.776   30.065  354.011   30.206  19.169 0.7842 18.699 0.8077 0.4702187      1.125781  
1 1 1 14 6  4  o 3.8479 1.0544 9.9876   11.686  5.6166    16.207  14.720    16.865  3.5427 1.4462 4.1530 1.5347 -0.6102598     2.108744  
1 1 1 14 6  5  o 14.323 0.7674 209.671  20.531  212.068   36.214  208.536   24.923  14.320 1.2645 14.326 0.8699 -0.5341530E-02 1.534767  
1 1 1 14 6  6  o 21.241 0.5649 458.927  23.998  459.592   34.064  458.272   33.815  21.256 0.8013 21.227 0.7965 0.2840614E-01  1.129821  
1 1 1 14 6  7  f 3.4502 1.0013 3.8351   11.426  -4.2134   15.856  12.530    16.480  2.9766 1.3242 3.9238 1.5023 -0.9471986     2.002591  
1 1 1 14 6  8  o 7.8155 0.8867 65.076   13.458  71.340    18.771  58.452    19.304  8.2884 1.1324 7.3426 1.3647 0.9457994      1.773358  
1 1 1 14 6  9  o 14.373 0.6329 212.161  18.185  204.247   25.523  220.320   25.916  14.096 0.9053 14.649 0.8846 -0.5531569     1.265718  
1 1 1 14 6  10 o 4.6627 0.9440 21.364   11.410  -2.8792   16.750  42.351    15.585  3.1096 1.3732 6.2158 1.2956 -3.106204      1.887974  
1 1 1 14 6  11 o 5.1394 1.1250 29.711   12.709  30.780    18.860  28.823    17.200  5.2159 1.6293 5.0628 1.5518 0.1530719      2.250014  
1 1 1 14 6  12 o 9.7806 0.7676 100.565  15.005  105.487   21.347  95.757    21.096  10.026 1.0645 9.5349 1.1063 0.4915075      1.535261  
1 1 1 14 6  13 o 9.3296 0.8351 93.062   15.577  96.495    22.242  89.757    21.822  9.5040 1.1702 9.1552 1.1918 0.3487387      1.670215  
1 1 1 14 6  14 o 8.5255 0.8889 79.059   15.075  69.576    21.110  88.927    21.534  7.9654 1.3251 9.0857 1.1851 -1.120308      1.777724  
1 1 1 14 6  15 o 3.5795 1.0412 8.6420   11.612  -29.6233  30.359  15.199    12.567  3.3374 1.5978 3.8215 1.3353 -0.4840612     2.082326  
1 1 1 14 6  16 o 6.4833 1.2262 41.967   13.677  71.882    30.962  34.714    15.246  7.4782 2.0217 5.4883 1.3880 1.989909       2.452355  
1 1 1 14 6  17 o 8.0266 1.2119 77.235   15.054  72.250    35.624  78.319    16.610  7.4131 2.2250 8.6402 0.9612 -1.227111      2.423724  
1 1 1 14 6  18 o 5.8004 1.2669 30.801   13.662  64.179    31.034  22.778    15.215  7.0840 2.0642 4.5167 1.4695 2.567376       2.533792  
1 1 1 14 6  19 o 11.911 0.9389 153.718  17.688  159.226   39.597  152.345   19.771  11.706 1.6914 12.116 0.8159 -0.4108305     1.877860  
1 1 1 14 6  20 o 7.0662 1.2363 58.700   14.913  57.558    34.321  58.966    16.558  6.6863 2.2085 7.4461 1.1118 -0.7598057     2.472611  
1 1 1 14 6  21 o 4.3222 1.2346 15.834   14.002  4.7603    34.935  17.953    15.283  4.4914 1.9833 4.1531 1.4708 0.3382945      2.469192  
1 1 1 14 6  22 o 8.5438 1.2491 88.900   16.598  80.445    38.124  90.877    18.437  7.7891 2.2931 9.2985 0.9914 -1.509383      2.498225  
1 1 1 14 6  23 o 14.877 0.9156 241.655  21.177  250.778   48.352  239.490   23.556  14.575 1.6588 15.178 0.7760 -0.6037827     1.831295  
1 1 1 14 6  24 o 7.5590 1.2120 89.599   16.644  34.509    39.745  101.314   18.329  5.3646 2.2345 9.7534 0.9396 -4.388808      2.424052  
1 1 1 14 6  25 o 4.4011 1.2699 19.706   13.284  26.724    39.092  18.789    14.125  4.8001 2.1097 4.0022 1.4143 0.7978420      2.539896  
1 1 1 14 6  26 o 4.2219 1.1549 23.545   14.317  -25.4439  43.016  29.648    15.183  3.6727 1.7921 4.7710 1.4572 -1.098266      2.309801  
1 1 1 14 6  27 o 4.5944 1.0635 34.693   13.476  -18.8334  39.332  41.813    14.344  3.4642 1.6954 5.7246 1.2844 -2.260323      2.126987  
1 1 1 14 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 7  0  o 6.8473 1.5305 62.098   19.156  46.339    27.252  77.491    26.933  5.5919 2.3891 8.1027 1.9138 -0.000000      0.000000  
1 1 1 14 7  1  f 16.383 0.5833 272.078  19.107  278.931   27.333  265.529   26.721  16.585 0.8240 16.181 0.8257 0.4038162      1.166504  
1 1 1 14 7  2  f 35.767 0.5753 1297.80  41.152  1311.64   58.331  1284.07   58.066  35.959 0.8111 35.576 0.8161 0.3831024      1.150583  
1 1 1 14 7  3  o 11.630 0.6645 138.245  15.424  139.125   21.177  137.252   22.509  11.678 0.9067 11.582 0.9717 0.9585571E-01  1.329046  
1 1 1 14 7  4  o 3.5478 1.0053 4.8373   11.441  -5.3295   15.975  15.545    16.394  2.9547 1.3207 4.1409 1.5159 -1.186226      2.010523  
1 1 1 14 7  5  o 9.1149 0.7590 86.347   13.779  77.094    19.368  95.831    19.608  8.6031 1.1256 9.6267 1.0184 -1.023616      1.517966  
1 1 1 14 7  6  o 4.5606 1.0069 19.989   11.663  36.604    16.226  2.2275    16.777  5.7567 1.4185 3.3646 1.4295 2.392093       2.013852  
1 1 1 14 7  7  o 12.000 0.6865 148.092  16.455  142.716   23.552  153.219   23.000  11.778 0.9999 12.223 0.9408 -0.4453363     1.372908  
1 1 1 14 7  8  o 13.013 0.6644 174.937  17.282  168.395   24.424  181.498   24.457  12.762 0.9569 13.264 0.9219 -0.5028753     1.328744  
1 1 1 14 7  9  o 4.7470 1.1055 24.047   12.186  21.323    16.900  26.996    17.587  4.5292 1.5503 4.9648 1.5764 -0.4356289     2.211013  
1 1 1 14 7  10 o 2.6563 0.8671 -9.9050  10.741  -11.6166  15.897  -8.4676   14.569  2.6684 1.2393 2.6442 1.2130 0.2423453E-01  1.734169  
1 1 1 14 7  11 f 10.997 0.7371 126.573  16.047  150.970   23.237  104.331   22.186  12.046 0.9645 9.9488 1.1150 2.096900       1.474298  
1 1 1 14 7  12 o 6.1712 1.1142 43.888   13.832  50.488    20.253  38.119    18.936  6.6133 1.5570 5.7292 1.5942 0.8840446      2.228423  
1 1 1 14 7  13 o 6.7753 1.0566 54.715   14.476  33.620    21.290  72.853    19.742  5.3362 1.7383 8.2145 1.2017 -2.878303      2.113233  
1 1 1 14 7  14 o 6.3822 1.1023 47.858   13.957  45.014    20.291  50.411    19.228  6.1630 1.6236 6.6015 1.4915 -0.4384894     2.204680  
1 1 1 14 7  15 o 8.7162 0.9426 85.384   15.847  76.390    23.237  93.204    21.668  8.1445 1.4811 9.2878 1.1665 -1.143340      1.885276  
1 1 1 14 7  16 o 7.3391 1.0249 62.096   14.641  47.559    21.031  75.768    20.395  6.3155 1.6477 8.3628 1.2194 -2.047216      2.049810  
1 1 1 14 7  17 f 10.688 0.7898 121.433  16.841  133.774   24.500  110.378   23.189  11.216 1.0922 10.160 1.1412 1.055608       1.579607  
1 1 1 14 7  18 f 11.805 0.9474 156.773  17.780  147.929   38.476  159.175   20.049  11.231 1.7130 12.380 0.8098 -1.148909      1.894735  
1 1 1 14 7  19 o 4.6968 1.4268 24.734   14.584  0.0000    0.0000  24.734    14.584  ?      ?      4.6968 1.4268 ?              ?         
1 1 1 14 7  20 o 18.690 0.8054 396.493  24.207  328.085   50.146  417.278   27.641  17.195 1.4581 20.185 0.6847 -2.989571      1.610890  
1 1 1 14 7  21 o 13.692 0.9846 224.805  20.083  177.293   44.602  236.888   22.492  12.225 1.8242 15.159 0.7418 -2.934263      1.969259  
1 1 1 14 7  22 f 4.1728 1.2519 11.141   13.449  12.150    37.506  10.993    14.407  4.7511 2.0778 3.5944 1.3970 1.156633       2.503763  
1 1 1 14 7  23 o 9.8035 1.2930 120.252  18.114  115.217   44.064  121.276   19.871  8.9062 2.4136 10.701 0.9285 -1.794505      2.586019  
1 1 1 14 7  24 o 3.9062 1.2483 -0.9728  13.360  32.244    38.902  -5.4144   14.225  5.1616 2.1840 2.6507 1.2094 2.510850       2.496526  
1 1 1 14 7  25 f 4.8266 1.2963 30.036   14.110  32.991    41.944  29.659    14.983  4.8430 2.1541 4.8103 1.4428 0.3265572E-01  2.592672  
1 1 1 14 7  26 o 4.2858 1.0850 26.670   13.057  -23.6280  39.004  33.018    13.857  3.4914 1.7043 5.0802 1.3433 -1.588776      2.170049  
1 1 1 14 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 7  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 8  0  o 16.566 0.8560 285.414  27.942  263.082   39.321  308.193   39.713  15.877 1.2564 17.255 1.1629 -0.000000      0.000000  
1 1 1 14 8  1  o 8.8045 0.8069 81.087   14.060  67.280    19.665  95.524    20.110  8.0067 1.2281 9.6024 1.0471 -1.595719      1.613876  
1 1 1 14 8  2  o 24.962 0.5595 636.136  27.934  629.714   39.312  642.685   39.699  24.835 0.7915 25.090 0.7911 -0.2546844     1.119069  
1 1 1 14 8  3  o 3.7777 1.0434 8.3099   11.923  -1.1656   16.438  18.829    17.320  3.1689 1.3810 4.3864 1.5644 -1.217507      2.086754  
1 1 1 14 8  4  o 18.754 0.5772 359.015  21.596  326.728   30.215  392.732   30.877  17.878 0.8450 19.629 0.7865 -1.751366      1.154406  
1 1 1 14 8  5  o 3.3249 0.9821 2.6135   11.034  -2.4780   15.199  8.2861    16.043  3.0009 1.3173 3.6490 1.4569 -0.6480894     1.964139  
1 1 1 14 8  6  o 4.9133 1.0958 26.166   12.085  29.433    17.181  22.966    17.002  5.1616 1.5443 4.6650 1.5551 0.4965200      2.191563  
1 1 1 14 8  7  o 15.818 0.6159 257.277  19.450  279.276   27.958  236.646   27.075  16.485 0.8480 15.152 0.8935 1.332704       1.231816  
1 1 1 14 8  8  o 7.2645 0.9636 57.924   13.477  59.557    19.507  56.432    18.641  7.3587 1.3760 7.1703 1.3494 0.1883149      1.927228  
1 1 1 14 8  9  o 9.7281 0.7866 99.885   15.301  99.466    21.830  100.288   21.454  9.7023 1.1250 9.7539 1.0997 -0.5161762E-01 1.573224  
1 1 1 14 8  10 o 6.8047 1.3116 42.224   16.887  26.924    19.348  91.167    34.604  4.9452 1.6589 8.6643 2.0321 -3.719080      2.623242  
1 1 1 14 8  11 o 6.0125 0.9799 40.031   13.041  68.162    18.821  14.054    18.086  7.9884 1.1780 4.0366 1.5662 3.951857       1.959782  
1 1 1 14 8  12 o 6.1931 1.0103 42.472   13.060  65.386    19.510  23.867    17.580  7.7550 1.2579 4.6313 1.5812 3.123743       2.020516  
1 1 1 14 8  13 o 9.3266 0.8437 93.748   15.636  92.772    23.363  94.540    21.043  9.2419 1.2640 9.4112 1.1180 -0.1692505     1.687483  
1 1 1 14 8  14 o 5.3780 1.1654 34.564   13.725  33.538    19.846  35.506    19.001  5.3013 1.6737 5.4548 1.6222 -0.1534920     2.330812  
1 1 1 14 8  15 o 7.3060 1.0905 61.942   15.411  70.282    22.805  54.932    20.908  7.7820 1.5197 6.8301 1.5642 0.9518614      2.180928  
1 1 1 14 8  16 o 6.8474 1.1223 54.657   15.069  58.451    21.801  51.187    20.851  7.0846 1.5789 6.6101 1.5954 0.4745750      2.244652  
1 1 1 14 8  17 o 6.1688 1.1599 45.416   14.550  45.215    21.096  45.598    20.095  6.1388 1.6727 6.1988 1.6074 -0.5998993E-01 2.319792  
1 1 1 14 8  18 o 4.3347 1.1597 17.719   13.795  23.479    20.673  13.096    18.522  4.6861 1.7042 3.9833 1.5733 0.7028456      2.319409  
1 1 1 14 8  19 o 7.7963 1.0559 75.971   15.784  35.056    23.692  108.620   21.164  5.4558 1.8357 10.137 1.0439 -4.680976      2.111807  
1 1 1 14 8  20 o 16.388 0.8464 294.050  21.936  279.488   48.222  297.849   24.632  15.755 1.5304 17.020 0.7236 -1.265214      1.692814  
1 1 1 14 8  21 o 13.981 0.8140 184.033  19.173  259.438   42.618  164.901   21.467  15.357 1.3876 12.606 0.8515 2.750686       1.628043  
1 1 1 14 8  22 o 17.225 0.9125 346.742  23.819  295.920   53.067  359.564   26.654  15.799 1.6794 18.652 0.7145 -2.852345      1.825096  
1 1 1 14 8  23 o 5.2675 1.2322 35.795   14.027  18.518    36.322  38.823    15.207  4.7698 2.0658 5.7653 1.3437 -0.9955025     2.464322  
1 1 1 14 8  24 o 3.9671 1.2444 9.6741   13.911  14.605    41.169  9.0384    14.781  4.5579 2.0710 3.3763 1.3800 1.181581       2.488714  
1 1 1 14 8  25 o 4.0861 1.2288 16.838   13.997  17.762    38.360  16.696    15.034  4.3735 1.9918 3.7988 1.4395 0.5746830      2.457555  
1 1 1 14 8  26 o 4.7791 1.3923 12.114   14.490  105.922   43.714  0.5345    15.358  6.7167 2.4728 2.8414 1.2805 3.875228       2.784684  
1 1 1 14 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 9  0  o 6.0107 1.6856 52.574   19.562  54.874    27.963  50.371    27.374  6.1768 2.3853 5.8445 2.3824 -0.000000      0.000000  
1 1 1 14 9  1  o 15.151 0.6233 234.667  18.882  228.406   26.424  241.201   26.992  14.944 0.8841 15.358 0.8787 -0.4149408     1.246546  
1 1 1 14 9  2  o 12.543 0.6853 163.125  16.963  192.935   23.992  133.324   23.988  13.732 0.8736 11.355 1.0562 2.376145       1.370692  
1 1 1 14 9  3  o 6.9875 0.9828 56.028   13.316  76.377    18.157  32.343    19.589  8.5778 1.0584 5.3973 1.6563 3.180528       1.965577  
1 1 1 14 9  4  o 14.990 0.6112 231.382  18.277  212.696   25.797  250.216   25.899  14.365 0.8979 15.615 0.8293 -1.249835      1.222309  
1 1 1 14 9  5  o 9.5537 0.7743 95.511   14.779  100.193   20.868  90.798    20.935  9.8003 1.0647 9.3072 1.1247 0.4931269      1.548650  
1 1 1 14 9  6  f 20.886 0.5837 448.113  24.284  401.350   34.213  495.595   34.475  19.759 0.8657 22.012 0.7831 -2.252218      1.167372  
1 1 1 14 9  7  f 11.320 0.7036 133.587  15.903  123.619   22.233  144.031   22.757  10.875 1.0222 11.765 0.9672 -0.8902788     1.407254  
1 1 1 14 9  8  o 5.9561 1.0962 40.612   13.550  52.861    19.244  28.568    19.083  6.8566 1.4487 5.0555 1.6457 1.801190       2.192474  
1 1 1 14 9  9  o 6.3014 1.0753 45.097   13.366  48.442    19.774  42.282    18.138  6.5092 1.5425 6.0936 1.4987 0.4156814      2.150661  
1 1 1 14 9  10 f 3.2882 1.0660 -5.6946  13.818  -16.6742  29.206  -2.5281   15.685  3.5900 1.6715 2.9864 1.3233 0.6035800      2.131935  
1 1 1 14 9  11 o 5.7764 1.1413 39.476   13.696  38.948    19.512  39.989    19.228  5.7343 1.6263 5.8186 1.6017 -0.8438683E-01 2.282630  
1 1 1 14 9  12 o 11.578 0.9924 129.621  21.093  103.851   24.576  201.711   41.104  9.7819 1.2562 13.374 1.5367 -3.592243      1.984793  
1 1 1 14 9  13 o 14.717 0.6628 228.102  19.503  229.091   27.922  227.159   27.252  14.741 0.9471 14.694 0.9273 0.4661846E-01  1.325501  
1 1 1 14 9  14 o 3.9599 1.0661 12.766   12.644  -0.9541   18.716  24.289    17.151  3.2869 1.4515 4.6330 1.5619 -1.346098      2.132238  
1 1 1 14 9  15 o 6.4486 1.1496 49.196   14.816  46.178    21.992  51.705    20.049  6.2170 1.7136 6.6802 1.5331 -0.4632611     2.299278  
1 1 1 14 9  16 o 12.222 0.7629 161.704  18.263  135.711   27.007  183.606   24.791  11.210 1.2046 13.234 0.9366 -2.024047      1.525869  
1 1 1 14 9  17 o 5.0735 1.2184 29.865   14.743  29.765    21.587  29.952    20.182  5.0729 1.7514 5.0740 1.6944 -0.1144886E-02 2.436852  
1 1 1 14 9  18 o 7.4011 1.0906 65.917   15.874  40.215    23.743  86.691    21.346  5.8037 1.8305 8.9985 1.1861 -3.194762      2.181144  
1 1 1 14 9  19 o 5.2337 1.2348 31.694   15.072  30.774    23.364  32.350    19.725  5.1939 1.8204 5.2735 1.6689 -0.7959509E-01 2.469666  
1 1 1 14 9  20 f 9.2060 0.9309 92.006   16.987  98.975    26.132  86.906    22.354  9.4654 1.3804 8.9465 1.2493 0.5188189      1.861776  
1 1 1 14 9  21 o 5.7307 1.2204 40.449   15.034  37.936    24.077  42.056    19.247  5.5413 1.8507 5.9201 1.5913 -0.3787875     2.440739  
1 1 1 14 9  22 o 9.4216 1.2142 102.396  16.896  115.846   40.505  99.562    18.590  9.1694 2.2302 9.6738 0.9609 -0.5043859     2.428341  
1 1 1 14 9  23 o 9.1401 1.3334 116.413  17.951  97.274    44.048  120.224   19.658  7.6886 2.5002 10.592 0.9280 -2.903132      2.666825  
1 1 1 14 9  24 f 10.094 1.3241 150.987  18.961  122.495   44.674  157.248   20.941  8.1504 2.5013 12.038 0.8698 -3.887308      2.648214  
1 1 1 14 9  25 o 7.4422 1.3415 86.368   16.937  87.907    45.935  86.126    18.220  6.2052 2.4692 8.6791 1.0497 -2.473846      2.683012  
1 1 1 14 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 9  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 10 0  o 5.5864 1.3945 38.307   18.798  81.649    28.713  5.7964    24.868  8.1612 2.0331 3.0116 1.9091 -0.000000      0.000000  
1 1 1 14 10 1  o 6.7157 1.0344 50.281   13.518  44.344    18.962  56.417    19.278  6.2776 1.5253 7.1537 1.3975 -0.8760657     2.068731  
1 1 1 14 10 2  f 7.0073 1.0012 54.067   13.754  64.257    19.361  43.683    19.544  7.7974 1.2415 6.2172 1.5711 1.580214       2.002414  
1 1 1 14 10 3  o 5.2089 1.1152 30.158   12.775  24.338    18.213  35.794    17.924  4.7792 1.6095 5.6387 1.5441 -0.8594546     2.230405  
1 1 1 14 10 4  o 4.0728 1.0404 13.447   11.976  -0.9412   17.288  26.721    16.605  3.2333 1.4125 4.9123 1.5279 -1.678992      2.080734  
1 1 1 14 10 5  o 5.1377 1.0996 29.579   12.898  17.665    18.619  40.569    17.883  4.3069 1.6084 5.9685 1.4999 -1.661625      2.199207  
1 1 1 14 10 6  o 4.6960 1.1144 23.950   12.431  20.328    18.223  27.102    17.001  4.4658 1.6034 4.9263 1.5482 -0.4605727     2.228881  
1 1 1 14 10 7  o 6.1098 1.0446 42.071   12.928  56.780    18.780  28.822    17.824  7.1559 1.3620 5.0638 1.5842 2.092095       2.089218  
1 1 1 14 10 8  o 4.5528 1.1315 21.848   12.845  25.359    18.147  18.322    18.184  4.7916 1.6066 4.3140 1.5937 0.4776258      2.262986  
1 1 1 14 10 9  o 7.9116 0.9650 71.588   14.456  53.709    21.182  87.176    19.778  6.7712 1.5911 9.0521 1.0924 -2.280959      1.930006  
1 1 1 14 10 10 o 6.6486 1.0990 52.232   14.462  42.390    20.968  61.162    19.973  5.9568 1.6847 7.3404 1.4117 -1.383604      2.198031  
1 1 1 14 10 11 o 9.2211 0.8403 91.339   15.340  109.365   22.400  75.420    21.051  10.119 1.1068 8.3229 1.2646 1.796496       1.680556  
1 1 1 14 10 12 o 5.7897 1.0135 45.762   15.808  -20.8661  30.792  69.607    18.421  3.5455 1.6716 8.0339 1.1464 -4.488363      2.026936  
1 1 1 14 10 13 o 7.1005 1.0974 58.698   15.156  69.409    22.407  49.664    20.577  7.7405 1.5016 6.4605 1.6007 1.279965       2.194797  
1 1 1 14 10 14 o 8.2216 0.9467 73.935   15.548  74.673    22.595  73.271    21.427  8.2437 1.3705 8.1996 1.3066 0.4410839E-01  1.893487  
1 1 1 14 10 15 o 8.8363 0.9008 85.302   15.826  76.482    22.590  93.802    22.177  8.3391 1.3545 9.3334 1.1880 -0.9942989     1.801679  
1 1 1 14 10 16 o 5.5601 1.2055 37.235   14.987  28.817    21.719  44.887    20.706  5.0037 1.7550 6.1165 1.6532 -1.112849      2.411089  
1 1 1 14 10 17 o 8.8873 0.9680 88.109   16.472  78.503    24.698  95.807    22.107  8.2961 1.5454 9.4785 1.1662 -1.182459      1.936020  
1 1 1 14 10 18 o 11.804 0.8069 149.295  18.934  140.742   27.760  156.736   25.892  11.438 1.2135 12.170 1.0638 -0.7321920     1.613789  
1 1 1 14 10 19 o 4.2409 1.1818 15.551   14.572  19.402    22.655  12.833    19.031  4.4995 1.7510 3.9824 1.5878 0.5171239      2.363697  
1 1 1 14 10 20 o 8.3813 1.1828 75.415   17.948  107.462   33.169  62.148    21.342  9.4308 1.8245 7.3318 1.5058 2.099009       2.365678  
1 1 1 14 10 21 o 9.3813 1.0078 102.893  17.747  87.665    27.316  114.016   23.345  8.5220 1.6624 10.241 1.1398 -1.718605      2.015595  
1 1 1 14 10 22 o 4.8639 1.2016 29.070   14.366  23.315    24.534  32.073    17.722  4.6114 1.8141 5.1164 1.5763 -0.5049729     2.403276  
1 1 1 14 10 23 f 4.8318 1.3034 31.649   16.557  21.451    38.423  33.974    18.347  4.5897 2.0502 5.0739 1.6100 -0.4842186     2.606773  
1 1 1 14 10 24 o 3.0339 1.0522 -9.7465  12.732  -18.4728  40.228  -8.7752   13.422  3.6872 1.7838 2.3806 1.1164 1.306573       2.104374  
1 1 1 14 10 25 o 5.0630 1.1071 44.206   14.702  -2.6052   40.184  51.440    15.797  3.7461 1.8050 6.3800 1.2825 -2.633839      2.214216  
1 1 1 14 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 10 31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 11 0  o 2.2744 1.1099 -19.7966 16.483  -0.4516   25.066  -34.5328  21.878  2.7708 1.8155 1.7781 1.2774 -0.000000      0.000000  
1 1 1 14 11 1  o 6.4357 1.1204 47.768   14.337  50.394    19.882  44.924    20.692  6.6475 1.5275 6.2238 1.6395 0.4237123      2.240814  
1 1 1 14 11 2  o 15.720 0.6495 256.463  20.404  268.167   28.909  244.846   28.801  16.090 0.8984 15.350 0.9381 0.7395458      1.298904  
1 1 1 14 11 3  o 3.4953 1.0625 2.0752   13.400  3.0513    18.926  1.0940    18.975  3.5374 1.5109 3.4532 1.4943 0.8419704E-01  2.125080  
1 1 1 14 11 4  o 2.6172 0.8797 -19.9802 12.626  -14.2830  17.568  -26.0666  18.158  2.7494 1.2855 2.4850 1.2013 0.2643387      1.759445  
1 1 1 14 11 5  o 5.8407 1.1643 39.480   14.252  34.930    20.148  44.036    20.164  5.5085 1.6778 6.1729 1.6148 -0.6643434     2.328590  
1 1 1 14 11 6  o 4.4678 1.1215 19.727   13.312  7.8883    19.380  30.302    18.317  3.7836 1.5669 5.1520 1.6051 -1.368463      2.243055  
1 1 1 14 11 7  o 5.2201 1.1544 31.626   13.772  22.617    20.031  39.703    18.966  4.6192 1.6779 5.8210 1.5860 -1.201710      2.308832  
1 1 1 14 11 8  o 4.8676 1.0597 24.640   13.166  3.3640    18.770  45.246    18.472  3.4930 1.4987 6.2422 1.4986 -2.749182      2.119395  
1 1 1 14 11 9  o 10.592 0.7877 121.088  16.354  96.269    23.351  144.984   22.912  9.4357 1.2374 11.748 0.9751 -2.312358      1.575433  
1 1 1 14 11 10 o 13.260 0.7200 187.655  18.979  169.211   27.260  205.004   26.439  12.573 1.0841 13.947 0.9478 -1.374615      1.440030  
1 1 1 14 11 11 o 6.6689 1.1028 52.007   14.659  68.334    21.541  37.923    20.007  7.7161 1.4491 5.6217 1.6629 2.094371       2.205669  
1 1 1 14 11 12 o 7.1463 1.0750 59.469   14.883  60.504    21.508  58.518    20.616  7.1939 1.5413 7.0986 1.4991 0.9529352E-01  2.150076  
1 1 1 14 11 13 o 3.6791 1.0765 4.6713   13.358  17.265    19.914  -5.6291   18.010  4.2925 1.6495 3.0658 1.3837 1.226726       2.152998  
1 1 1 14 11 14 o 7.5006 1.1083 65.060   16.068  72.199    23.667  58.955    21.884  7.8991 1.5534 7.1022 1.5813 0.7969084      2.216683  
1 1 1 14 11 15 o 16.160 0.6676 275.274  21.519  266.196   31.243  283.467   29.681  15.872 0.9842 16.449 0.9022 -0.5774307     1.335175  
1 1 1 14 11 16 o 5.3662 1.2094 33.107   14.613  37.187    21.591  29.657    19.852  5.6269 1.7409 5.1055 1.6793 0.5213819      2.418853  
1 1 1 14 11 17 o 13.383 0.7550 190.237  20.143  179.646   29.071  200.016   27.935  12.987 1.1193 13.779 1.0137 -0.7925453     1.510062  
1 1 1 14 11 18 o 6.3646 1.2415 49.219   16.332  46.094    24.292  51.797    22.064  6.1377 1.8362 6.5914 1.6713 -0.4537783     2.482928  
1 1 1 14 11 19 o 12.050 0.8067 156.848  19.162  138.454   28.335  172.351   26.013  11.313 1.2523 12.788 1.0171 -1.474753      1.613309  
1 1 1 14 11 20 o 2.8670 0.9554 -18.2683 13.563  -4.2439   22.236  -26.5769  17.115  3.4020 1.5362 2.3320 1.1363 1.069996       1.910790  
1 1 1 14 11 21 o 11.415 0.8613 145.518  19.194  135.790   29.804  152.411   25.090  10.949 1.3610 11.880 1.0559 -0.9309807     1.722593  
1 1 1 14 11 22 o 4.7129 1.2375 26.773   15.209  30.916    24.642  24.224    19.331  4.9262 1.8482 4.4996 1.6462 0.4266329      2.475044  
1 1 1 14 11 23 o 10.469 1.0881 147.749  19.568  92.983    30.823  184.722   25.326  8.0132 1.9433 12.925 0.9798 -4.911328      2.176297  
1 1 1 14 11 24 o 5.2830 1.2857 43.700   16.384  41.851    28.008  44.662    20.202  5.0185 1.9485 5.5476 1.6779 -0.5291247     2.571395  
1 1 1 14 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 12 0  o 3.0676 1.3661 -2.1686  19.722  -29.8226  28.411  23.550    27.399  2.2406 1.5813 3.8945 2.2281 -0.000000      0.000000  
1 1 1 14 12 1  o 5.9858 1.1128 40.716   15.000  65.437    21.301  16.399    21.126  7.6341 1.4481 4.3375 1.6900 3.296593       2.225600  
1 1 1 14 12 2  o 9.9113 0.8354 105.408  16.392  90.401    23.401  119.863   22.968  9.1622 1.2770 10.660 1.0772 -1.498213      1.670712  
1 1 1 14 12 3  o 8.2191 0.9675 74.686   15.514  69.696    22.110  79.526    21.774  7.8538 1.4613 8.5844 1.2682 -0.7306042     1.934919  
1 1 1 14 12 4  o 7.1263 1.0923 59.114   15.124  51.978    21.924  65.592    20.889  6.6340 1.6572 7.6185 1.4233 -0.9845071     2.184536  
1 1 1 14 12 5  o 12.144 0.7086 155.536  17.193  154.870   24.824  156.151   23.836  12.104 1.0254 12.184 0.9782 -0.7957840E-01 1.417150  
1 1 1 14 12 6  o 12.089 0.7221 154.072  17.425  167.715   25.382  141.910   23.965  12.603 1.0070 11.576 1.0351 1.027444       1.444122  
1 1 1 14 12 7  o 4.5199 1.1096 16.669   14.125  39.867    20.558  -4.0725   19.439  5.7958 1.6775 3.2440 1.4530 2.551760       2.219295  
1 1 1 14 12 8  o 3.7289 1.0591 8.2766   12.770  -3.5625   18.591  18.853    17.571  3.1810 1.4231 4.2768 1.5688 -1.095792      2.118104  
1 1 1 14 12 9  o 14.351 0.6770 218.319  19.341  203.048   27.997  232.263   26.752  13.824 1.0126 14.878 0.8990 -1.054020      1.354080  
1 1 1 14 12 10 o 7.2503 1.0788 61.248   15.148  66.039    21.796  56.772    21.067  7.5507 1.4962 6.9498 1.5546 0.6009178      2.157625  
1 1 1 14 12 11 o 4.9840 1.0295 25.706   14.060  -8.3240   21.318  51.909    18.706  3.2364 1.4782 6.7317 1.4333 -3.495266      2.058997  
1 1 1 14 12 12 o 11.461 0.8163 142.386  18.403  119.142   26.705  163.406   25.395  10.476 1.2746 12.446 1.0202 -1.970372      1.632651  
1 1 1 14 12 13 o 9.4868 0.8788 97.701   16.661  94.152    23.656  101.194   23.471  9.2981 1.2721 9.6755 1.2129 -0.3774405     1.757648  
1 1 1 14 12 14 o 5.0176 1.2108 28.500   14.878  37.669    21.506  20.083    20.605  5.5864 1.7390 4.4487 1.6854 1.137630       2.421696  
1 1 1 14 12 15 o 4.1892 1.1669 14.763   14.332  12.535    21.906  16.431    18.949  4.1573 1.6874 4.2212 1.6122 -0.6387424E-01 2.333731  
1 1 1 14 12 16 o 14.695 0.7338 231.576  21.108  183.651   30.320  276.653   29.405  13.100 1.1572 16.289 0.9026 -3.188777      1.467577  
1 1 1 14 12 17 f 5.5834 1.3947 38.315   19.500  44.972    22.342  17.027    39.954  6.1118 1.7427 5.0549 2.1779 1.056883       2.789354  
1 1 1 14 12 18 o 3.1727 1.0015 -9.2137  13.347  7.9593    20.341  -22.1975  17.687  3.8281 1.5969 2.5174 1.2090 1.310723       2.002912  
1 1 1 14 12 19 o 6.2133 1.2504 49.153   16.795  36.174    25.491  59.109    22.325  5.4184 1.9013 7.0082 1.6245 -1.589764      2.500782  
1 1 1 14 12 20 o 8.6030 1.0825 88.363   17.760  76.186    26.860  97.823    23.674  7.8217 1.7596 9.3843 1.2614 -1.562602      2.165007  
1 1 1 14 12 21 o 3.5314 1.0876 4.6123   14.305  -0.9227   23.185  8.0144    18.177  3.5006 1.5758 3.5621 1.4993 -0.6150174E-01 2.175118  
1 1 1 14 12 22 o 6.1643 1.2363 55.235   16.148  46.867    26.769  60.023    20.248  5.5146 1.9472 6.8141 1.5239 -1.299478      2.472645  
1 1 1 14 12 23 f 4.9066 1.1626 35.693   14.921  16.459    25.573  45.621    18.373  3.9976 1.7323 5.8157 1.5511 -1.818085      2.325286  
1 1 1 14 12 24 o 6.7451 1.2102 62.823   16.857  104.886   27.841  38.477    21.181  8.5431 1.6893 4.9471 1.7333 3.595988       2.420328  
1 1 1 14 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 12 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 13 0  o 2.2869 1.1345 -24.9113 19.758  -25.1603  27.906  -24.6611  27.979  2.2802 1.6005 2.2937 1.6084 -0.000000      0.000000  
1 1 1 14 13 1  o 10.888 0.7944 125.631  17.194  108.556   23.211  146.396   25.596  10.056 1.1541 11.720 1.0920 -1.663951      1.588789  
1 1 1 14 13 2  o 11.484 0.8022 144.190  17.900  174.007   24.714  111.286   25.962  12.868 0.9603 10.100 1.2853 2.768680       1.604382  
1 1 1 14 13 3  o 6.6403 1.0961 52.444   15.267  72.891    21.089  29.931    22.129  8.1747 1.2899 5.1059 1.7726 3.068832       2.192274  
1 1 1 14 13 4  o 4.6027 1.1816 22.416   14.090  19.528    20.015  25.253    19.839  4.4258 1.6647 4.7796 1.6773 -0.3537769     2.363160  
1 1 1 14 13 5  o 4.3122 1.1549 17.174   13.968  9.5564    19.432  25.317    20.091  3.8410 1.5776 4.7834 1.6872 -0.9424527     2.309822  
1 1 1 14 13 6  o 4.6659 1.1895 22.533   14.744  34.387    21.322  11.672    20.410  5.3552 1.7394 3.9767 1.6231 1.378477       2.379051  
1 1 1 14 13 7  o 15.815 0.6771 264.204  21.386  248.001   30.149  280.613   30.340  15.303 0.9851 16.328 0.9291 -1.025438      1.354110  
1 1 1 14 13 8  f 5.1905 1.1832 31.815   14.457  21.764    21.231  40.504    19.740  4.5626 1.7148 5.8183 1.6308 -1.255624      2.366456  
1 1 1 14 13 9  o 6.9765 1.1709 58.437   16.114  53.840    23.324  62.634    22.288  6.6521 1.7350 7.3009 1.5728 -0.6488032     2.341794  
1 1 1 14 13 10 o 10.303 0.8593 114.647  17.572  98.383    24.613  131.553   25.095  9.5063 1.2946 11.101 1.1303 -1.594329      1.718606  
1 1 1 14 13 11 o 4.9894 1.2130 28.256   14.694  25.250    21.438  30.921    20.180  4.8137 1.7378 5.1652 1.6929 -0.3514695     2.426059  
1 1 1 14 13 12 f 8.8780 0.9362 86.257   16.568  96.333    24.249  77.436    22.691  9.3809 1.2925 8.3751 1.3546 1.005871       1.872319  
1 1 1 14 13 13 o 4.1331 1.1571 10.001   14.736  28.457    23.019  -2.8155   19.182  5.0089 1.8017 3.2573 1.4523 1.751599       2.314129  
1 1 1 14 13 14 o 3.6793 1.1100 3.3718   14.706  -5.0228   21.563  10.671    20.107  3.3946 1.5247 3.9641 1.6137 -0.5695074     2.220047  
1 1 1 14 13 15 o 3.7237 1.1107 4.4445   14.384  13.948    21.189  -3.6778   19.589  4.1729 1.6715 3.2745 1.4632 0.8983924      2.221401  
1 1 1 14 13 16 o 4.2328 1.1884 13.437   15.182  24.137    22.997  5.1714    20.212  4.7838 1.7873 3.6818 1.5667 1.102056       2.376774  
1 1 1 14 13 17 o 5.4505 1.1857 34.943   15.506  15.633    23.358  50.157    20.733  4.3594 1.7518 6.5417 1.5983 -2.182277      2.371377  
1 1 1 14 13 18 o 3.2746 1.0283 -3.9092  14.180  -23.6124  23.340  7.6183    17.852  2.9469 1.4082 3.6022 1.4988 -0.6552236     2.056514  
1 1 1 14 13 19 o 3.8037 1.2371 -4.7672  20.391  6.2328    22.823  -48.2753  45.391  3.8154 1.6450 3.7919 1.8482 0.2349472E-01  2.474263  
1 1 1 14 13 20 o 6.5227 1.2583 54.523   16.872  64.911    25.389  46.307    22.579  7.0757 1.7922 5.9696 1.7668 1.106030       2.516599  
1 1 1 14 13 21 o 4.7237 1.3247 29.327   17.889  34.558    31.148  26.753    21.853  4.9142 2.0054 4.5332 1.7313 0.3809509      2.649303  
1 1 1 14 13 22 o 3.5683 1.1016 6.8018   15.589  -9.6749   25.172  17.053    19.855  3.2111 1.5131 3.9256 1.6014 -0.7144659     2.203189  
1 1 1 14 13 23 o 3.8275 1.0892 17.540   14.000  -0.5490   23.478  27.521    17.440  3.2577 1.5106 4.3973 1.5697 -1.139637      2.178474  
1 1 1 14 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 13 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 14 0  o 11.252 1.3113 147.278  27.027  143.558   38.913  150.746   37.567  11.036 1.9428 11.467 1.7616 -0.000000      0.000000  
1 1 1 14 14 1  f 9.5259 0.9128 99.346   17.365  93.903    23.811  105.531   25.379  9.2504 1.2870 9.8013 1.2947 -0.5508575     1.825521  
1 1 1 14 14 2  o 3.7615 1.1154 4.7010   14.613  -6.5836   19.826  18.122    21.621  3.1594 1.4362 4.3637 1.7071 -1.204356      2.230890  
1 1 1 14 14 3  o 12.863 0.7313 176.013  18.786  163.325   26.070  189.720   27.096  12.366 1.0541 13.360 1.0141 -0.9935608     1.462690  
1 1 1 14 14 4  o 12.867 0.7423 176.011  19.000  152.798   26.135  202.035   27.672  11.935 1.0949 13.799 1.0027 -1.864560      1.484632  
1 1 1 14 14 5  o 4.3179 1.1576 17.065   14.252  27.762    20.471  7.0035    19.854  4.9162 1.7051 3.7195 1.5663 1.196700       2.315266  
1 1 1 14 14 6  o 8.7841 1.0270 92.862   16.421  40.306    22.933  148.163   23.525  5.7374 1.7974 11.831 0.9942 -6.093264      2.054014  
1 1 1 14 14 7  o 11.918 0.7653 151.668  18.241  151.435   25.793  151.900   25.800  11.908 1.0830 11.927 1.0815 -0.1929379E-01 1.530561  
1 1 1 14 14 8  o 7.5911 1.0659 68.729   15.771  39.448    22.797  95.607    21.842  5.7345 1.7913 9.4477 1.1559 -3.713249      2.131871  
1 1 1 14 14 9  o 5.3533 1.2659 33.613   15.947  31.700    23.534  35.237    21.684  5.2442 1.8276 5.4624 1.7521 -0.2181096     2.531796  
1 1 1 14 14 10 o 4.3446 1.1885 15.722   15.241  27.832    22.044  4.6302    21.096  4.9750 1.7659 3.7141 1.5911 1.260937       2.376957  
1 1 1 14 14 11 o 6.7873 1.2145 55.525   16.507  62.677    24.278  49.376    22.510  7.2043 1.7105 6.3704 1.7245 0.8339067      2.428958  
1 1 1 14 14 12 o 10.229 0.9001 114.588  18.247  103.628   26.641  124.273   25.043  9.6972 1.3736 10.761 1.1636 -1.063720      1.800232  
1 1 1 14 14 13 o 7.9397 1.0957 72.573   16.954  105.447   24.583  42.757    23.412  9.8981 1.2418 5.9814 1.8056 3.916739       2.191456  
1 1 1 14 14 14 o 5.0921 1.2631 29.254   15.963  26.322    23.014  31.973    22.161  4.9258 1.7971 5.2584 1.7754 -0.3325887     2.526184  
1 1 1 14 14 15 o 9.5939 0.9691 101.771  18.499  92.555    26.468  110.571   25.865  9.1133 1.4522 10.075 1.2837 -0.9612341     1.938197  
1 1 1 14 14 16 o 4.0907 1.1723 9.3482   15.982  -7.4224   23.540  23.686    21.766  3.4477 1.5664 4.7338 1.7446 -1.286089      2.344594  
1 1 1 14 14 17 o 11.480 0.8712 144.979  19.885  136.301   29.060  152.621   27.270  11.090 1.3102 11.870 1.1487 -0.7800894     1.742465  
1 1 1 14 14 18 o 7.2085 1.2222 64.888   17.309  60.757    26.574  67.933    22.812  6.8718 1.8794 7.5453 1.5631 -0.6735020     2.444460  
1 1 1 14 14 19 o 10.164 1.3078 140.863  22.821  104.911   40.984  157.019   27.474  8.3944 2.3488 11.934 1.1511 -3.539358      2.615685  
1 1 1 14 14 20 o 3.3836 1.0874 -2.6655  15.642  6.5462    25.056  -8.5486   20.024  3.7804 1.6740 2.9868 1.3884 0.7935565      2.174864  
1 1 1 14 14 21 o 3.7476 1.1389 9.9633   15.307  19.306    23.496  3.0741    20.176  4.1505 1.7225 3.3448 1.4905 0.8057678      2.277849  
1 1 1 14 14 22 o 4.3704 1.2380 25.419   16.449  39.839    25.628  15.317    21.450  4.9566 1.8792 3.7843 1.6123 1.172271       2.476042  
1 1 1 14 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 0  o 17.601 0.9347 328.021  32.337  369.119   48.151  294.257   43.643  18.624 1.3075 16.579 1.3362 -0.000000      0.000000  
1 1 1 14 15 1  o 4.2941 1.1646 15.255   14.917  1.2418    20.926  29.734    21.271  3.5393 1.5498 5.0490 1.7388 -1.509701      2.329221  
1 1 1 14 15 2  o 14.841 0.7072 233.215  20.974  245.980   30.026  221.049   29.312  15.250 0.9844 14.431 1.0156 0.8187008      1.414383  
1 1 1 14 15 3  o 10.389 0.8716 117.590  18.014  132.699   25.835  103.296   25.129  11.083 1.1655 9.6937 1.2962 1.389573       1.743110  
1 1 1 14 15 4  o 5.0586 1.2328 29.126   15.414  21.113    21.683  37.313    21.916  4.5506 1.7277 5.5665 1.7589 -1.015903      2.465536  
1 1 1 14 15 5  o 4.4759 1.0998 17.560   14.379  -8.2521   21.601  38.099    19.269  3.2671 1.4905 5.6847 1.6175 -2.417551      2.199583  
1 1 1 14 15 6  o 8.4028 1.0389 79.238   16.880  96.890    24.632  63.607    23.178  9.4295 1.3061 7.3761 1.6159 2.053389       2.077720  
1 1 1 14 15 7  o 12.376 0.7813 162.964  19.330  167.105   27.834  159.105   26.866  12.523 1.1113 12.228 1.0985 0.2948141      1.562607  
1 1 1 14 15 8  o 6.8913 1.2074 56.443   16.524  62.548    24.527  51.369    22.360  7.2286 1.7212 6.5539 1.6937 0.6747346      2.414794  
1 1 1 14 15 9  o 4.2494 1.1945 15.225   15.384  21.782    21.841  8.7688    21.673  4.5854 1.7357 3.9135 1.6416 0.6719472      2.389031  
1 1 1 14 15 10 o 4.7744 1.2472 23.264   16.406  35.414    23.189  11.087    23.214  5.4378 1.8162 4.1110 1.7097 1.326822       2.494308  
1 1 1 14 15 11 o 6.4290 1.2381 49.356   16.415  54.192    23.035  44.366    23.398  6.7695 1.7029 6.0886 1.7976 0.6808605      2.476101  
1 1 1 14 15 12 o 5.6868 1.2615 38.673   16.364  28.953    23.978  47.146    22.387  5.0949 1.8381 6.2787 1.7282 -1.183862      2.522955  
1 1 1 14 15 13 o 8.2635 1.1148 78.620   17.745  83.048    25.522  74.478    24.688  8.5064 1.5576 8.0207 1.5952 0.4857159      2.229516  
1 1 1 14 15 14 o 7.2342 1.1513 59.431   17.064  89.775    25.878  36.086    22.698  8.9728 1.4420 5.4956 1.7951 3.477147       2.302594  
1 1 1 14 15 15 o 4.1701 1.1443 9.0470   15.964  -19.0729  24.137  30.912    21.284  3.1596 1.4867 5.1805 1.7400 -2.020933      2.288602  
1 1 1 14 15 16 o 9.1273 1.0999 99.886   18.864  76.125    28.131  119.301   25.429  7.8139 1.8319 10.441 1.2178 -2.626854      2.199744  
1 1 1 14 15 17 o 13.313 0.8288 193.928  22.026  192.352   32.010  195.346   30.354  13.223 1.2104 13.402 1.1324 -0.1787291     1.657544  
1 1 1 14 15 18 o 5.4238 1.2734 33.880   17.653  60.659    26.469  12.427    23.691  6.7748 1.8847 4.0728 1.7128 2.702053       2.546724  
1 1 1 14 15 19 o 3.3632 1.0834 -5.9852  16.842  -25.1548  25.811  8.2289    22.226  2.9905 1.4423 3.7360 1.6170 -0.7455788     2.166800  
1 1 1 14 15 20 o 4.7570 1.2818 31.509   17.399  21.772    27.916  37.694    22.249  4.3539 1.8466 5.1600 1.7782 -0.8060961     2.563617  
1 1 1 14 15 21 o 3.0078 1.0382 -16.3652 16.503  -22.6382  36.398  -14.7420  18.516  3.4043 1.6584 2.6114 1.2496 0.7928851      2.076432  
1 1 1 14 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 15 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 0  o 13.854 1.0748 209.877  28.710  189.285   40.282  231.139   40.930  13.078 1.6048 14.631 1.4302 -0.000000      0.000000  
1 1 1 14 16 1  o 5.3034 1.2561 32.755   15.695  31.137    22.024  34.423    22.373  5.1963 1.7698 5.4105 1.7830 -0.2141399     2.512214  
1 1 1 14 16 2  o 5.6407 1.2227 37.605   15.547  26.911    22.167  47.959    21.811  4.9345 1.7688 6.3469 1.6887 -1.412413      2.445430  
1 1 1 14 16 3  o 15.611 0.6976 256.053  21.764  269.528   31.192  243.270   30.381  16.021 0.9735 15.201 0.9993 0.8198776      1.395107  
1 1 1 14 16 4  o 8.6727 1.0543 86.760   17.326  111.096   24.358  61.836    24.651  10.158 1.1989 7.1872 1.7347 2.971013       2.108692  
1 1 1 14 16 5  o 5.8609 1.2326 41.047   15.868  51.440    22.530  30.817    22.353  6.5550 1.7031 5.1669 1.7823 1.388105       2.465146  
1 1 1 14 16 6  o 8.5070 1.3267 102.020  21.734  122.621   25.958  53.715    39.748  10.637 1.2202 6.3776 2.3562 4.258943       2.653409  
1 1 1 14 16 7  o 5.4877 1.2612 36.160   16.076  43.649    22.813  28.773    22.658  5.9672 1.7781 5.0082 1.7890 0.9590168      2.522355  
1 1 1 14 16 8  o 4.1387 1.1313 8.0947   15.524  -17.5467  22.261  32.370    21.660  3.0345 1.4278 5.2429 1.7553 -2.208400      2.262631  
1 1 1 14 16 9  o 10.266 0.9210 114.363  18.604  140.904   26.981  90.310    25.685  11.478 1.1754 9.0554 1.4182 2.422185       1.841987  
1 1 1 14 16 10 o 3.4757 1.0986 -3.6118  15.580  -4.3267   23.075  -3.0129   21.121  3.5252 1.5807 3.4263 1.5260 0.9883213E-01  2.197112  
1 1 1 14 16 11 o 5.2594 1.2911 31.721   16.587  34.232    24.097  29.460    22.867  5.4114 1.8512 5.1074 1.8001 0.3039274      2.582132  
1 1 1 14 16 12 o 4.2038 1.1954 12.785   16.031  0.0664    24.213  22.712    21.391  3.7467 1.6530 4.6609 1.7272 -0.9142005     2.390744  
1 1 1 14 16 13 o 3.7352 1.1368 2.2463   16.062  -13.6049  24.907  13.533    21.017  3.3481 1.5537 4.1224 1.6599 -0.7743104     2.273614  
1 1 1 14 16 14 o 15.917 0.7377 269.545  23.293  252.359   34.440  284.033   31.623  15.381 1.1196 16.454 0.9610 -1.072765      1.475430  
1 1 1 14 16 15 o 12.458 0.8448 170.126  20.948  157.618   30.201  181.723   29.081  11.952 1.2634 12.963 1.1217 -1.010655      1.689504  
1 1 1 14 16 16 o 4.7976 1.3120 24.071   18.592  10.902    26.588  36.672    26.009  4.1908 1.7905 5.4045 1.9182 -1.213671      2.623968  
1 1 1 14 16 17 o 5.2777 1.3546 35.652   18.916  25.487    27.467  44.822    26.089  4.7660 1.9052 5.7894 1.9262 -1.023417      2.709188  
1 1 1 14 16 18 o 5.8669 1.3515 49.801   19.175  34.352    29.455  61.164    25.261  5.0420 1.9864 6.6918 1.8333 -1.649772      2.703074  
1 1 1 14 16 19 o 8.8293 1.1889 102.814  20.395  101.447   30.565  103.911   27.383  8.5353 1.8443 9.1232 1.5007 -0.5878630     2.377751  
1 1 1 14 16 20 o 3.4102 1.0593 -1.6197  16.197  -37.3402  25.392  22.885    21.031  2.6402 1.3056 4.1802 1.6684 -1.540051      2.118527  
1 1 1 14 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 16 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 0  o 3.8286 1.6346 20.305   22.874  13.024    30.712  29.375    34.279  3.4468 2.1582 4.2103 2.4555 -0.000000      0.000000  
1 1 1 14 17 1  f 12.497 0.7848 166.827  19.576  161.137   26.703  173.439   28.784  12.285 1.0869 12.710 1.1323 -0.4259214     1.569524  
1 1 1 14 17 2  o 4.6050 1.2103 17.538   15.972  0.7616    21.295  39.110    24.148  3.5516 1.5591 5.6585 1.8517 -2.106946      2.420671  
1 1 1 14 17 3  o 5.9363 1.2942 43.830   17.205  51.220    23.332  35.023    25.470  6.4695 1.7576 5.4030 1.9003 1.066543       2.588467  
1 1 1 14 17 4  o 13.781 0.7552 202.573  20.812  208.133   29.683  197.197   29.188  13.972 1.0622 13.591 1.0738 0.3813000      1.510444  
1 1 1 14 17 5  o 6.0843 1.2957 45.585   17.149  40.862    24.612  50.042    23.908  5.7774 1.8681 6.3912 1.7959 -0.6138186     2.591339  
1 1 1 14 17 6  o 12.958 0.7975 179.171  20.574  201.138   29.506  158.385   28.703  13.771 1.0713 12.145 1.1817 1.625822       1.595007  
1 1 1 14 17 7  f 4.6792 1.2626 20.642   16.546  28.255    24.316  14.077    22.581  5.0887 1.8487 4.2697 1.7201 0.8190179      2.525124  
1 1 1 14 17 8  o 11.915 0.8609 153.201  20.189  186.577   29.023  121.906   28.103  13.258 1.0946 10.572 1.3291 2.685603       1.721813  
1 1 1 14 17 9  f 20.123 0.6602 423.314  26.560  423.046   38.113  423.567   37.032  20.103 0.9479 20.143 0.9193 -0.3919983E-01 1.320456  
1 1 1 14 17 10 o 8.8779 1.1273 91.947   19.169  72.515    27.869  109.395   26.407  7.7418 1.8290 10.014 1.3185 -2.272174      2.254690  
1 1 1 14 17 11 f 5.9002 1.3289 42.797   17.720  39.395    26.094  45.708    24.139  5.6922 1.9265 6.1082 1.8311 -0.4160352     2.657889  
1 1 1 14 17 12 o 5.7358 1.3137 39.605   17.782  27.664    26.259  49.719    24.166  5.0687 1.9066 6.4030 1.8078 -1.334335      2.627470  
1 1 1 14 17 13 o 9.1727 1.0871 96.492   19.524  103.021   28.427  90.662    26.861  9.5394 1.4900 8.8060 1.5834 0.7333736      2.174194  
1 1 1 14 17 14 o 10.691 0.9717 127.735  20.712  140.470   30.728  117.133   28.038  11.175 1.3748 10.206 1.3736 0.9694595      1.943405  
1 1 1 14 17 15 o 9.5606 1.1541 109.078  21.542  118.809   30.886  99.861    30.060  10.105 1.5282 9.0162 1.7299 1.088867       2.308289  
1 1 1 14 17 16 o 5.2227 1.3898 35.420   20.042  27.520    30.227  41.617    26.773  4.8820 1.9819 5.5634 1.9488 -0.6813793     2.779505  
1 1 1 14 17 17 o 3.4226 1.1260 -8.4185  18.495  1.3310    28.086  -15.8841  24.577  3.7475 1.7058 3.0976 1.4702 0.6499293      2.251929  
1 1 1 14 17 18 o 3.4975 1.1109 -1.6168  17.634  -30.6162  28.583  16.203    22.406  3.0001 1.4633 3.9949 1.6720 -0.9947808     2.221896  
1 1 1 14 17 19 o 4.0495 1.1697 11.820   18.313  -28.6556  28.226  41.240    24.065  2.9458 1.4405 5.1531 1.8434 -2.207336      2.339454  
1 1 1 14 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 0  o 3.4657 1.5355 9.6489   22.462  -2.9635   30.840  23.899    32.781  2.9516 1.9607 3.9797 2.3635 -0.000000      0.000000  
1 1 1 14 18 1  o 7.4909 1.2155 66.419   17.834  62.664    25.075  70.262    25.369  7.2511 1.7492 7.7308 1.6881 -0.4796848     2.430942  
1 1 1 14 18 2  o 4.7193 1.2558 22.569   16.122  21.022    23.380  23.972    22.262  4.6552 1.7877 4.7834 1.7641 -0.1282120     2.511553  
1 1 1 14 18 3  o 5.9634 1.2764 42.484   16.588  45.816    22.879  38.791    24.084  6.2035 1.7617 5.7233 1.8476 0.4802527      2.552897  
1 1 1 14 18 4  o 11.717 0.8454 147.183  19.769  156.044   27.792  138.108   28.125  12.105 1.1480 11.330 1.2412 0.7751389      1.690719  
1 1 1 14 18 5  o 17.665 0.6754 326.424  23.850  340.940   34.292  312.825   33.193  18.049 0.9500 17.280 0.9604 0.7686825      1.350878  
1 1 1 14 18 6  o 3.1413 1.0232 -18.9196 15.853  -41.7918  22.661  3.0036    22.186  2.5543 1.2574 3.7283 1.6146 -1.174070      2.046482  
1 1 1 14 18 7  o 5.6000 1.2933 36.334   17.123  48.736    24.738  24.928    23.724  6.3341 1.8421 4.8660 1.8158 1.468163       2.586644  
1 1 1 14 18 8  o 5.6419 1.3366 38.108   17.768  39.549    25.297  36.704    24.963  5.7282 1.8963 5.5556 1.8842 0.1725936      2.673223  
1 1 1 14 18 9  o 16.966 0.7136 304.470  24.172  286.294   34.292  322.419   34.078  16.430 1.0436 17.501 0.9736 -1.070644      1.427205  
1 1 1 14 18 10 o 7.3075 1.2572 65.107   18.853  87.686    26.755  42.837    26.570  8.7002 1.5964 5.9147 1.9427 2.785498       2.514491  
1 1 1 14 18 11 o 10.685 0.9964 128.240  20.867  103.787   29.958  151.286   29.083  9.5573 1.5673 11.813 1.2309 -2.256152      1.992875  
1 1 1 14 18 12 o 4.6248 1.3052 20.708   18.255  25.651    26.379  16.165    25.288  4.8650 1.8904 4.3847 1.8001 0.4803281      2.610389  
1 1 1 14 18 13 o 20.644 0.6981 453.281  28.791  480.651   41.894  428.784   39.634  21.234 0.9865 20.054 0.9882 1.180586       1.396295  
1 1 1 14 18 14 o 6.9048 1.3654 62.735   21.231  92.318    30.497  34.916    29.574  8.5226 1.8428 5.2871 2.0153 3.235562       2.730797  
1 1 1 14 18 15 o 3.7831 1.2042 -10.3395 19.825  23.757    30.813  -34.4247  25.897  4.7145 1.9659 2.8518 1.3913 1.862756       2.408458  
1 1 1 14 18 16 o 4.7664 1.3018 29.374   19.424  6.2035    29.180  47.811    26.029  3.8754 1.7541 5.6573 1.9240 -1.781860      2.603582  
1 1 1 14 18 17 o 3.9193 1.1985 9.5675   18.688  -14.4932  28.911  26.836    24.493  3.3216 1.5816 4.5170 1.8012 -1.195418      2.397076  
1 1 1 14 18 18 o 3.2816 1.0955 -7.0643  18.506  -6.5729   29.027  -7.4009   24.021  3.4102 1.6124 3.1531 1.4834 0.2571099      2.190978  
1 1 1 14 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 18 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 0  o 4.3216 1.7119 29.300   23.046  44.112    33.470  15.947    31.779  5.0259 2.5945 3.6173 2.2339 -0.000000      0.000000  
1 1 1 14 19 1  o 11.169 0.8867 135.775  19.638  149.750   27.236  120.641   28.343  11.839 1.1503 10.500 1.3497 1.338711       1.773340  
1 1 1 14 19 2  o 7.7106 1.1687 68.449   17.963  48.489    24.467  91.789    26.457  6.3233 1.8300 9.0978 1.4540 -2.774477      2.337335  
1 1 1 14 19 3  o 14.243 0.7568 216.020  21.401  191.718   30.692  239.016   29.856  13.401 1.1451 15.084 0.9896 -1.683322      1.513516  
1 1 1 14 19 4  o 13.969 0.7659 207.710  21.264  199.852   31.464  214.315   28.849  13.673 1.1505 14.264 1.0112 -0.5912075     1.531768  
1 1 1 14 19 5  o 7.5406 1.2780 69.100   19.019  64.982    27.994  72.630    25.919  7.2536 1.9051 7.8275 1.7040 -0.5738626     2.555961  
1 1 1 14 19 6  o 10.529 0.9941 120.144  19.813  166.714   30.604  86.543    25.996  12.402 1.2338 8.6560 1.5590 3.746187       1.988150  
1 1 1 14 19 7  f 12.678 0.8547 174.435  21.329  211.355   30.569  139.410   29.774  14.084 1.0853 11.273 1.3206 2.810992       1.709324  
1 1 1 14 19 8  o 5.4336 1.3574 34.128   18.458  39.119    26.572  29.475    25.658  5.7109 1.9440 5.1562 1.8951 0.5547438      2.714839  
1 1 1 14 19 9  o 6.2970 1.3550 49.273   18.763  57.801    26.914  41.209    26.172  6.8042 1.9032 5.7898 1.9294 1.014407       2.710078  
1 1 1 14 19 10 o 10.860 1.0216 134.114  21.822  161.570   31.216  107.870   30.519  12.081 1.2920 9.6402 1.5829 2.440505       2.043222  
1 1 1 14 19 11 o 3.9596 1.1911 -2.1425  18.460  27.789    26.477  -30.4555  25.751  4.9503 1.9021 2.9689 1.4341 1.981417       2.382120  
1 1 1 14 19 12 o 8.4293 1.3308 89.510   21.792  104.267   32.970  78.062    29.040  9.0612 1.8809 7.7974 1.8833 1.263815       2.661688  
1 1 1 14 19 13 o 7.6992 1.4251 80.437   22.177  87.042    32.536  74.706    30.308  7.9900 2.0315 7.4083 1.9992 0.5817204      2.850251  
1 1 1 14 19 14 o 7.6659 1.3901 82.603   21.761  68.266    31.881  95.109    29.776  6.8010 2.1173 8.5309 1.8017 -1.729861      2.780148  
1 1 1 14 19 15 o 3.9005 1.2211 2.3280   19.796  32.435    29.808  -21.4290  26.478  4.7651 1.9551 3.0359 1.4634 1.729173       2.442120  
1 1 1 14 19 16 o 4.0408 1.2502 14.257   19.729  1.8028    29.845  23.923    26.293  3.7214 1.7177 4.3602 1.8169 -0.6387689     2.500342  
1 1 1 14 19 17 o 3.2633 1.0923 -7.7999  18.692  -2.5474   28.528  -11.7509  24.742  3.4596 1.6241 3.0671 1.4612 0.3925312      2.184687  
1 1 1 14 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 19 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 0  o 3.4622 1.4773 -5.2193  23.371  40.242    31.994  -57.2270  34.220  4.7858 2.5184 2.1386 1.5452 -0.000000      0.000000  
1 1 1 14 20 1  o 13.273 0.8164 190.418  21.509  204.325   29.526  174.693   31.398  13.861 1.0651 12.684 1.2376 1.176397       1.632836  
1 1 1 14 20 2  o 6.4074 1.3036 50.575   17.648  54.544    24.991  46.627    24.924  6.6654 1.8224 6.1494 1.8645 0.5160742      2.607222  
1 1 1 14 20 3  f 5.1321 1.3241 29.196   17.679  35.804    26.236  23.700    23.928  5.4877 1.9287 4.7764 1.8146 0.7113004      2.648171  
1 1 1 14 20 4  o 14.304 0.8076 218.589  23.096  212.846   32.096  224.756   33.259  14.114 1.1370 14.495 1.1473 -0.3811045     1.615251  
1 1 1 14 20 5  o 8.7857 1.1772 88.044   19.989  134.505   30.253  52.043    26.630  11.073 1.3661 6.4985 1.9175 4.574363       2.354304  
1 1 1 14 20 6  o 9.8663 1.1365 113.924  21.393  97.272    31.738  127.790   28.960  8.9585 1.8331 10.774 1.3440 -1.815599      2.273038  
1 1 1 14 20 7  o 3.2790 1.0892 -17.4104 18.187  -19.7790  26.621  -15.3375  24.904  3.2839 1.5500 3.2740 1.5307 0.9853363E-02  2.178493  
1 1 1 14 20 8  o 5.8166 1.2957 41.119   19.703  8.5138    29.188  68.416    26.706  4.2456 1.8453 7.3877 1.8195 -3.142092      2.591444  
1 1 1 14 20 9  o 10.007 1.1243 117.160  22.478  118.644   32.584  115.813   31.050  10.037 1.6232 9.9776 1.5560 0.5921078E-01  2.248550  
1 1 1 14 20 10 o 5.1398 1.3742 26.454   20.423  53.314    31.249  6.4254    26.984  6.2459 2.1082 4.0338 1.7633 2.212097       2.748439  
1 1 1 14 20 11 o 4.1474 1.2760 9.2881   19.889  2.9349    29.894  14.334    26.641  4.0189 1.8008 4.2759 1.8082 -0.2569885     2.551961  
1 1 1 14 20 12 o 4.8221 1.2656 14.059   21.492  -41.3892  31.872  60.295    29.104  3.1117 1.5235 6.5325 2.0213 -3.420775      2.531142  
1 1 1 14 20 13 o 10.140 1.1861 134.890  23.096  120.025   33.857  147.826   31.585  9.2789 1.8887 11.002 1.4354 -1.723036      2.372231  
1 1 1 14 20 14 o 4.9177 1.4004 35.159   21.203  32.326    30.604  37.773    29.403  4.7990 1.9764 5.0365 1.9845 -0.2374945     2.800788  
1 1 1 14 20 15 o 8.2806 1.3648 104.226  22.278  91.601    33.592  114.138   29.766  7.4175 2.1436 9.1437 1.6900 -1.726205      2.729651  
1 1 1 14 20 16 o 3.2478 1.0860 -7.5625  18.954  -20.5889  27.823  3.7190    25.892  3.0137 1.4639 3.4819 1.6046 -0.4682562     2.172065  
1 1 1 14 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 20 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 0  o 5.5179 1.9867 55.524   28.624  70.837    40.502  40.244    40.458  6.3307 2.9144 4.7052 2.7007 -0.000000      0.000000  
1 1 1 14 21 1  o 3.0585 1.0294 -25.9578 17.743  -44.0669  26.368  -10.9737  23.985  2.7838 1.3676 3.3332 1.5390 -0.5493593     2.058850  
1 1 1 14 21 2  o 9.3057 1.1486 103.228  20.288  134.309   28.822  72.701    28.564  11.016 1.3082 7.5954 1.8884 3.420646       2.297256  
1 1 1 14 21 3  o 6.4038 1.4049 53.204   19.876  49.589    27.566  57.119    28.687  6.1927 1.9744 6.6149 1.9991 -0.4222331     2.809740  
1 1 1 14 21 4  o 6.4910 1.2410 49.302   19.425  91.389    28.490  12.740    26.554  8.6933 1.6995 4.2886 1.8089 4.404631       2.482059  
1 1 1 14 21 5  o 4.2660 1.2674 8.6442   19.205  27.765    27.819  -8.7653   26.545  4.9838 1.9401 3.5482 1.6313 1.435552       2.534733  
1 1 1 14 21 6  o 6.9270 1.3130 62.347   20.694  29.263    29.624  93.880    28.921  5.0738 1.9942 8.7802 1.7084 -3.706433      2.625953  
1 1 1 14 21 7  o 8.8337 1.2687 95.685   21.453  108.442   33.188  86.529    28.118  9.2884 1.8515 8.3790 1.7350 0.9094000      2.537379  
1 1 1 14 21 8  o 8.1958 1.3646 85.994   22.228  113.045   33.488  64.690    29.718  9.4706 1.8343 6.9210 2.0209 2.549654       2.729214  
1 1 1 14 21 9  o 6.1111 1.4249 48.788   20.226  69.573    32.087  35.085    26.054  7.0004 2.1140 5.2217 1.9111 1.778737       2.849766  
1 1 1 14 21 10 o 4.6552 1.3232 18.978   21.354  -12.8258  31.903  44.789    28.741  3.6505 1.7150 5.6599 2.0156 -2.009372      2.646470  
1 1 1 14 21 11 o 4.3382 1.3204 16.039   21.053  35.277    31.705  0.8656    28.156  4.9735 2.0257 3.7029 1.6941 1.270639       2.640724  
1 1 1 14 21 12 o 3.9709 1.2352 4.3101   21.140  -29.8235  31.690  31.679    28.377  3.1795 1.5486 4.7623 1.9248 -1.582745      2.470422  
1 1 1 14 21 13 o 13.883 0.9226 232.819  25.414  217.872   37.217  245.878   34.788  13.284 1.4008 14.481 1.2011 -1.196935      1.845227  
1 1 1 14 21 14 o 4.1737 1.2692 19.939   20.307  0.0332    30.860  35.141    26.968  3.6211 1.6965 4.7262 1.8883 -1.105130      2.538462  
1 1 1 14 21 15 o 3.7523 1.2145 11.092   20.497  11.759    29.088  10.433    28.887  3.7729 1.7246 3.7316 1.7105 0.4133654E-01  2.428942  
1 1 1 14 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 21 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 0  o 12.506 1.4465 183.873  32.240  234.586   48.917  144.926   42.868  14.303 1.7852 10.710 2.2766 -0.000000      0.000000  
1 1 1 14 22 1  o 4.6065 1.2738 15.834   19.665  -16.0875  29.341  41.870    26.498  3.5169 1.6498 5.6960 1.9413 -2.179113      2.547601  
1 1 1 14 22 2  o 5.0787 1.3889 29.472   20.501  18.755    29.273  39.789    28.720  4.5972 1.9165 5.5603 2.0108 -0.9631348     2.777831  
1 1 1 14 22 3  o 5.4142 1.3490 33.120   20.196  7.7097    28.172  59.986    28.967  4.1341 1.8046 6.6944 2.0057 -2.560347      2.698023  
1 1 1 14 22 4  o 8.3137 1.5286 101.512  26.199  110.837   31.086  78.653    48.672  9.6671 1.6078 6.9602 2.6002 2.706867       3.057143  
1 1 1 14 22 5  o 5.7199 1.4255 43.629   20.277  48.362    29.581  39.434    27.849  5.9511 2.0504 5.4886 1.9808 0.4624639      2.850935  
1 1 1 14 22 6  o 4.0037 1.2478 3.8316   19.809  18.902    29.040  -9.2830   27.090  4.5090 1.8963 3.4984 1.6224 1.010585       2.495579  
1 1 1 14 22 7  o 6.4022 1.2223 52.560   20.230  5.8271    29.104  96.251    28.141  4.0228 1.7915 8.7816 1.6631 -4.758796      2.444508  
1 1 1 14 22 8  o 3.0963 1.0550 -28.1982 19.512  -12.3265  28.051  -43.0767  27.159  3.4234 1.6082 2.7692 1.3658 0.6541638      2.109914  
1 1 1 14 22 9  f 4.9422 1.4167 35.110   21.758  46.097    32.815  26.490    29.066  5.3404 2.0989 4.5441 1.9033 0.7963338      2.833416  
1 1 1 14 22 10 f 3.8935 1.2515 6.0476   21.297  0.8425    32.453  9.9850    28.226  3.8406 1.7792 3.9464 1.7604 -0.1057956     2.502906  
1 1 1 14 22 11 o 3.8754 1.2397 1.6473   21.420  28.777    31.385  -22.0090  29.307  4.5879 1.9523 3.1629 1.5283 1.425045       2.479380  
1 1 1 14 22 12 o 4.2038 1.3102 18.151   21.215  35.966    33.232  5.8965    27.563  4.7308 2.0110 3.6769 1.6799 1.053835       2.620321  
1 1 1 14 22 13 o 3.0749 1.0545 -19.2483 20.351  -31.8971  31.377  -10.0638  26.737  2.9877 1.4725 3.1621 1.5099 -0.1744447     2.109051  
1 1 1 14 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 22 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 0  o 3.0050 1.4341 -8.9227  25.462  13.851    36.677  -30.1104  35.377  3.5146 2.2635 2.4953 1.7617 -0.000000      0.000000  
1 1 1 14 23 1  o 5.4616 1.4106 40.680   20.050  38.441    27.841  43.092    28.897  5.3452 1.9725 5.5781 2.0170 -0.2329068     2.821198  
1 1 1 14 23 2  o 5.3263 1.4136 38.258   20.554  32.339    29.567  43.793    28.593  5.0423 1.9890 5.6103 2.0091 -0.5679688     2.827109  
1 1 1 14 23 3  o 6.0718 1.4208 52.422   20.038  52.663    30.011  52.229    26.918  6.0300 2.0659 6.1136 1.9512 -0.8363724E-01 2.841687  
1 1 1 14 23 4  o 4.9183 1.3757 31.028   20.372  22.704    29.865  38.272    27.859  4.5788 1.9242 5.2578 1.9666 -0.6790075     2.751372  
1 1 1 14 23 5  o 4.0302 1.2380 10.240   19.350  -6.4217   27.609  26.326    27.127  3.4828 1.6228 4.5776 1.8701 -1.094778      2.476049  
1 1 1 14 23 6  o 4.5927 1.3022 24.429   19.245  47.509    28.554  5.2180    26.051  5.4923 2.0021 3.6932 1.6657 1.799128       2.604406  
1 1 1 14 23 7  o 7.7078 1.4365 90.782   22.968  73.250    32.743  107.765   32.226  6.6971 2.1535 8.7185 1.9017 -2.021486      2.872984  
1 1 1 14 23 8  o 4.7138 1.3461 26.624   20.549  51.541    30.836  6.7204    27.560  5.6253 2.0759 3.8023 1.7143 1.822978       2.692232  
1 1 1 14 23 9  o 4.4977 1.3313 25.568   21.267  5.8129    30.751  43.679    29.443  3.8231 1.7570 5.1723 2.0008 -1.349182      2.662689  
1 1 1 14 23 10 o 4.4140 1.3384 27.201   20.826  33.172    32.724  23.135    27.001  4.6068 1.9777 4.2211 1.8039 0.3856459      2.676857  
1 1 1 14 23 11 o 3.5582 1.1761 0.2734   21.452  -19.1182  32.287  15.599    28.703  3.2243 1.5687 3.8920 1.7526 -0.6676731     2.352126  
1 1 1 14 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 23 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 0  o 11.509 1.6147 178.551  32.114  149.761   46.319  205.199   44.562  10.053 2.6663 12.964 1.8221 -0.000000      0.000000  
1 1 1 14 24 1  o 3.9229 1.2320 5.5252   19.884  -12.2666  26.968  26.720    29.435  3.2779 1.5512 4.5679 1.9145 -1.290049      2.463994  
1 1 1 14 24 2  o 3.8485 1.2380 5.0210   20.897  1.7196    29.331  8.4245    29.781  3.7449 1.7191 3.9521 1.7819 -0.2071857     2.475996  
1 1 1 14 24 3  o 8.7571 1.6544 116.367  27.628  95.302    32.904  166.714   50.869  7.9308 2.0570 9.5833 2.5917 -1.652564      3.308784  
1 1 1 14 24 4  o 7.1568 1.4737 82.763   23.056  67.659    33.991  95.633    31.377  6.2659 2.1957 8.0478 1.9662 -1.781878      2.947406  
1 1 1 14 24 5  o 4.1720 1.2989 15.859   21.468  30.283    30.725  2.0984    30.009  4.6244 1.9480 3.7197 1.7188 0.9046776      2.597872  
1 1 1 14 24 6  o 4.6526 1.3487 28.767   21.720  4.0591    31.027  52.509    30.415  3.7696 1.7439 5.5356 2.0579 -1.766039      2.697469  
1 1 1 14 24 7  o 5.0910 1.4193 42.453   21.960  62.715    32.378  25.192    29.885  5.8553 2.1323 4.3266 1.8738 1.528676       2.838644  
1 1 1 14 24 8  o 5.4908 1.4652 56.811   22.127  52.050    32.161  61.089    30.490  5.2352 2.0714 5.7464 2.0728 -0.5112057     2.930408  
1 1 1 14 24 9  o 4.2532 1.3242 26.886   21.952  23.070    32.230  30.188    29.982  4.1428 1.8621 4.3636 1.8834 -0.2208033     2.648490  
1 1 1 14 24 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 24 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 0  o 2.7017 1.3522 -25.3007 30.414  -44.2522  45.641  -10.1628  40.791  2.5468 1.8319 2.8566 1.9895 -0.000000      0.000000  
1 1 1 14 25 1  o 5.2815 1.3777 44.934   21.965  75.074    30.731  13.454    31.407  6.5985 2.0826 3.9645 1.8043 2.633960       2.755499  
1 1 1 14 25 2  o 10.411 1.1282 146.699  23.377  144.487   34.305  148.617   31.942  10.181 1.6847 10.641 1.5009 -0.4592161     2.256321  
1 1 1 14 25 3  o 4.6001 1.3477 27.862   21.309  60.714    32.788  3.8420    28.037  5.6245 2.1272 3.5757 1.6555 2.048825       2.695489  
1 1 1 14 25 4  o 5.2909 1.4529 50.896   22.611  73.517    33.857  32.686    30.378  6.0992 2.1860 4.4825 1.9144 1.616634       2.905793  
1 1 1 14 25 5  o 3.7400 1.2099 10.086   20.666  -1.1717   31.362  18.726    27.475  3.5215 1.6683 3.9585 1.7529 -0.4369903     2.419861  
1 1 1 14 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 25 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 26 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 27 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 28 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 29 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 14 30 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 1  0  o 13.378 1.2396 184.733  32.513  0.0000    0.0000  184.733   32.513  13.378 1.2396 13.378 1.2396 -0.000000      0.000000  
1 1 1 15 1  1  o 14.196 0.6384 189.009  15.926  232.959   32.607  175.240   18.251  15.183 1.0738 13.209 0.6908 1.974116       1.276826  
1 1 1 15 1  2  f 19.048 0.6714 357.497  23.933  389.594   42.880  342.974   28.844  19.629 1.0922 18.467 0.7809 1.162104       1.342714  
1 1 1 15 1  3  o 14.574 0.6595 200.361  16.442  241.424   34.906  188.652   18.639  15.443 1.1301 13.705 0.6800 1.738381       1.318972  
1 1 1 15 1  4  o 19.854 0.6441 392.036  21.740  407.737   45.055  387.271   24.820  20.068 1.1226 19.641 0.6319 0.4275284      1.288169  
1 1 1 15 1  5  o 4.7325 1.1438 15.909   10.537  33.949    25.280  12.116    11.592  5.8046 1.8944 3.6604 1.2823 2.144253       2.287559  
1 1 1 15 1  6  o 13.158 0.7450 172.209  16.242  180.704   34.956  169.870   18.342  13.318 1.3124 12.998 0.7056 0.3196754      1.490018  
1 1 1 15 1  7  o 11.358 0.7584 121.830  14.831  149.813   31.284  113.718   16.844  12.099 1.2928 10.617 0.7932 1.481815       1.516780  
1 1 1 15 1  8  o 24.004 0.6503 563.210  26.572  627.506   55.797  544.352   30.218  24.765 1.1265 23.242 0.6501 1.523232       1.300632  
1 1 1 15 1  9  f 10.509 0.7923 96.585   14.141  147.194   31.598  83.912    15.812  11.925 1.3248 9.0921 0.8696 2.833451       1.584688  
1 1 1 15 1  10 o 5.5967 1.0084 33.697   12.039  17.504    16.667  51.366    17.410  4.2911 1.5342 6.9022 1.3091 -2.611031      2.016807  
1 1 1 15 1  11 o 23.020 0.5644 540.853  25.980  554.990   36.822  526.842   36.660  23.325 0.7893 22.715 0.8069 0.6092854      1.128803  
1 1 1 15 1  12 o 6.2212 0.9698 43.169   12.810  69.238    18.091  16.954    18.142  8.1496 1.1099 4.2928 1.5906 3.856829       1.939611  
1 1 1 15 1  13 o 15.946 0.6067 261.224  19.349  259.643   27.324  262.815   27.404  15.897 0.8594 15.995 0.8566 -0.9819603E-01 1.213434  
1 1 1 15 1  14 o 5.3610 1.1236 32.446   12.948  27.706    17.672  37.940    19.027  4.9771 1.5802 5.7449 1.5979 -0.7677741     2.247248  
1 1 1 15 1  15 o 14.205 0.6444 209.318  18.288  199.336   25.216  220.396   26.564  13.849 0.9104 14.561 0.9121 -0.7121630     1.288702  
1 1 1 15 1  16 f 5.6639 1.1142 37.993   13.487  47.961    18.675  27.126    19.497  6.4408 1.4807 4.8869 1.6652 1.553839       2.228328  
1 1 1 15 1  17 o 5.1268 1.1354 29.349   13.310  18.762    17.697  43.137    20.196  4.2605 1.5726 5.9932 1.6381 -1.732674      2.270753  
1 1 1 15 1  18 o 12.771 0.6919 171.997  17.651  161.572   24.351  183.540   25.623  12.360 0.9851 13.183 0.9718 -0.8230667     1.383781  
1 1 1 15 1  19 o 4.7440 1.1700 24.715   13.565  23.755    18.117  25.941    20.464  4.6477 1.6045 4.8404 1.7033 -0.1926193     2.339946  
1 1 1 15 1  20 o 18.429 0.6405 358.493  23.387  399.079   32.423  314.479   33.765  19.594 0.8274 17.264 0.9779 2.329966       1.280924  
1 1 1 15 1  21 o 5.4171 1.1462 31.491   14.696  12.505    19.991  53.817    21.678  4.0465 1.6226 6.7877 1.6195 -2.741214      2.292473  
1 1 1 15 1  22 o 10.259 0.8828 114.042  18.044  121.532   25.133  106.074   25.922  10.649 1.1801 9.8698 1.3132 0.7786789      1.765554  
1 1 1 15 1  23 o 10.610 0.9034 121.960  19.102  110.110   25.861  136.186   28.337  10.040 1.2880 11.181 1.2672 -1.140821      1.806851  
1 1 1 15 1  24 o 9.9470 0.9866 111.145  19.459  111.407   25.985  110.812   29.362  10.036 1.2945 9.8578 1.4893 0.1785221      1.973274  
1 1 1 15 1  25 o 11.977 0.9022 161.625  21.228  174.350   28.429  145.588   31.914  12.654 1.1233 11.299 1.4122 1.355228       1.804495  
1 1 1 15 1  26 f 6.3386 1.3445 52.962   19.192  33.119    25.311  79.801    29.437  5.0335 1.8761 7.6438 1.9263 -2.610285      2.688941  
1 1 1 15 1  27 o 4.1050 1.2588 14.312   18.966  4.8846    24.802  27.587    29.431  3.6325 1.6331 4.5775 1.9161 -0.9449458     2.517624  
1 1 1 15 1  28 o 5.0056 1.3786 43.122   19.652  35.859    25.703  53.345    30.492  4.6740 1.8511 5.3372 2.0435 -0.6631174     2.757195  
1 1 1 15 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 2  0  o 12.254 0.9330 156.706  22.181  152.079   31.826  161.076   30.930  12.055 1.3652 12.454 1.2722 -0.000000      0.000000  
1 1 1 15 2  1  o 18.459 0.5642 342.818  20.826  352.127   29.653  333.756   29.256  18.707 0.7926 18.211 0.8032 0.4960575      1.128431  
1 1 1 15 2  2  o 27.890 0.5586 782.707  31.160  777.475   44.067  787.939   44.067  27.797 0.7927 27.984 0.7874 -0.1875973     1.117257  
1 1 1 15 2  3  o 11.289 0.8123 124.873  17.407  116.384   21.170  142.587   30.583  10.736 0.9860 11.842 1.2913 -1.106201      1.624675  
1 1 1 15 2  4  o 18.331 0.6429 324.823  20.179  366.578   42.181  312.431   22.979  19.025 1.1086 17.637 0.6515 1.387894       1.285843  
1 1 1 15 2  5  o 12.780 0.8229 176.787  16.636  147.881   35.849  184.721   18.781  12.007 1.4929 13.554 0.6928 -1.546831      1.645813  
1 1 1 15 2  6  o 4.8444 1.1497 14.517   11.199  42.458    25.818  8.0409    12.430  6.3015 1.8948 3.3873 1.3028 2.914249       2.299456  
1 1 1 15 2  7  o 7.7307 1.0446 59.796   12.968  69.629    28.919  57.321    14.509  7.9539 1.8524 7.5075 0.9663 0.4463491      2.089290  
1 1 1 15 2  8  o 14.843 0.7160 213.086  18.065  247.442   38.338  203.282   20.481  15.500 1.2367 14.186 0.7219 1.314526       1.431994  
1 1 1 15 2  9  o 7.8129 1.1130 74.349   13.560  51.884    30.250  79.999    15.170  6.7659 2.0547 8.8600 0.8561 -2.094126      2.225945  
1 1 1 15 2  10 o 7.5704 1.1082 84.287   14.561  23.238    31.592  100.754   16.408  5.2163 2.0565 9.9245 0.8266 -4.708208      2.216417  
1 1 1 15 2  11 o 9.0979 0.9625 76.310   14.409  108.326   33.209  68.885    15.992  10.010 1.6587 8.1855 0.9769 1.824868       1.925029  
1 1 1 15 2  12 o 8.4162 1.0273 66.645   14.323  100.429   31.616  57.921    16.066  9.3847 1.7488 7.4477 1.0786 1.936968       2.054662  
1 1 1 15 2  13 o 8.5012 1.1631 97.441   15.601  55.396    32.968  109.572   17.709  6.7002 2.1616 10.302 0.8595 -3.601966      2.326211  
1 1 1 15 2  14 o 9.5336 1.0399 95.203   15.551  110.086   34.738  91.473    17.391  9.6781 1.8623 9.3891 0.9261 0.2889719      2.079841  
1 1 1 15 2  15 o 12.644 0.8336 163.116  17.432  187.626   38.019  156.591   19.616  12.981 1.4644 12.308 0.7968 0.6720982      1.667198  
1 1 1 15 2  16 o 5.0046 1.2351 22.941   13.006  42.587    28.295  17.678    14.645  5.8984 2.0061 4.1108 1.4412 1.787597       2.470103  
1 1 1 15 2  17 f 7.1003 1.0729 77.445   15.529  12.265    31.367  98.605    17.873  4.5152 1.9373 9.6855 0.9226 -5.170244      2.145808  
1 1 1 15 2  18 o 9.0242 1.2022 104.581  16.860  79.678    36.133  111.513   19.063  7.7354 2.2197 10.313 0.9242 -2.577614      2.404386  
1 1 1 15 2  19 o 2.6155 0.9197 -40.3406 15.060  -35.7843  28.688  -42.0739  17.694  3.1251 1.5105 2.1059 1.0495 1.019171       1.839323  
1 1 1 15 2  20 o 14.970 0.6877 240.748  20.160  274.299   27.379  201.015   29.795  16.227 0.8436 13.712 1.0864 2.515189       1.375492  
1 1 1 15 2  21 o 3.4019 1.0538 -0.3229  13.717  4.0468    17.846  -6.6323   21.444  3.4780 1.4759 3.3259 1.5046 0.1520960      2.107626  
1 1 1 15 2  22 o 3.9143 1.1514 8.9309   14.817  9.9364    19.627  7.5982    22.595  3.8803 1.5886 3.9483 1.6672 -0.6796575E-01 2.302883  
1 1 1 15 2  23 o 5.5023 1.2910 35.744   16.478  36.268    21.586  35.013    25.508  5.5383 1.7452 5.4663 1.9029 0.7204580E-01  2.581973  
1 1 1 15 2  24 o 9.1838 1.1003 103.366  18.596  125.143   24.523  73.903    28.524  10.737 1.1420 7.6310 1.8810 3.105783       2.200538  
1 1 1 15 2  25 o 5.7571 1.3260 42.019   17.394  34.473    22.698  52.758    27.076  5.2353 1.7965 6.2789 1.9507 -1.043547      2.651920  
1 1 1 15 2  26 o 10.516 0.9902 130.884  20.613  110.341   27.220  158.502   31.561  9.5307 1.4280 11.501 1.3721 -1.970477      1.980343  
1 1 1 15 2  27 o 3.9250 1.1538 11.967   17.310  32.367    22.105  -20.3838  27.836  4.7483 1.7565 3.1017 1.4964 1.646599       2.307535  
1 1 1 15 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 2  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 3  0  o 23.265 0.8009 548.777  37.058  542.722   52.683  554.707   52.138  23.134 1.1451 23.396 1.1201 -0.000000      0.000000  
1 1 1 15 3  1  f 16.468 0.5810 273.189  19.132  271.134   27.321  275.165   26.801  16.406 0.8326 16.531 0.8106 -0.1246376     1.162085  
1 1 1 15 3  2  o 5.8306 0.9601 34.824   12.209  58.489    17.564  12.698    16.983  7.5930 1.1566 4.0682 1.5328 3.524804       1.920169  
1 1 1 15 3  3  o 39.739 0.7157 1563.96  53.944  1705.04   94.084  1494.86   65.842  40.978 1.1480 38.499 0.8551 2.478607       1.431455  
1 1 1 15 3  4  o 20.327 0.5726 416.979  23.243  387.421   32.628  447.431   33.118  19.591 0.8328 21.064 0.7861 -1.473391      1.145188  
1 1 1 15 3  5  o 13.338 0.6422 179.706  17.085  162.395   23.498  199.121   24.885  12.654 0.9285 14.021 0.8874 -1.366471      1.284358  
1 1 1 15 3  6  o 9.5265 0.7625 92.598   14.343  74.183    19.716  113.302   20.905  8.5059 1.1590 10.547 0.9910 -2.041211      1.524910  
1 1 1 15 3  7  f 3.2565 1.0318 -1.9262  10.431  -7.5054   26.509  -0.9043   11.346  3.8342 1.7085 2.6789 1.1574 1.155286       2.063608  
1 1 1 15 3  8  o 17.383 0.6804 298.493  20.258  330.868   42.046  288.705   23.119  17.876 1.1761 16.890 0.6844 0.9853592      1.360714  
1 1 1 15 3  9  f 7.1990 1.1157 49.772   13.092  74.128    29.807  43.950    14.573  8.0058 1.8916 6.3921 1.1835 1.613700       2.231350  
1 1 1 15 3  10 o 16.939 0.6881 269.522  20.092  346.757   42.631  247.467   22.781  18.267 1.1669 15.612 0.7296 2.654984       1.376224  
1 1 1 15 3  11 o 6.7445 1.1601 52.937   13.400  45.616    30.391  54.704    14.930  6.2405 2.0791 7.2485 1.0299 -1.008012      2.320141  
1 1 1 15 3  12 o 7.7922 1.1426 68.830   14.047  66.332    31.970  69.428    15.637  7.3986 2.0760 8.1859 0.9551 -0.7872925     2.285183  
1 1 1 15 3  13 o 9.7079 1.1218 116.110  16.329  87.321    34.879  124.191   18.479  8.4399 2.0798 10.976 0.8418 -2.536128      2.243670  
1 1 1 15 3  14 o 9.4357 0.9234 82.466   15.376  129.311   32.315  68.756    17.482  10.804 1.4954 8.0670 1.0835 2.737485       1.846726  
1 1 1 15 3  15 o 13.410 0.8076 186.576  18.253  204.610   38.354  181.295   20.754  13.577 1.4124 13.242 0.7836 0.3350210      1.615227  
1 1 1 15 3  16 o 10.505 0.9296 109.154  16.218  146.071   36.254  99.918    18.133  11.259 1.6100 9.7513 0.9298 1.507516       1.859218  
1 1 1 15 3  17 o 7.4319 1.1694 70.727   14.998  53.531    31.322  75.842    17.084  6.4059 2.1095 8.4579 1.0099 -2.052041      2.338804  
1 1 1 15 3  18 o 4.2968 1.1150 19.235   13.151  -11.3711  29.489  26.833    14.693  3.7358 1.7182 4.8578 1.4217 -1.122080      2.230097  
1 1 1 15 3  19 o 6.4030 1.3107 39.812   14.787  75.146    34.189  31.682    16.400  7.5803 2.1538 5.2257 1.4941 2.354626       2.621301  
1 1 1 15 3  20 f 6.4992 1.2787 45.360   15.128  65.644    31.804  39.429    17.198  7.1563 2.0909 5.8421 1.4724 1.314185       2.557302  
1 1 1 15 3  21 o 11.591 1.0335 149.097  20.981  149.256   40.480  149.039   24.533  11.303 1.7907 11.880 1.0325 -0.5775223     2.067086  
1 1 1 15 3  22 o 6.3252 1.2194 54.691   16.655  16.808    37.375  64.078    18.604  4.9483 2.1187 7.7021 1.2078 -2.753743      2.438765  
1 1 1 15 3  23 o 8.9047 1.3021 118.142  19.490  56.087    42.002  135.171   22.002  6.4782 2.4164 11.331 0.9709 -4.852948      2.604122  
1 1 1 15 3  24 o 6.0940 1.4461 44.009   17.717  60.397    40.719  40.182    19.678  6.4567 2.3849 5.7313 1.6359 0.7253919      2.892102  
1 1 1 15 3  25 o 6.9509 1.2276 77.516   19.241  15.057    43.655  92.575    21.436  4.7791 2.1558 9.1227 1.1749 -4.343590      2.455176  
1 1 1 15 3  26 o 5.6439 1.5039 45.365   19.443  74.603    46.122  39.046    21.441  6.0376 2.4492 5.2501 1.7461 0.7874498      3.007883  
1 1 1 15 3  27 o 5.3680 1.4490 44.997   18.899  65.065    44.708  40.631    20.854  5.4839 2.3318 5.2521 1.7209 0.2318063      2.898090  
1 1 1 15 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 3  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 4  0  o 12.177 0.9936 157.396  22.906  132.941   32.644  181.117   32.150  11.136 1.5518 13.217 1.2414 -0.000000      0.000000  
1 1 1 15 4  1  o 19.672 0.5692 390.921  22.373  371.814   31.655  409.993   31.626  19.187 0.8249 20.158 0.7845 -0.9705486     1.138340  
1 1 1 15 4  2  o 15.277 0.5998 236.353  18.298  227.334   26.277  244.844   25.495  14.988 0.8766 15.566 0.8189 -0.5782604     1.199621  
1 1 1 15 4  3  o 12.455 0.6512 157.298  16.199  146.037   22.646  169.095   23.179  11.994 0.9440 12.916 0.8973 -0.9214821     1.302463  
1 1 1 15 4  4  o 10.954 0.6979 122.155  15.283  118.299   21.573  126.041   21.654  10.777 1.0009 11.130 0.9728 -0.3526640     1.395733  
1 1 1 15 4  5  o 10.271 0.7451 108.108  15.249  116.633   21.341  99.215    21.797  10.697 0.9975 9.8445 1.1071 0.8525648      1.490199  
1 1 1 15 4  6  o 12.895 0.8546 162.770  20.128  151.272   23.663  192.867   38.284  12.180 0.9714 13.610 1.4065 -1.429878      1.709283  
1 1 1 15 4  7  o 7.0201 0.9837 53.702   13.453  65.189    18.689  41.350    19.380  7.9258 1.1790 6.1144 1.5751 1.811417       1.967463  
1 1 1 15 4  8  o 14.560 0.6263 217.605  18.230  219.113   25.456  216.017   26.120  14.618 0.8707 14.502 0.9006 0.1161737      1.252686  
1 1 1 15 4  9  o 4.1708 1.0485 14.438   11.845  26.534    16.721  2.2540    16.781  4.9623 1.5315 3.3793 1.4324 1.582963       2.096974  
1 1 1 15 4  10 o 3.7113 1.0318 9.7480   11.796  -33.3534  28.911  18.357    12.921  3.2517 1.5574 4.1708 1.3540 -0.9190936     2.063687  
1 1 1 15 4  11 f 9.4996 0.9359 88.044   14.676  111.702   32.861  82.150    16.402  10.076 1.6306 8.9228 0.9191 1.153506       1.871822  
1 1 1 15 4  12 o 3.9899 1.0925 13.724   12.577  -20.3735  30.004  20.993    13.853  3.5870 1.6781 4.3928 1.3995 -0.8058486     2.185056  
1 1 1 15 4  13 o 8.3391 1.0866 79.348   14.636  75.164    30.686  80.580    16.652  7.8778 1.9565 8.8003 0.9461 -0.9224968     2.173242  
1 1 1 15 4  14 o 4.2758 1.2169 12.578   12.655  24.797    30.594  10.056    13.900  5.0319 2.0110 3.5196 1.3710 1.512265       2.433846  
1 1 1 15 4  15 o 8.0781 1.1599 80.718   15.239  65.862    32.299  84.972    17.284  7.1570 2.1117 8.9993 0.9603 -1.842299      2.319784  
1 1 1 15 4  16 o 10.838 1.0182 134.993  17.095  127.100   36.424  137.223   19.360  10.202 1.8534 11.473 0.8437 -1.271164      2.036362  
1 1 1 15 4  17 o 3.7586 1.1517 5.4244   13.038  5.1163    30.391  5.4939    14.433  4.2523 1.8647 3.2649 1.3521 0.9873931      2.303369  
1 1 1 15 4  18 o 4.9882 1.2678 26.869   14.486  25.541    31.210  27.234    16.355  5.0928 2.0325 4.8837 1.5159 0.2091012      2.535531  
1 1 1 15 4  19 o 3.9816 1.1901 -1.9601  12.977  34.251    31.160  -9.5593   14.274  5.4211 2.0681 2.5421 1.1785 2.879033       2.380253  
1 1 1 15 4  20 o 6.7728 1.2179 59.522   15.394  36.360    34.531  65.267    17.198  5.6932 2.1758 7.8524 1.0951 -2.159171      2.435837  
1 1 1 15 4  21 o 7.5806 1.2858 68.557   16.439  67.203    37.502  68.879    18.289  7.1260 2.3061 8.0353 1.1381 -0.9093614     2.571651  
1 1 1 15 4  22 o 5.8453 1.4048 32.820   15.832  63.673    38.132  26.394    17.403  6.8766 2.3288 4.8139 1.5718 2.062686       2.809652  
1 1 1 15 4  23 o 3.8648 1.1894 7.0058   14.814  -4.3174   34.153  9.6299    16.441  4.1096 1.8746 3.6200 1.4644 0.4895337      2.378844  
1 1 1 15 4  24 o 3.9360 1.1410 9.9654   15.999  -52.7276  37.967  23.501    17.641  3.3496 1.6447 4.5223 1.5820 -1.172718      2.282043  
1 1 1 15 4  25 o 7.9115 1.3802 88.829   18.727  80.441    45.243  90.563    20.571  6.8042 2.5138 9.0188 1.1405 -2.214630      2.760411  
1 1 1 15 4  26 o 10.395 1.3077 141.053  20.945  159.518   46.336  136.311   23.481  9.7920 2.3876 10.998 1.0675 -1.206137      2.615352  
1 1 1 15 4  27 o 5.7455 1.2238 61.488   18.620  12.959    46.576  70.719    20.314  4.1462 1.9834 7.3449 1.4343 -3.198715      2.447685  
1 1 1 15 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 5  0  o 18.161 0.8513 338.647  30.589  324.122   43.072  353.426   43.449  17.754 1.2264 18.568 1.1810 -0.000000      0.000000  
1 1 1 15 5  1  o 11.720 0.6887 139.990  16.105  128.246   22.672  151.952   22.881  11.216 1.0107 12.225 0.9358 -1.009359      1.377456  
1 1 1 15 5  2  o 13.420 0.6358 183.684  16.944  158.913   23.949  208.515   23.977  12.496 0.9583 14.344 0.8358 -1.847856      1.271564  
1 1 1 15 5  3  o 15.646 0.6027 248.306  18.853  252.747   26.561  243.796   26.765  15.789 0.8411 15.502 0.8633 0.2877388      1.205306  
1 1 1 15 5  4  o 8.9377 0.7965 82.195   14.160  92.459    20.115  72.114    19.935  9.5057 1.0581 8.3697 1.1909 1.136069       1.593043  
1 1 1 15 5  5  f 15.474 0.6141 244.223  18.973  228.786   26.860  259.597   26.804  14.976 0.8968 15.972 0.8391 -0.9962034     1.228127  
1 1 1 15 5  6  o 7.7104 1.1544 64.044   16.314  69.519    29.749  61.690    19.509  7.7587 1.9261 7.6622 1.2731 0.9653950E-01  2.308777  
1 1 1 15 5  7  o 4.4770 1.0571 18.301   12.504  1.2054    18.078  33.983    17.315  3.4255 1.4703 5.5285 1.5191 -2.102964      2.114105  
1 1 1 15 5  8  o 4.8434 1.1210 24.709   12.525  25.964    17.590  23.419    17.838  4.9339 1.5776 4.7528 1.5929 0.1810427      2.241922  
1 1 1 15 5  9  o 11.589 0.7044 139.451  16.325  137.272   23.151  141.606   23.024  11.495 1.0070 11.684 0.9853 -0.1894093     1.408872  
1 1 1 15 5  10 o 2.6930 0.8719 -8.5256  10.539  -11.3448  15.991  -6.3609   14.012  2.7028 1.2510 2.6831 1.2149 0.1967549E-01  1.743781  
1 1 1 15 5  11 o 4.1001 1.0369 11.303   12.056  31.116    18.180  -4.2479   16.106  5.2313 1.5938 2.9688 1.3266 2.262549       2.073714  
1 1 1 15 5  12 o 9.7907 0.8063 101.333  15.779  105.916   22.532  96.922    22.105  10.015 1.1249 9.5665 1.1553 0.4485245      1.612502  
1 1 1 15 5  13 o 16.490 0.7780 296.316  21.030  274.998   43.958  302.644   23.949  15.800 1.3910 17.179 0.6970 -1.378797      1.555915  
1 1 1 15 5  14 o 6.4355 1.2036 32.422   13.667  90.961    32.045  19.408    15.110  8.6165 1.9097 4.2546 1.4655 4.361915       2.407194  
1 1 1 15 5  15 o 5.0710 1.2948 21.648   13.553  50.794    32.516  15.520    14.910  6.2133 2.1492 3.9286 1.4445 2.284752       2.589532  
1 1 1 15 5  16 o 3.5563 1.1080 2.9234   12.701  -0.6267   29.061  3.7617    14.121  3.9788 1.7797 3.1337 1.3203 0.8451602      2.216015  
1 1 1 15 5  17 o 5.8635 1.2109 44.804   14.514  20.376    34.566  50.032    15.992  5.0013 2.0836 6.7258 1.2343 -1.724545      2.421757  
1 1 1 15 5  18 o 6.0090 1.2343 45.469   14.552  33.365    32.835  48.427    16.233  5.4417 2.1106 6.5762 1.2803 -1.134549      2.468573  
1 1 1 15 5  19 o 14.841 0.8553 239.698  20.587  232.948   44.056  241.583   23.286  14.377 1.5322 15.305 0.7607 -0.9281273     1.710613  
1 1 1 15 5  20 o 6.6569 1.1896 60.538   15.559  26.584    34.492  69.212    17.433  5.2373 2.1202 8.0765 1.0792 -2.839291      2.379124  
1 1 1 15 5  21 o 6.2807 1.1275 57.422   15.882  -1.4588   36.789  70.910    17.608  4.3934 1.9807 8.1680 1.0778 -3.774654      2.254981  
1 1 1 15 5  22 o 18.194 0.8369 350.487  24.601  363.319   53.900  347.110   27.649  18.029 1.4948 18.359 0.7530 -0.3295078     1.673764  
1 1 1 15 5  23 o 4.3564 1.2108 19.283   15.174  -21.0523  39.537  26.250    16.432  3.9760 1.8805 4.7367 1.5258 -0.7607229     2.421669  
1 1 1 15 5  24 o 4.5207 1.2586 22.474   15.160  -1.1332   40.399  26.343    16.355  4.3484 2.0041 4.6929 1.5233 -0.3445711     2.517288  
1 1 1 15 5  25 o 6.6133 1.1798 73.244   17.798  20.863    40.459  85.812    19.818  4.5588 2.0642 8.6678 1.1432 -4.108997      2.359601  
1 1 1 15 5  26 o 4.9788 1.3204 37.383   16.695  28.802    43.786  38.843    18.059  4.6280 2.1156 5.3297 1.5807 -0.7017326     2.640866  
1 1 1 15 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 6  0  o 25.098 0.8069 644.469  40.220  602.438   57.254  685.422   56.514  24.263 1.1863 25.933 1.0940 -0.000000      0.000000  
1 1 1 15 6  1  o 7.7133 0.9522 63.830   14.048  82.057    20.060  46.290    19.679  8.9251 1.1238 6.5015 1.5376 2.423603       1.904483  
1 1 1 15 6  2  o 11.130 0.7114 126.979  15.828  124.847   21.982  129.275   22.809  11.036 0.9959 11.224 1.0161 -0.1883879     1.422780  
1 1 1 15 6  3  o 15.517 0.6147 246.101  19.059  254.771   26.725  237.128   27.187  15.804 0.8455 15.230 0.8926 0.5741243      1.229448  
1 1 1 15 6  4  o 3.6365 1.0435 6.5171   11.990  1.2636    16.542  12.332    17.404  3.2984 1.4108 3.9746 1.5380 -0.6762433     2.087076  
1 1 1 15 6  5  o 12.690 0.6503 165.709  16.481  168.455   22.851  162.731   23.793  12.810 0.8920 12.570 0.9465 0.2400360      1.300520  
1 1 1 15 6  6  o 17.063 0.6102 297.371  20.766  327.810   29.814  268.690   28.940  17.924 0.8317 16.202 0.8931 1.721287       1.220367  
1 1 1 15 6  7  o 6.7946 1.0264 51.257   13.495  45.715    19.891  55.984    18.369  6.4003 1.5666 7.1889 1.3265 -0.7886195     2.052736  
1 1 1 15 6  8  o 10.575 0.7653 116.981  16.179  113.396   22.916  120.545   22.845  10.406 1.1011 10.745 1.0630 -0.3394985     1.530520  
1 1 1 15 6  9  o 7.0491 1.3194 57.564   17.066  57.675    19.501  57.201    35.268  7.2291 1.3993 6.8690 2.2373 0.3600874      2.638894  
1 1 1 15 6  10 o 6.2759 1.0846 45.127   13.582  38.173    19.182  52.119    19.233  5.7552 1.6056 6.7967 1.4585 -1.041535      2.169187  
1 1 1 15 6  11 o 12.579 0.6923 164.956  17.407  162.585   24.890  167.227   24.353  12.481 0.9971 12.677 0.9605 -0.1961155     1.384520  
1 1 1 15 6  12 o 2.1409 0.7439 -29.4328 10.854  -22.4804  16.157  -35.1513  14.653  2.3581 1.1383 1.9237 0.9581 0.4343752      1.487854  
1 1 1 15 6  13 f 8.3788 0.9394 77.987   15.305  73.690    22.352  81.780    21.000  8.0546 1.4404 8.7030 1.2065 -0.6484022     1.878899  
1 1 1 15 6  14 f 8.9959 0.8767 88.152   15.751  82.224    22.033  94.348    22.527  8.6679 1.2710 9.3239 1.2080 -0.6560030     1.753472  
1 1 1 15 6  15 o 5.1328 1.1640 33.790   13.854  3.0431    33.386  40.186    15.227  4.3175 1.9211 5.9480 1.3149 -1.630534      2.328006  
1 1 1 15 6  16 o 10.387 1.1222 134.818  17.068  102.688   36.910  143.557   19.250  9.0020 2.0902 11.771 0.8177 -2.769059      2.244473  
1 1 1 15 6  17 o 4.8191 1.1306 28.304   14.551  -22.4634  34.835  39.035    16.016  3.7893 1.7839 5.8488 1.3897 -2.059500      2.261295  
1 1 1 15 6  18 o 4.6571 1.2439 7.4883   13.702  53.799    31.805  -3.0657   15.183  6.4188 2.1263 2.8955 1.2914 3.523296       2.487742  
1 1 1 15 6  19 o 5.0145 1.4652 28.560   15.617  0.0000    0.0000  28.560    15.617  ?      ?      5.0145 1.4652 ?              ?         
1 1 1 15 6  20 o 6.6853 1.1681 63.571   15.619  18.376    35.488  74.428    17.394  4.9725 2.0940 8.3980 1.0356 -3.425466      2.336100  
1 1 1 15 6  21 o 8.9220 1.2892 106.938  17.493  76.087    40.785  113.893   19.365  7.4177 2.4054 10.426 0.9286 -3.008680      2.578446  
1 1 1 15 6  22 o 7.5523 1.2893 76.100   16.840  57.915    38.995  80.269    18.671  6.4565 2.3418 8.6480 1.0795 -2.191575      2.578613  
1 1 1 15 6  23 o 7.1740 1.3961 56.555   16.508  90.286    41.277  50.133    18.011  7.8039 2.4059 6.5441 1.4172 1.259844       2.792260  
1 1 1 15 6  24 o 6.0548 1.0169 59.830   16.087  -35.1941  39.428  78.807    17.620  3.6073 1.7501 8.5024 1.0362 -4.895176      2.033810  
1 1 1 15 6  25 o 4.4595 1.2571 25.715   15.991  1.9623    42.553  29.621    17.255  4.1737 1.9669 4.7454 1.5659 -0.5716305     2.514115  
1 1 1 15 6  26 f 4.5679 1.3952 17.969   16.132  76.271    45.155  9.4392    17.271  5.7510 2.3875 3.3847 1.4445 2.366256       2.790448  
1 1 1 15 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 6  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 7  0  o 15.337 0.8903 244.237  26.759  276.868   39.674  217.003   36.244  16.301 1.2331 14.373 1.2844 -0.000000      0.000000  
1 1 1 15 7  1  o 7.4397 0.9655 59.802   14.013  66.573    19.853  53.080    19.782  7.9541 1.2479 6.9253 1.4735 1.028841       1.930937  
1 1 1 15 7  2  o 4.2320 1.0721 14.717   12.662  28.296    17.443  -0.4104   18.411  5.0835 1.5634 3.3806 1.4674 1.702912       2.144218  
1 1 1 15 7  3  f 10.387 0.7328 111.770  15.154  114.198   20.626  108.923   22.338  10.528 0.9796 10.246 1.0901 0.2818508      1.465541  
1 1 1 15 7  4  o 7.2717 0.9689 56.803   13.677  43.328    18.941  71.485    19.771  6.2576 1.5269 8.2858 1.1931 -2.028188      1.937744  
1 1 1 15 7  5  o 13.557 0.6625 188.567  17.942  175.892   24.950  202.139   25.819  13.080 0.9538 14.035 0.9198 -0.9554033     1.325048  
1 1 1 15 7  6  o 4.2169 1.1017 16.181   12.384  11.659    17.067  21.210    17.997  3.8845 1.5175 4.5492 1.5975 -0.6646893     2.203367  
1 1 1 15 7  7  o 10.040 0.7771 105.137  15.529  119.587   22.463  91.910    21.491  10.720 1.0478 9.3610 1.1479 1.358571       1.554201  
1 1 1 15 7  8  o 6.6210 1.0847 49.620   14.079  51.676    20.281  47.708    19.561  6.7548 1.5359 6.4871 1.5321 0.2676682      2.169430  
1 1 1 15 7  9  o 12.215 0.8648 153.365  20.225  179.278   34.921  140.286   24.809  12.876 1.3560 11.553 1.0737 1.322760       1.729612  
1 1 1 15 7  10 o 9.0432 0.8758 87.676   15.762  79.855    22.590  95.097    22.004  8.6139 1.3113 9.4726 1.1614 -0.8587570     1.751676  
1 1 1 15 7  11 o 10.838 0.7916 125.061  16.924  151.824   24.476  100.543   23.426  12.006 1.0193 9.6700 1.2113 2.336068       1.583111  
1 1 1 15 7  12 o 2.7836 0.9066 -12.2889 12.170  -26.0641  18.153  -1.0432   16.402  2.4622 1.1929 3.1050 1.3656 -0.6428580     1.813214  
1 1 1 15 7  13 o 3.4401 1.0348 4.1141   12.456  1.5275    18.759  6.1537    16.657  3.4073 1.4801 3.4729 1.4466 -0.6559229E-01 2.069636  
1 1 1 15 7  14 o 6.2222 1.1410 46.511   14.579  35.974    20.800  56.687    20.441  5.4710 1.7114 6.9733 1.5094 -1.502367      2.281913  
1 1 1 15 7  15 o 6.7197 1.0810 54.685   15.844  21.386    23.011  84.702    21.847  4.6114 1.7729 8.8280 1.2374 -4.216551      2.161987  
1 1 1 15 7  16 f 11.188 0.8342 135.503  18.331  107.834   25.877  163.372   25.971  9.9479 1.3006 12.427 1.0449 -2.479260      1.668401  
1 1 1 15 7  17 o 8.0853 1.2100 101.219  15.976  38.235    38.857  114.032   17.526  5.7039 2.2706 10.467 0.8372 -4.762785      2.419993  
1 1 1 15 7  18 o 7.7409 1.2288 66.310   15.735  77.902    35.181  63.412    17.592  7.7715 2.1767 7.7103 1.1408 0.6125879E-01  2.457586  
1 1 1 15 7  19 o 11.741 0.9555 139.496  18.120  172.176   41.310  131.710   20.164  12.239 1.6876 11.242 0.8968 0.9974642      1.911085  
1 1 1 15 7  20 o 6.9519 1.2612 61.496   16.053  47.298    35.953  65.031    17.940  6.1177 2.2440 7.7862 1.1521 -1.668466      2.522474  
1 1 1 15 7  21 o 8.4069 1.2827 80.431   16.721  90.732    40.102  78.263    18.397  8.2253 2.3311 8.5885 1.0710 -0.3631706     2.565366  
1 1 1 15 7  22 o 9.9812 1.1996 118.884  18.090  118.773   40.565  118.912   20.210  9.3736 2.2013 10.589 0.9543 -1.215205      2.399287  
1 1 1 15 7  23 o 8.4377 1.3425 75.488   17.825  124.499   43.784  65.750    19.516  9.2230 2.3630 7.6525 1.2751 1.570432       2.685079  
1 1 1 15 7  24 o 7.4367 1.3244 79.248   17.350  76.073    40.859  79.947    19.164  6.4821 2.3900 8.3912 1.1419 -1.909064      2.648826  
1 1 1 15 7  25 o 5.9339 1.0670 61.956   16.410  -23.2566  45.088  74.968    17.619  3.7642 1.8363 8.1036 1.0871 -4.339398      2.133979  
1 1 1 15 7  26 o 4.3406 1.1971 28.392   14.572  10.558    39.784  31.155    15.660  3.9603 1.8770 4.7209 1.4863 -0.7606118     2.394156  
1 1 1 15 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 8  0  o 5.1890 1.6217 39.328   19.615  60.344    28.782  21.103    26.803  6.5533 2.3861 3.8248 2.1970 -0.000000      0.000000  
1 1 1 15 8  1  o 4.1052 1.0936 12.952   12.428  5.9027    16.606  21.926    18.737  3.5471 1.4578 4.6633 1.6305 -1.116197      2.187117  
1 1 1 15 8  2  o 12.501 0.6974 161.769  17.392  173.087   24.436  150.150   24.759  12.962 0.9426 12.040 1.0282 0.9227715      1.394885  
1 1 1 15 8  3  o 7.2787 1.0015 58.332   14.045  52.628    19.470  64.520    20.279  6.8796 1.4602 7.6778 1.3709 -0.7981606     2.002922  
1 1 1 15 8  4  o 7.3286 0.9850 58.699   14.047  46.076    19.444  72.480    20.315  6.3834 1.5406 8.2739 1.2277 -1.890538      1.969912  
1 1 1 15 8  5  o 3.5394 1.0321 5.6515   11.936  9.6446    16.539  1.3109    17.243  3.7340 1.4829 3.3448 1.4358 0.3892040      2.064128  
1 1 1 15 8  6  o 8.2529 0.9739 79.299   14.657  36.035    20.725  122.583   20.730  5.6260 1.6990 10.880 0.9527 -5.253834      1.947875  
1 1 1 15 8  7  o 14.311 0.6583 212.673  18.832  222.439   26.856  203.226   26.415  14.642 0.9171 13.980 0.9448 0.6621113      1.316656  
1 1 1 15 8  8  o 2.9059 0.9223 -11.4205 12.013  -28.3358  17.066  5.1950    16.914  2.3238 1.1328 3.4879 1.4557 -1.164060      1.844511  
1 1 1 15 8  9  o 8.4242 0.8923 75.424   14.956  86.730    22.284  66.156    20.176  9.0046 1.2373 7.8439 1.2861 1.160698       1.784679  
1 1 1 15 8  10 o 6.2681 1.0588 46.585   13.857  28.634    20.746  61.045    18.619  5.0203 1.7177 7.5159 1.2386 -2.495618      2.117669  
1 1 1 15 8  11 o 10.041 0.8185 107.670  16.356  123.229   23.962  94.098    22.380  10.741 1.1155 9.3402 1.1980 1.400687       1.636937  
1 1 1 15 8  12 o 5.5839 1.1926 37.457   14.658  30.384    21.760  43.334    19.834  5.1207 1.7589 6.0471 1.6110 -0.9263625     2.385184  
1 1 1 15 8  13 o 12.095 0.7606 156.126  18.243  183.266   26.396  131.310   25.241  13.150 1.0036 11.039 1.1432 2.111263       1.521272  
1 1 1 15 8  14 o 5.7385 1.1743 38.754   14.514  50.534    21.407  28.730    19.747  6.4984 1.6454 4.9787 1.6759 1.519674       2.348645  
1 1 1 15 8  15 o 7.9862 1.0256 72.900   15.740  61.569    23.314  82.391    21.337  7.2322 1.6485 8.7403 1.2206 -1.508101      2.051205  
1 1 1 15 8  16 o 5.9741 1.1791 43.019   15.229  28.950    21.952  56.073    21.145  5.0294 1.7644 6.9188 1.5647 -1.889415      2.358298  
1 1 1 15 8  17 o 3.6951 1.0991 3.0460   14.402  17.025    21.019  -9.3265   19.774  4.3114 1.6841 3.0787 1.4127 1.232637       2.198141  
1 1 1 15 8  18 o 3.7837 1.1088 7.0086   14.190  -3.2763   21.265  15.264    19.052  3.4237 1.5276 4.1437 1.6076 -0.7199624     2.217595  
1 1 1 15 8  19 o 8.5017 1.2428 85.798   16.197  83.584    38.148  86.285    17.889  7.9434 2.2811 9.0600 0.9873 -1.116639      2.485583  
1 1 1 15 8  20 o 5.7365 1.3932 27.734   15.829  69.067    37.538  18.795    17.457  7.1867 2.3053 4.2863 1.5650 2.900337       2.786326  
1 1 1 15 8  21 o 5.7769 1.2879 42.272   15.172  32.287    36.307  44.385    16.700  5.3576 2.1731 6.1961 1.3827 -0.8384790     2.575715  
1 1 1 15 8  22 o 7.5005 1.3796 65.578   16.597  86.037    43.502  62.092    17.955  7.4876 2.4870 7.5134 1.1949 -0.2575541E-01 2.759200  
1 1 1 15 8  23 o 12.386 1.0701 180.783  20.307  182.568   45.963  180.350   22.636  11.751 1.9557 13.022 0.8692 -1.270395      2.140107  
1 1 1 15 8  24 o 2.9483 1.0059 -7.2307  12.570  -61.9122  42.541  -1.9998   13.158  3.2569 1.6238 2.6397 1.1878 0.6171813      2.011855  
1 1 1 15 8  25 o 3.5658 1.1747 3.6736   14.905  12.154    40.000  2.3063    16.062  4.1306 1.9340 3.0011 1.3341 1.129455       2.349473  
1 1 1 15 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 8  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 9  0  o 7.1483 1.6811 69.579   21.486  78.165    31.399  62.019    29.464  7.7049 2.3350 6.5917 2.4191 -0.000000      0.000000  
1 1 1 15 9  1  o 18.054 0.6096 334.863  22.004  346.981   31.254  322.954   30.985  18.384 0.8500 17.723 0.8741 0.6611729      1.219289  
1 1 1 15 9  2  o 7.6602 0.9945 65.277   14.632  50.019    21.196  79.167    20.223  6.6388 1.6124 8.6816 1.1647 -2.042759      1.989080  
1 1 1 15 9  3  o 7.5146 1.0052 62.804   14.589  44.889    20.580  80.901    20.684  6.2691 1.6272 8.7601 1.1806 -2.490950      2.010329  
1 1 1 15 9  4  f 7.2556 1.0275 57.606   14.611  44.408    19.701  73.741    21.783  6.2251 1.5797 8.2862 1.3144 -2.061109      2.055075  
1 1 1 15 9  5  o 3.7807 1.0889 7.8535   13.254  15.227    18.659  0.3447    18.830  4.1572 1.5969 3.4042 1.4809 0.7530110      2.177851  
1 1 1 15 9  6  o 14.502 0.6620 218.177  19.191  208.644   26.784  228.236   27.512  14.172 0.9450 14.833 0.9274 -0.6606627     1.324048  
1 1 1 15 9  7  o 3.8574 1.0791 9.2316   12.667  19.458    18.870  0.8440    17.089  4.4303 1.6256 3.2844 1.4197 1.145973       2.158282  
1 1 1 15 9  8  o 5.6553 1.1260 37.159   13.357  32.367    18.953  41.888    18.827  5.2957 1.6299 6.0149 1.5540 -0.7191834     2.251966  
1 1 1 15 9  9  o 4.9612 1.1473 27.736   13.131  33.709    19.621  22.891    17.672  5.3543 1.6601 4.5682 1.5842 0.7860894      2.294666  
1 1 1 15 9  10 o 11.988 0.7203 151.177  17.237  161.392   25.346  142.388   23.510  12.359 1.0254 11.617 1.0119 0.7423182      1.440574  
1 1 1 15 9  11 o 11.582 0.7401 142.662  17.128  142.425   24.736  142.880   23.739  11.557 1.0702 11.606 1.0227 -0.4989052E-01 1.480285  
1 1 1 15 9  12 o 5.1985 1.1176 28.653   14.093  51.962    20.957  9.4122    19.041  6.6112 1.6018 3.7859 1.5590 2.825303       2.235267  
1 1 1 15 9  13 o 5.6323 1.1985 38.385   14.706  33.635    21.835  42.327    19.894  5.3124 1.7619 5.9522 1.6254 -0.6398149     2.397100  
1 1 1 15 9  14 o 5.5494 1.2977 38.678   17.915  48.660    20.764  9.6073    35.434  6.4317 1.6161 4.6670 2.0308 1.764661       2.595414  
1 1 1 15 9  15 o 3.5634 1.0645 1.2531   14.158  -17.0195  21.231  15.886    18.999  2.9686 1.3960 4.1582 1.6075 -1.189601      2.129075  
1 1 1 15 9  16 o 9.1762 0.9339 93.297   16.965  83.632    24.762  101.847   23.290  8.6523 1.4310 9.7000 1.2005 -1.047622      1.867860  
1 1 1 15 9  17 o 5.5157 1.1771 32.422   15.422  56.343    22.961  12.760    20.817  6.9224 1.6763 4.1091 1.6529 2.813221       2.354179  
1 1 1 15 9  18 o 5.1277 1.2192 26.336   15.983  48.280    23.925  8.6494    21.479  6.3222 1.8036 3.9332 1.6409 2.388960       2.438322  
1 1 1 15 9  19 o 7.9616 1.1401 75.758   17.653  56.701    26.084  91.863    23.980  6.7678 1.8666 9.1554 1.3096 -2.387642      2.280145  
1 1 1 15 9  20 o 3.7052 1.1492 1.8729   16.238  -15.2504  29.321  9.4472    19.501  3.5923 1.6733 3.8181 1.5757 -0.2257290     2.298425  
1 1 1 15 9  21 o 4.9073 1.1009 32.544   14.164  -35.2661  39.505  42.548    15.173  3.7121 1.7889 6.1026 1.2838 -2.390473      2.201873  
1 1 1 15 9  22 o 8.1939 1.2943 95.331   17.025  70.504    40.826  100.558   18.732  6.7081 2.4009 9.6796 0.9676 -2.971436      2.588501  
1 1 1 15 9  23 o 9.2565 1.2306 86.898   17.640  171.697   44.041  70.693    19.252  10.726 2.1282 7.7875 1.2361 2.938167       2.461119  
1 1 1 15 9  24 o 5.8303 1.3866 49.798   16.655  63.756    41.964  47.188    18.146  5.6745 2.3230 5.9861 1.5145 -0.3115396     2.773114  
1 1 1 15 9  25 o 3.8138 1.2367 11.319   15.303  28.739    44.393  8.9704    16.302  4.3577 2.0394 3.2699 1.3996 1.087787       2.473484  
1 1 1 15 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 10 0  f 12.802 1.0693 177.962  26.246  196.467   38.023  161.121   36.273  13.498 1.4509 12.106 1.5712 -0.000000      0.000000  
1 1 1 15 10 1  o 14.328 0.6792 214.060  19.382  191.063   27.273  237.528   27.550  13.521 1.0086 15.136 0.9101 -1.615535      1.358464  
1 1 1 15 10 2  o 16.149 0.6360 270.269  20.516  275.135   28.477  265.017   29.583  16.317 0.8726 15.982 0.9255 0.3350716      1.272049  
1 1 1 15 10 3  o 5.0852 1.1752 28.949   13.804  31.444    18.817  26.040    20.314  5.2646 1.6246 4.9058 1.6987 0.3588252      2.350494  
1 1 1 15 10 4  o 8.8741 0.8656 83.555   15.302  73.970    20.991  94.425    22.355  8.3160 1.2621 9.4321 1.1850 -1.116114      1.731238  
1 1 1 15 10 5  o 6.5317 1.1119 49.468   14.793  66.412    20.955  32.633    20.887  7.7191 1.4093 5.3444 1.7202 2.374698       2.223743  
1 1 1 15 10 6  o 8.6657 0.8972 81.022   15.504  88.858    22.165  73.516    21.694  9.1010 1.2177 8.2305 1.3179 0.8705330      1.794389  
1 1 1 15 10 7  o 4.0076 1.1225 13.122   13.426  9.9124    19.745  15.882    18.311  3.8801 1.5915 4.1350 1.5834 -0.2548406     2.245044  
1 1 1 15 10 8  o 12.647 0.7083 168.874  17.898  161.223   25.342  176.487   25.281  12.344 1.0265 12.949 0.9761 -0.6051617     1.416508  
1 1 1 15 10 9  o 4.6296 1.1678 22.955   13.649  26.139    19.972  20.165    18.698  4.8400 1.6838 4.4192 1.6187 0.4208746      2.335683  
1 1 1 15 10 10 o 8.4338 0.9441 78.711   15.905  84.077    22.966  73.765    22.049  8.7208 1.3168 8.1468 1.3532 0.5740442      1.888136  
1 1 1 15 10 11 o 4.3118 1.1657 18.264   13.997  18.124    20.583  18.384    19.092  4.3325 1.6737 4.2912 1.6231 0.4133272E-01  2.331483  
1 1 1 15 10 12 o 3.5685 1.0733 4.7448   13.452  1.7775    19.212  7.5986    18.840  3.4465 1.4975 3.6904 1.5379 -0.2438679     2.146589  
1 1 1 15 10 13 o 5.7211 1.1903 39.189   14.747  31.784    22.122  45.112    19.784  5.2382 1.7738 6.2039 1.5878 -0.9656787     2.380661  
1 1 1 15 10 14 o 6.1451 1.4540 43.163   18.957  59.548    37.822  37.666    21.907  6.6820 2.3176 5.6082 1.7566 1.073782       2.908101  
1 1 1 15 10 15 o 15.500 0.6973 253.894  21.545  279.828   30.764  228.931   30.182  16.313 0.9429 14.688 1.0275 1.625241       1.394547  
1 1 1 15 10 16 o 4.2884 1.1610 15.375   14.944  -1.0657   23.282  26.894    19.489  3.6647 1.6187 4.9122 1.6649 -1.247484      2.322043  
1 1 1 15 10 17 o 10.634 0.8651 122.101  18.237  119.343   27.417  124.290   24.425  10.470 1.3092 10.797 1.1311 -0.3268547     1.730150  
1 1 1 15 10 18 o 11.538 0.8680 146.626  19.602  121.841   28.843  167.898   26.721  10.505 1.3728 12.572 1.0628 -2.066354      1.736087  
1 1 1 15 10 19 o 3.9539 1.1614 6.2273   15.180  20.298    23.984  -3.1761   19.607  4.6157 1.8001 3.2922 1.4680 1.323424       2.322786  
1 1 1 15 10 20 o 11.163 0.9002 141.179  19.451  112.615   28.921  164.770   26.283  9.9415 1.4546 12.385 1.0611 -2.443435      1.800452  
1 1 1 15 10 21 o 6.6300 1.1112 58.221   16.847  18.931    26.235  85.789    21.976  4.4827 1.8361 8.7772 1.2519 -4.294539      2.222302  
1 1 1 15 10 22 f 5.6024 1.0454 25.509   15.608  85.092    25.271  -11.2355  19.845  8.2838 1.5830 2.9209 1.3659 5.362900       2.090850  
1 1 1 15 10 23 o 2.9730 1.0043 -7.5390  13.284  -47.4638  37.451  -1.7928   14.208  3.2045 1.5848 2.7416 1.2339 0.4629543      2.008551  
1 1 1 15 10 24 o 3.4089 1.1051 5.3164   14.515  -26.0409  41.334  9.7274    15.503  3.5016 1.7186 3.3163 1.3896 0.1852520      2.210152  
1 1 1 15 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 10 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 0  o 2.3609 1.1567 -19.5299 17.868  -5.2433   28.289  -29.0128  23.047  2.7808 1.8568 1.9410 1.3800 -0.000000      0.000000  
1 1 1 15 11 1  o 9.1538 0.9292 93.094   15.966  118.818   22.531  67.149    22.627  10.623 1.0604 7.6841 1.5261 2.939430       1.858390  
1 1 1 15 11 2  o 12.160 0.7375 155.596  17.931  156.811   25.126  154.334   25.598  12.217 1.0284 12.103 1.0575 0.1136093      1.475072  
1 1 1 15 11 3  o 7.3124 1.0431 61.336   14.910  76.290    20.809  45.558    21.375  8.4168 1.2361 6.2080 1.6804 2.208803       2.086127  
1 1 1 15 11 4  o 6.7155 1.1260 53.037   14.933  47.268    21.585  58.334    20.681  6.3050 1.6810 7.1260 1.4986 -0.8210135     2.252061  
1 1 1 15 11 5  o 3.2551 1.0219 -2.2931  13.273  -1.7514   19.254  -2.7837   18.323  3.3138 1.4674 3.1965 1.4227 0.1172712      2.043840  
1 1 1 15 11 6  o 7.4223 1.0750 63.119   15.380  71.163    22.928  56.538    20.739  7.8644 1.5126 6.9802 1.5279 0.8842282      2.150017  
1 1 1 15 11 7  o 8.1715 1.0360 75.943   16.360  63.107    23.398  88.222    22.884  7.3281 1.6377 9.0150 1.2692 -1.686870      2.071939  
1 1 1 15 11 8  o 8.1178 1.0027 74.367   15.886  81.758    22.761  67.346    22.183  8.6132 1.3213 7.6224 1.5085 0.9907255      2.005330  
1 1 1 15 11 9  o 7.2603 1.1145 62.242   15.715  64.038    21.943  60.350    22.518  7.4002 1.5330 7.1203 1.6180 0.2799354      2.228919  
1 1 1 15 11 10 o 6.2387 1.1971 46.813   15.420  55.530    22.506  39.101    21.169  6.7950 1.6683 5.6824 1.7173 1.112612       2.394289  
1 1 1 15 11 11 o 9.0598 0.9284 88.393   16.688  104.288   25.437  76.381    22.111  9.7703 1.3017 8.3493 1.3241 1.421082       1.856849  
1 1 1 15 11 12 o 5.4547 1.2238 34.346   15.025  42.617    22.613  27.806    20.106  5.9540 1.7694 4.9555 1.6910 0.9984560      2.447507  
1 1 1 15 11 13 o 6.4401 1.1264 48.738   15.326  72.649    22.160  26.814    21.219  7.9908 1.4395 4.8893 1.7329 3.101478       2.252810  
1 1 1 15 11 14 o 6.4211 1.2188 49.564   16.081  59.380    23.638  41.108    21.940  7.0222 1.7010 5.8200 1.7459 1.202287       2.437586  
1 1 1 15 11 15 o 8.6473 1.0706 86.021   17.628  67.280    25.869  102.267   24.085  7.5380 1.7496 9.7566 1.2343 -2.218594      2.141171  
1 1 1 15 11 16 o 12.787 0.7770 174.396  19.777  164.564   28.810  183.156   27.197  12.400 1.1617 13.173 1.0323 -0.7729883     1.554059  
1 1 1 15 11 17 o 5.5212 1.2804 36.604   16.548  29.609    25.054  42.018    22.040  5.1323 1.8747 5.9102 1.7445 -0.7779016     2.560815  
1 1 1 15 11 18 o 16.558 0.7091 289.992  23.334  267.918   34.002  309.643   32.081  15.903 1.0690 17.213 0.9319 -1.309707      1.418186  
1 1 1 15 11 19 o 5.1482 1.2827 31.751   16.333  30.926    25.259  32.343    21.412  5.1172 1.8803 5.1793 1.7451 -0.6215191E-01 2.565370  
1 1 1 15 11 20 o 12.136 0.8820 165.461  20.997  145.656   31.423  181.439   28.223  11.330 1.3867 12.942 1.0904 -1.611835      1.764031  
1 1 1 15 11 21 o 3.8133 1.1558 2.8283   15.703  24.815    25.940  -9.8904   19.729  4.6584 1.8549 2.9682 1.3793 1.690123       2.311500  
1 1 1 15 11 22 o 4.7404 1.2683 27.920   16.338  47.247    26.830  16.530    20.597  5.5399 1.9502 3.9408 1.6220 1.599113       2.536536  
1 1 1 15 11 23 o 3.2388 1.0422 -0.6810  15.267  -18.7621  26.033  8.7968    18.848  3.0209 1.4549 3.4567 1.4926 -0.4357762     2.084330  
1 1 1 15 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 11 30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 12 0  o 5.6726 1.7998 52.469   21.776  60.275    32.704  46.252    29.188  6.0935 2.6184 5.2517 2.4701 -0.000000      0.000000  
1 1 1 15 12 1  o 8.0531 1.0081 73.458   15.734  65.238    22.797  80.934    21.742  7.4798 1.5738 8.6265 1.2602 -1.146653      2.016147  
1 1 1 15 12 2  o 3.8086 1.0946 5.8061   14.117  21.708    19.993  -10.0065  19.937  4.5468 1.6726 3.0704 1.4124 1.476414       2.189127  
1 1 1 15 12 3  o 3.8244 1.1324 7.8138   14.536  7.7607    20.121  7.8718    21.022  3.7939 1.5859 3.8550 1.6169 -0.6109238E-01 2.264836  
1 1 1 15 12 4  o 6.6531 1.1815 52.763   15.717  56.095    21.512  48.948    23.021  6.9296 1.5864 6.3765 1.7514 0.5531259      2.363076  
1 1 1 15 12 5  o 5.6468 1.1809 36.916   15.538  17.616    21.951  56.296    21.997  4.3842 1.7187 6.9095 1.6199 -2.525340      2.361794  
1 1 1 15 12 6  o 8.7440 1.0355 89.690   17.000  64.358    24.725  112.401   23.411  7.2819 1.7243 10.206 1.1469 -2.924298      2.070937  
1 1 1 15 12 7  o 4.2057 1.1364 16.796   13.766  7.2357    21.166  23.804    18.123  3.8041 1.6104 4.6072 1.6039 -0.8030775     2.272875  
1 1 1 15 12 8  o 5.5392 1.1608 33.435   15.184  59.115    22.830  13.064    20.333  7.0315 1.6515 4.0470 1.6316 2.984507       2.321553  
1 1 1 15 12 9  f 10.725 0.8421 125.338  17.865  142.874   25.019  107.094   25.518  11.567 1.0815 9.8820 1.2912 1.685182       1.684255  
1 1 1 15 12 10 o 9.6997 0.8879 101.923  17.204  107.921   24.462  96.052    24.200  10.001 1.2229 9.3981 1.2875 0.6031704      1.775729  
1 1 1 15 12 11 o 4.2529 1.1789 16.034   14.631  13.828    21.447  17.954    20.009  4.1734 1.6781 4.3324 1.6561 -0.1590447     2.357714  
1 1 1 15 12 12 o 3.7156 1.1044 5.4275   14.452  -6.1193   21.576  14.823    19.463  3.3234 1.5059 4.1077 1.6158 -0.7843337     2.208751  
1 1 1 15 12 13 o 6.3401 1.1863 47.251   15.922  67.661    23.498  29.925    21.649  7.5945 1.5976 5.0857 1.7540 2.508807       2.372561  
1 1 1 15 12 14 o 4.6883 1.1457 18.342   15.273  42.653    21.661  -5.6933   21.538  6.0076 1.7170 3.3691 1.5175 2.638580       2.291481  
1 1 1 15 12 15 o 6.9397 1.2057 57.889   16.635  51.346    25.014  63.077    22.274  6.4935 1.8413 7.3860 1.5569 -0.8925486     2.411310  
1 1 1 15 12 16 o 10.334 0.9547 119.214  19.301  100.983   28.650  134.365   26.117  9.4807 1.5109 11.187 1.1673 -1.705922      1.909354  
1 1 1 15 12 17 o 6.8789 1.2297 56.354   16.913  61.964    24.873  51.529    23.067  7.1973 1.7458 6.5606 1.7324 0.6367483      2.459488  
1 1 1 15 12 18 o 10.081 0.9479 114.215  18.851  104.311   28.094  122.326   25.424  9.5775 1.4667 10.584 1.2011 -1.006540      1.895709  
1 1 1 15 12 19 o 5.4536 1.5743 33.467   24.283  30.654    27.717  42.759    50.367  5.0970 1.9490 5.8102 2.4729 -0.7131267     3.148628  
1 1 1 15 12 20 o 4.4733 1.2501 21.652   16.796  13.283    26.708  27.127    21.602  4.2075 1.7960 4.7391 1.7393 -0.5316362     2.500133  
1 1 1 15 12 21 o 5.3386 1.2741 41.905   17.574  23.217    27.638  54.588    22.769  4.4115 1.8523 6.2656 1.7498 -1.854186      2.548126  
1 1 1 15 12 22 o 6.1914 1.3494 56.318   18.096  71.257    28.911  46.695    23.203  6.7601 1.9988 5.6226 1.8134 1.137550       2.698812  
1 1 1 15 12 23 o 4.1930 1.2370 24.711   16.853  25.816    28.676  24.128    20.831  4.2384 1.8356 4.1475 1.6587 0.9094429E-01  2.473980  
1 1 1 15 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 12 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 13 0  o 16.111 0.9740 279.328  30.742  276.977   45.222  281.347   41.917  15.994 1.4406 16.228 1.3112 -0.000000      0.000000  
1 1 1 15 13 1  o 5.4281 1.2442 35.378   15.455  32.243    21.484  38.741    22.251  5.2140 1.7481 5.6421 1.7709 -0.4281330     2.488350  
1 1 1 15 13 2  o 7.2183 1.1128 61.844   15.617  67.421    21.625  55.764    22.577  7.6395 1.4687 6.7972 1.6722 0.8422279      2.225598  
1 1 1 15 13 3  o 3.7898 1.0420 -0.6172  14.400  30.303    19.881  -34.7434  20.886  5.0659 1.6813 2.5138 1.2313 2.552182       2.083933  
1 1 1 15 13 4  o 3.1920 1.0214 -10.6525 14.490  -25.0852  19.779  6.0665    21.288  2.6239 1.2648 3.7601 1.6042 -1.136233      2.042818  
1 1 1 15 13 5  o 8.4195 1.0039 80.033   16.557  79.226    23.679  80.805    23.159  8.3000 1.4808 8.5390 1.3561 -0.2389908     2.007872  
1 1 1 15 13 6  o 5.0624 1.2311 29.959   15.085  28.624    21.986  31.147    20.735  4.9863 1.7643 5.1384 1.7174 -0.1520920     2.462151  
1 1 1 15 13 7  o 9.0985 0.9156 90.848   16.640  88.766    23.918  92.802    23.165  8.9736 1.3327 9.2235 1.2558 -0.2498970     1.831140  
1 1 1 15 13 8  f 6.4545 1.2101 50.297   16.027  42.443    23.529  57.094    21.889  5.9255 1.8147 6.9834 1.6014 -1.057905      2.420262  
1 1 1 15 13 9  o 9.9677 1.0127 116.550  18.242  74.679    26.817  152.611   24.887  7.9180 1.7408 12.017 1.0354 -4.099349      2.025489  
1 1 1 15 13 10 o 12.128 0.7954 156.485  19.246  170.067   28.396  144.945   26.175  12.612 1.1258 11.644 1.1239 0.9674845      1.590782  
1 1 1 15 13 11 o 7.5299 1.1582 67.356   16.948  70.345    24.152  64.456    23.790  7.7140 1.6171 7.3459 1.6585 0.3681569      2.316429  
1 1 1 15 13 12 o 4.9271 1.2589 26.782   15.976  23.605    23.214  29.641    22.019  4.7611 1.7924 5.0931 1.7682 -0.3319516     2.517771  
1 1 1 15 13 13 o 8.4498 1.0746 81.322   17.558  69.487    25.391  92.166    24.305  7.6898 1.6965 9.2097 1.3196 -1.519923      2.149235  
1 1 1 15 13 14 o 3.6561 1.1222 1.8179   15.385  -6.0312   23.557  7.6557    20.316  3.4980 1.5802 3.8142 1.5939 -0.3162625     2.244489  
1 1 1 15 13 15 o 18.177 0.6925 347.332  25.139  353.355   36.679  341.995   34.523  18.304 1.0019 18.049 0.9564 0.2550316      1.385091  
1 1 1 15 13 16 o 5.9840 1.2505 43.725   16.899  27.013    25.426  56.948    22.617  5.0171 1.8783 6.9509 1.6513 -1.933863      2.501006  
1 1 1 15 13 17 o 10.782 0.9304 128.850  19.901  130.071   30.085  127.901   26.536  10.759 1.3982 10.805 1.2279 -0.4685211E-01 1.860837  
1 1 1 15 13 18 o 15.482 0.7615 257.083  23.494  288.152   34.683  230.738   31.938  16.358 1.0601 14.605 1.0934 1.753345       1.522913  
1 1 1 15 13 19 o 12.582 0.8886 178.080  22.238  173.992   32.880  181.526   30.189  12.367 1.3294 12.798 1.1795 -0.4307032     1.777183  
1 1 1 15 13 20 o 4.9295 1.2644 31.800   17.724  11.038    26.813  47.912    23.621  4.0016 1.7533 5.8575 1.8223 -1.855935      2.528791  
1 1 1 15 13 21 o 7.7982 1.4430 111.733  25.832  123.799   29.088  66.710    56.188  9.9952 1.4551 5.6011 2.4922 4.394049       2.885917  
1 1 1 15 13 22 o 2.7861 0.9423 -19.4431 15.805  -49.6058  25.519  -0.6751   20.130  2.4568 1.2298 3.1153 1.4279 -0.6584899     1.884524  
1 1 1 15 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 0  o 5.7170 1.8403 55.589   23.065  50.857    34.965  59.234    30.690  5.3344 2.6743 6.0995 2.5288 -0.000000      0.000000  
1 1 1 15 14 1  o 3.6495 1.1034 3.7173   14.640  -5.3006   21.149  12.015    20.287  3.3111 1.4965 3.9878 1.6218 -0.6766708     2.206753  
1 1 1 15 14 2  o 7.2789 1.1107 62.660   16.405  90.458    23.579  36.580    22.838  9.0656 1.3004 5.4921 1.8010 3.573587       2.221408  
1 1 1 15 14 3  o 12.747 0.7522 173.384  19.162  180.762   27.145  166.055   27.053  13.034 1.0413 12.460 1.0856 0.5739784      1.504305  
1 1 1 15 14 4  o 10.699 0.8959 124.046  18.660  90.644    25.294  163.932   27.640  9.0279 1.4009 12.370 1.1172 -3.342126      1.791832  
1 1 1 15 14 5  o 6.9510 1.1283 58.024   16.747  86.345    23.296  27.737    24.091  8.8897 1.3103 5.0123 1.8372 3.877409       2.256567  
1 1 1 15 14 6  o 4.0929 1.1815 11.528   15.394  6.7902    21.597  16.421    21.948  3.8505 1.6282 4.3354 1.7126 -0.4848666     2.363000  
1 1 1 15 14 7  o 5.7620 1.2579 39.539   15.897  43.210    23.678  36.526    21.450  5.9745 1.8186 5.5496 1.7382 0.4249563      2.515703  
1 1 1 15 14 8  o 3.5236 1.0413 -11.7921 14.814  23.891    21.491  -44.0944  20.448  4.7249 1.7347 2.3223 1.1525 2.402633       2.082618  
1 1 1 15 14 9  o 14.868 0.7175 234.656  21.294  226.659   30.698  242.074   29.563  14.592 1.0519 15.144 0.9761 -0.5519552     1.435015  
1 1 1 15 14 10 o 5.6660 1.2224 35.658   16.286  59.812    24.526  16.610    21.780  7.0215 1.7522 4.3106 1.7050 2.710895       2.444772  
1 1 1 15 14 11 o 4.0102 1.1784 9.4196   15.545  5.9764    23.859  11.959    20.491  3.9721 1.6965 4.0484 1.6359 -0.7630873E-01 2.356755  
1 1 1 15 14 12 o 5.2990 1.2911 32.598   16.609  29.192    25.372  35.152    21.970  5.1353 1.8849 5.4626 1.7648 -0.3272948     2.582144  
1 1 1 15 14 13 o 7.2376 1.1490 65.081   18.267  22.476    27.070  100.702   24.752  4.8419 1.9053 9.6333 1.2847 -4.791345      2.297994  
1 1 1 15 14 14 o 3.8294 1.1595 5.3771   15.890  0.8076    23.699  9.1089    21.417  3.7283 1.6405 3.9304 1.6390 -0.2021792     2.318968  
1 1 1 15 14 15 o 7.9241 1.2159 74.282   18.713  77.073    26.840  71.641    26.105  8.0763 1.7146 7.7719 1.7245 0.3043809      2.431858  
1 1 1 15 14 16 o 3.4882 1.1166 -5.3796  16.886  -14.0302  25.579  1.3023    22.481  3.3505 1.5614 3.6259 1.5966 -0.2753835     2.233177  
1 1 1 15 14 17 o 6.2999 1.3481 50.043   18.390  63.321    28.448  40.512    24.103  6.9467 1.9615 5.6530 1.8500 1.293699       2.696291  
1 1 1 15 14 18 o 2.9581 0.9991 -22.3918 16.371  -13.5037  24.691  -29.3643  21.869  3.2488 1.5206 2.6675 1.2963 0.5812931      1.998136  
1 1 1 15 14 19 o 6.4714 1.2835 59.163   18.217  40.915    27.594  73.260    24.253  5.3780 1.9670 7.5649 1.6495 -2.186892      2.567067  
1 1 1 15 14 20 f 5.8716 1.3151 46.948   18.351  77.310    28.634  25.785    23.906  7.2678 1.9354 4.4753 1.7811 2.792486       2.630255  
1 1 1 15 14 21 o 4.9831 1.1294 37.430   19.255  -57.5973  41.119  64.122    21.792  3.1460 1.5728 6.8203 1.6214 -3.674342      2.258872  
1 1 1 15 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 14 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 0  o 3.1770 1.4616 1.4209   22.779  -10.9451  32.102  13.962    32.329  2.7997 1.9011 3.5544 2.2205 -0.000000      0.000000  
1 1 1 15 15 1  o 7.4404 1.2240 65.990   17.870  66.097    25.438  65.885    25.108  7.4400 1.7405 7.4409 1.7214 -0.8502007E-03 2.447952  
1 1 1 15 15 2  o 5.2001 1.2810 30.680   16.353  35.702    24.090  26.388    22.271  5.4950 1.8511 4.9053 1.7712 0.5897760      2.561944  
1 1 1 15 15 3  o 14.781 0.7352 231.163  21.696  226.811   31.422  235.128   29.994  14.621 1.0746 14.941 1.0037 -0.3205528     1.470429  
1 1 1 15 15 4  o 4.8848 1.2552 25.285   16.343  15.082    23.457  34.910    22.783  4.3325 1.7504 5.4371 1.7996 -1.104551      2.510470  
1 1 1 15 15 5  o 9.2874 0.9840 95.218   18.254  101.712   26.128  89.026    25.514  9.6174 1.3584 8.9575 1.4242 0.6599112      1.968096  
1 1 1 15 15 6  o 8.2429 1.4217 90.383   22.351  97.345    26.097  71.219    43.297  9.3697 1.3927 7.1162 2.4790 2.253453       2.843415  
1 1 1 15 15 7  o 13.584 0.7751 196.910  20.995  219.281   30.572  176.945   28.881  14.336 1.0663 12.832 1.1253 1.503798       1.550248  
1 1 1 15 15 8  o 11.687 0.8761 148.941  20.396  138.300   29.294  158.951   28.413  11.229 1.3044 12.144 1.1699 -0.9144592     1.752127  
1 1 1 15 15 9  o 8.9026 1.0828 89.161   18.622  109.527   27.301  71.438    25.467  10.004 1.3645 7.8012 1.6818 2.202928       2.165672  
1 1 1 15 15 10 o 6.1237 1.2375 45.481   17.053  25.418    25.335  62.100    23.058  4.9465 1.8701 7.3009 1.6213 -2.354476      2.475073  
1 1 1 15 15 11 o 4.6049 1.2410 20.992   15.903  17.952    23.335  23.628    21.730  4.4776 1.7668 4.7322 1.7433 -0.2545824     2.482007  
1 1 1 15 15 12 o 5.0262 1.0609 18.502   16.227  -28.1761  23.702  59.679    22.262  2.9050 1.3963 7.1474 1.5975 -4.242362      2.121716  
1 1 1 15 15 13 o 6.8384 1.2785 57.268   18.029  45.314    25.304  69.594    25.695  6.0581 1.8864 7.6187 1.7262 -1.560587      2.557017  
1 1 1 15 15 14 o 8.1125 1.1842 75.622   19.129  114.467   28.763  44.813    25.615  10.174 1.4136 6.0512 1.9002 4.122613       2.368327  
1 1 1 15 15 15 o 7.2892 1.2913 65.528   19.093  86.889    28.576  48.302    25.661  8.4284 1.7524 6.1499 1.8971 2.278506       2.582601  
1 1 1 15 15 16 o 3.0412 1.0318 -26.3142 18.026  -22.3552  26.543  -29.7030  24.558  3.1916 1.5186 2.8908 1.3973 0.3008521      2.063646  
1 1 1 15 15 17 o 4.8754 1.2913 22.306   18.588  50.717    28.038  0.0293    24.828  6.0937 1.9954 3.6570 1.6397 2.436698       2.582684  
1 1 1 15 15 18 o 3.6177 1.1582 -0.3238  17.821  5.9578    27.213  -5.0408   23.581  3.8859 1.7313 3.3495 1.5390 0.5364017      2.316468  
1 1 1 15 15 19 o 7.4895 1.3424 80.668   20.033  80.760    30.584  80.598    26.513  7.3075 2.0234 7.6715 1.7647 -0.3639474     2.684893  
1 1 1 15 15 20 o 3.4967 1.1201 3.2371   17.391  -13.1408  28.414  13.047    21.990  3.2498 1.5531 3.7437 1.6144 -0.4939160     2.240176  
1 1 1 15 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 15 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 16 0  o 14.211 1.1202 222.782  30.823  225.336   44.061  220.334   43.133  14.287 1.5927 14.136 1.5757 -0.000000      0.000000  
1 1 1 15 16 1  o 11.462 0.8521 143.442  19.319  158.980   26.622  126.157   28.078  12.203 1.0908 10.722 1.3094 1.481156       1.704235  
1 1 1 15 16 2  o 10.786 0.9098 130.149  19.062  153.207   26.008  103.386   28.020  11.977 1.0857 9.5954 1.4601 2.382043       1.819516  
1 1 1 15 16 3  o 4.9099 1.2884 26.056   16.967  19.456    23.290  33.520    24.768  4.5064 1.7692 5.3135 1.8734 -0.8071275     2.576718  
1 1 1 15 16 4  o 7.8362 1.1055 73.565   17.490  118.674   25.254  31.981    24.247  10.455 1.2078 5.2179 1.8521 5.236687       2.211076  
1 1 1 15 16 5  o 8.3606 1.1276 81.740   18.160  78.280    25.795  85.140    25.570  8.1469 1.6399 8.5744 1.5481 -0.4274578     2.255143  
1 1 1 15 16 6  o 13.296 0.7931 188.953  21.041  199.607   29.467  177.871   30.054  13.713 1.0744 12.878 1.1669 0.8349180      1.586160  
1 1 1 15 16 7  o 8.0317 1.1302 79.251   17.803  39.207    26.187  113.663   24.276  5.7465 1.9300 10.317 1.1765 -4.570466      2.260323  
1 1 1 15 16 8  o 3.5606 1.1237 -3.6509  16.395  -9.2768   23.506  1.6789    22.879  3.3921 1.5504 3.7291 1.6271 -0.3369839     2.247483  
1 1 1 15 16 9  o 14.908 0.7589 235.641  22.619  235.501   32.459  235.772   31.538  14.891 1.0899 14.926 1.0565 -0.3492355E-01 1.517895  
1 1 1 15 16 10 o 10.790 0.9051 126.393  19.518  124.981   28.012  127.725   27.210  10.713 1.3074 10.867 1.2520 -0.1538582     1.810172  
1 1 1 15 16 11 o 4.6298 1.2509 16.473   17.247  38.410    25.869  -1.0811   23.141  5.6369 1.9181 3.6228 1.6063 2.014170       2.501853  
1 1 1 15 16 12 o 6.6277 1.3616 54.638   19.131  51.369    28.674  57.260    25.683  6.4053 2.0103 6.8501 1.8369 -0.4448323     2.723120  
1 1 1 15 16 13 o 4.3068 1.2644 9.2390   18.682  27.465    27.365  -6.6714   25.568  5.0292 1.9334 3.5843 1.6300 1.444880       2.528805  
1 1 1 15 16 14 o 4.7036 1.3315 22.200   18.967  22.411    28.004  22.021    25.780  4.7451 1.9142 4.6621 1.8515 0.8298683E-01  2.663058  
1 1 1 15 16 15 o 6.4850 1.3965 56.299   20.277  43.641    29.715  67.329    27.738  5.7571 2.0496 7.2128 1.8974 -1.455640      2.792975  
1 1 1 15 16 16 o 5.4577 1.4047 39.658   20.201  30.852    29.090  47.859    28.073  5.0171 1.9749 5.8983 1.9982 -0.8811793     2.809423  
1 1 1 15 16 17 o 4.2323 1.2706 16.298   18.712  23.442    27.771  10.358    25.323  4.5265 1.8752 3.9381 1.7152 0.5883796      2.541285  
1 1 1 15 16 18 o 3.8780 1.2022 9.1042   18.742  -9.6821   29.655  21.599    24.185  3.4745 1.6388 4.2815 1.7594 -0.8069491     2.404392  
1 1 1 15 16 19 f 3.5507 1.1208 -0.8276  18.228  -34.6161  28.029  23.937    23.996  2.8410 1.3985 4.2603 1.7518 -1.419326      2.241601  
1 1 1 15 16 20 o 4.2980 1.2800 25.525   19.183  43.937    28.648  10.561    25.828  4.9402 1.9549 3.6558 1.6528 1.284356       2.560014  
1 1 1 15 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 0  o 4.2130 1.7144 26.797   23.214  40.978    35.727  16.435    30.538  4.8250 2.6233 3.6010 2.2078 -0.000000      0.000000  
1 1 1 15 17 1  o 3.7659 1.1473 0.0432   16.529  -16.1961  23.831  15.096    22.944  3.2127 1.5005 4.3190 1.7360 -1.106318      2.294635  
1 1 1 15 17 2  o 11.438 0.8884 141.366  20.242  126.810   28.427  156.337   28.830  10.799 1.3162 12.077 1.1936 -1.278024      1.776843  
1 1 1 15 17 3  o 7.9177 1.1649 73.175   18.115  85.044    24.912  59.857    26.389  8.7990 1.4156 7.0365 1.8505 1.762501       2.329846  
1 1 1 15 17 4  o 10.317 0.9643 116.705  19.718  100.661   28.007  132.474   27.765  9.5426 1.4675 11.092 1.2516 -1.549693      1.928690  
1 1 1 15 17 5  o 7.7398 1.2356 71.643   18.616  67.085    27.844  75.326    25.034  7.4180 1.8757 8.0617 1.6090 -0.6436515     2.471234  
1 1 1 15 17 6  o 4.2272 1.2371 11.376   17.302  3.9976    25.075  18.082    23.904  3.9503 1.7136 4.5042 1.7847 -0.5539260     2.474204  
1 1 1 15 17 7  o 8.8557 1.1281 90.483   19.323  77.129    27.850  102.880   26.833  8.0364 1.7797 9.6750 1.3867 -1.638651      2.256168  
1 1 1 15 17 8  o 5.3518 1.3536 32.543   18.414  39.221    26.918  26.669    25.246  5.7122 1.9566 4.9915 1.8711 0.7206631      2.707240  
1 1 1 15 17 9  o 8.2892 1.2067 82.226   19.656  61.036    28.102  102.521   27.502  6.9818 1.9419 9.5965 1.4329 -2.614658      2.413335  
1 1 1 15 17 10 o 7.2579 1.3301 65.605   19.849  50.825    28.521  79.487    27.641  6.3586 2.0063 8.1571 1.7469 -1.798576      2.660238  
1 1 1 15 17 11 o 11.855 0.9429 153.172  21.626  206.450   31.988  108.320   29.349  13.878 1.1525 9.8315 1.4926 4.046462       1.885763  
1 1 1 15 17 12 o 5.9593 1.2722 35.340   19.831  83.533    30.339  -0.6093   26.204  8.1310 1.8999 3.7876 1.6924 4.343407       2.544351  
1 1 1 15 17 13 o 11.288 1.0068 145.927  22.462  128.246   32.586  161.935   31.006  10.505 1.5510 12.072 1.2842 -1.567224      2.013648  
1 1 1 15 17 14 o 12.148 0.9863 167.678  23.886  186.353   34.682  150.827   32.945  12.836 1.3510 11.460 1.4374 1.375412       1.972609  
1 1 1 15 17 15 o 6.2305 1.2968 52.119   20.383  15.896    29.886  83.620    27.870  4.4000 1.8895 8.0609 1.7766 -3.660909      2.593576  
1 1 1 15 17 16 o 3.2596 1.0908 -13.3232 18.904  -18.2139  27.941  -9.1948   25.672  3.2180 1.5385 3.3011 1.5468 -0.8311248E-01 2.181682  
1 1 1 15 17 17 o 4.6933 1.3399 25.820   20.263  50.031    30.552  6.8072    27.074  5.5870 2.0654 3.7996 1.7074 1.787431       2.679744  
1 1 1 15 17 18 o 4.6812 1.3209 31.758   20.270  9.8181    30.116  49.929    27.408  3.8702 1.7635 5.4923 1.9670 -1.622150      2.641747  
1 1 1 15 17 19 o 3.6111 1.1774 6.9640   19.779  0.0786    31.312  11.536    25.515  3.5440 1.6754 3.6782 1.6547 -0.1341970     2.354764  
1 1 1 15 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 17 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 0  o 2.2577 1.1411 -44.0075 23.445  -41.8280  33.104  -46.2009  33.209  2.2850 1.6297 2.2305 1.5978 -0.000000      0.000000  
1 1 1 15 18 1  o 3.7127 1.1738 -4.1652  17.990  -11.8765  25.014  4.0974    25.893  3.4208 1.5767 4.0047 1.7393 -0.5838780     2.347569  
1 1 1 15 18 2  o 5.1492 1.2863 28.171   17.895  44.865    24.489  9.0411    26.215  6.0828 1.8491 4.2156 1.7888 1.867215       2.572698  
1 1 1 15 18 3  o 15.464 0.7403 253.139  22.801  227.854   32.212  278.530   32.279  14.646 1.0997 16.282 0.9912 -1.636699      1.480500  
1 1 1 15 18 4  o 9.5952 1.0091 102.158  19.258  108.174   26.538  95.466    27.991  9.9530 1.3332 9.2374 1.5151 0.7156324      2.018124  
1 1 1 15 18 5  o 9.2533 1.0729 96.020   19.852  93.589    27.788  98.555    28.372  9.1308 1.5216 9.3758 1.5130 -0.2449474     2.145844  
1 1 1 15 18 6  o 7.8050 1.2240 73.392   19.329  49.154    27.429  97.301    27.242  6.2739 1.9657 9.3361 1.4590 -3.062201      2.447987  
1 1 1 15 18 7  o 6.2197 1.2893 46.863   18.664  22.925    26.573  70.173    26.222  4.8098 1.8893 7.6297 1.7550 -2.819855      2.578656  
1 1 1 15 18 8  o 4.0317 1.2314 3.3300   18.337  14.541    27.099  -6.1374   24.904  4.4785 1.8536 3.5849 1.6217 0.8936594      2.462835  
1 1 1 15 18 9  o 12.011 0.9067 158.583  21.541  139.033   31.236  176.311   29.745  11.209 1.3933 12.813 1.1607 -1.603712      1.813427  
1 1 1 15 18 10 o 4.6737 1.3215 21.414   18.751  17.818    27.665  24.470    25.503  4.5544 1.8778 4.7930 1.8598 -0.2386651     2.642942  
1 1 1 15 18 11 o 5.7366 1.4049 42.380   19.706  39.188    29.033  45.107    26.833  5.5633 2.0202 5.9098 1.9528 -0.3464851     2.809758  
1 1 1 15 18 12 o 5.3202 1.4110 34.614   20.782  23.757    30.007  44.621    28.808  4.8214 1.9680 5.8189 2.0224 -0.9974108     2.821913  
1 1 1 15 18 13 o 7.5516 1.4294 77.475   22.025  82.931    31.811  72.451    30.526  7.8219 2.0195 7.2812 2.0235 0.5407352      2.858828  
1 1 1 15 18 14 o 11.176 1.0414 148.695  23.143  137.827   33.416  158.713   32.083  10.666 1.5664 11.685 1.3728 -1.018598      2.082843  
1 1 1 15 18 15 o 8.2079 1.3522 101.879  22.913  73.457    34.468  124.384   30.671  6.5406 2.2141 9.8751 1.5530 -3.334501      2.704443  
1 1 1 15 18 16 o 3.3184 1.1101 -11.1629 19.208  -3.7906   29.388  -16.6608  25.379  3.5711 1.6674 3.0657 1.4659 0.5054305      2.220125  
1 1 1 15 18 17 o 4.7342 1.2206 24.891   20.458  -32.5143  31.732  65.719    26.761  3.0447 1.4967 6.4236 1.9286 -3.378844      2.441211  
1 1 1 15 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 18 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 0  o 4.4832 1.7680 30.059   25.859  54.877    36.949  6.2336    36.202  5.5550 2.7554 3.4113 2.2161 -0.000000      0.000000  
1 1 1 15 19 1  o 7.9449 1.2662 76.504   19.643  72.672    28.077  80.177    27.491  7.6996 1.8470 8.1901 1.7324 -0.4904952     2.532307  
1 1 1 15 19 2  o 9.3328 1.1546 101.093  21.043  94.423    29.837  107.693   29.683  8.9001 1.7386 9.7654 1.5198 -0.8653698     2.309196  
1 1 1 15 19 3  o 14.360 0.8249 221.779  23.685  228.577   33.771  215.199   33.227  14.584 1.1578 14.136 1.1753 0.4481659      1.649776  
1 1 1 15 19 4  o 5.2831 1.3495 32.048   18.428  26.761    26.960  36.684    25.247  5.0237 1.9219 5.5424 1.8949 -0.5187707     2.698962  
1 1 1 15 19 5  o 6.5597 1.3560 52.854   18.882  56.779    27.704  49.448    25.805  6.7677 1.9441 6.3518 1.8908 0.4158282      2.711908  
1 1 1 15 19 6  o 11.912 0.9550 157.990  22.193  123.276   31.757  191.128   31.027  10.475 1.5158 13.349 1.1621 -2.873759      1.910014  
1 1 1 15 19 7  o 12.349 0.8954 167.265  22.071  167.817   32.216  166.777   30.298  12.334 1.3060 12.365 1.2251 -0.3131294E-01 1.790703  
1 1 1 15 19 8  o 7.4562 1.3056 69.383   19.895  93.915    29.287  48.361    27.111  8.7937 1.7268 6.1188 1.9587 2.674896       2.611263  
1 1 1 15 19 9  o 5.3287 1.3976 34.781   19.992  28.737    29.289  40.054    27.355  5.0492 1.9835 5.6082 1.9695 -0.5590248     2.795193  
1 1 1 15 19 10 o 3.5296 1.1542 -10.4253 19.260  -16.6201  28.399  -5.1497   26.208  3.4439 1.6179 3.6152 1.6464 -0.1713648     2.308343  
1 1 1 15 19 11 o 5.2834 1.3902 33.944   20.778  15.963    29.932  50.667    28.866  4.4693 1.9044 6.0975 2.0260 -1.628211      2.780486  
1 1 1 15 19 12 o 9.1808 1.3119 109.913  23.211  109.831   33.989  109.986   31.773  9.0869 1.9298 9.2747 1.7776 -0.1878595     2.623717  
1 1 1 15 19 13 o 4.3870 1.3506 18.581   22.158  24.133    32.497  13.757    30.290  4.5856 1.9698 4.1885 1.8483 0.3971391      2.701212  
1 1 1 15 19 14 f 4.6773 1.3768 28.057   21.161  39.603    32.515  19.573    27.871  5.0857 2.0587 4.2689 1.8288 0.8168302      2.753653  
1 1 1 15 19 15 o 8.0473 1.3990 100.378  22.677  85.020    33.607  113.216   30.727  7.0825 2.1688 9.0121 1.7679 -1.929566      2.798062  
1 1 1 15 19 16 o 3.6678 1.1966 6.2757   20.162  6.7353    31.811  5.9672    26.065  3.7651 1.7502 3.5704 1.6322 0.1946938      2.393157  
1 1 1 15 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 19 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 0  o 4.1071 1.7518 26.076   26.148  27.814    38.863  24.640    35.344  4.1993 2.5339 4.0149 2.4195 -0.000000      0.000000  
1 1 1 15 20 1  o 7.4094 1.3492 68.692   20.334  55.859    28.170  82.652    29.382  6.6162 1.9769 8.2026 1.8367 -1.586368      2.698453  
1 1 1 15 20 2  o 4.5416 1.2708 15.744   18.644  34.746    25.583  -5.7768   27.226  5.3745 1.9030 3.7088 1.6848 1.665667       2.541652  
1 1 1 15 20 3  o 8.4592 1.2502 87.245   20.479  97.328    29.443  77.796    28.504  9.0069 1.6967 7.9115 1.8367 1.095380       2.500496  
1 1 1 15 20 4  o 3.7383 1.1736 -2.6639  18.173  -18.0804  26.191  11.651    25.238  3.2868 1.5471 4.1898 1.7652 -0.9030490     2.347257  
1 1 1 15 20 5  o 6.2660 1.3364 47.641   19.996  78.519    29.421  21.134    27.259  7.8640 1.8933 4.6679 1.8866 3.196058       2.672816  
1 1 1 15 20 6  o 6.9737 1.3314 65.316   19.838  44.624    31.258  79.273    25.671  5.8317 2.0993 8.1156 1.6380 -2.283897      2.662764  
1 1 1 15 20 7  o 6.4496 1.4598 55.074   21.148  64.952    32.471  47.797    27.868  6.8731 2.1363 6.0261 1.9901 0.8469610      2.919659  
1 1 1 15 20 8  o 4.3308 1.2794 10.925   20.189  -15.2336  31.009  30.171    26.599  3.6249 1.6990 5.0366 1.9133 -1.411701      2.558753  
1 1 1 15 20 9  o 8.3666 1.3913 92.424   22.835  99.807    33.796  86.223    30.975  8.6564 1.9933 8.0767 1.9415 0.5797596      2.782546  
1 1 1 15 20 10 o 4.9461 1.3753 27.377   21.709  2.9870    32.163  47.789    29.423  4.0701 1.8419 5.8222 2.0427 -1.752028      2.750513  
1 1 1 15 20 11 o 4.6471 1.3443 18.243   21.321  50.929    32.269  -7.0836   28.405  5.7513 2.1234 3.5429 1.6492 2.208426       2.688570  
1 1 1 15 20 12 o 8.1607 1.4045 101.901  23.360  78.120    34.509  122.015   31.737  6.7980 2.2131 9.5234 1.7300 -2.725423      2.809021  
1 1 1 15 20 13 o 18.320 0.7916 383.256  28.923  423.573   42.172  347.452   39.742  19.280 1.0937 17.361 1.1446 1.919075       1.583101  
1 1 1 15 20 14 o 4.7127 1.3427 34.015   20.795  15.198    32.380  47.224    27.129  4.0709 1.8447 5.3544 1.9515 -1.283412      2.685374  
1 1 1 15 20 15 o 6.0803 1.3728 59.814   22.987  115.016   34.418  15.365    30.884  8.2432 2.0859 3.9174 1.7853 4.325835       2.745631  
1 1 1 15 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 20 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 0  o 4.1946 1.7907 29.429   27.507  25.458    38.478  33.580    39.339  4.0331 2.4753 4.3561 2.5882 -0.000000      0.000000  
1 1 1 15 21 1  o 6.6267 1.3952 57.798   19.943  51.791    27.861  64.109    28.560  6.2646 1.9836 6.9888 1.9626 -0.7242427     2.790383  
1 1 1 15 21 2  o 5.9574 1.3056 44.488   18.953  20.222    27.075  67.806    26.541  4.5953 1.8718 7.3195 1.8206 -2.724227      2.611174  
1 1 1 15 21 3  o 5.0872 1.3424 30.327   18.618  39.545    26.657  21.549    26.013  5.5574 1.9446 4.6171 1.8511 0.9403276      2.684784  
1 1 1 15 21 4  o 4.2428 1.2535 -3.3210  22.989  37.349    28.011  -87.2341  40.235  5.4219 1.9820 3.0637 1.5352 2.358188       2.506992  
1 1 1 15 21 5  o 6.0988 1.3704 47.126   19.567  69.664    29.446  29.304    26.185  7.2265 1.9791 4.9711 1.8959 2.255430       2.740735  
1 1 1 15 21 6  o 5.4633 1.4244 39.315   21.500  23.361    32.684  51.485    28.546  4.8009 2.0150 6.1256 2.0137 -1.324614      2.848740  
1 1 1 15 21 7  o 5.5670 1.3750 39.507   21.870  6.0160    32.424  67.463    29.624  4.1755 1.8729 6.9586 2.0136 -2.783171      2.749991  
1 1 1 15 21 8  o 5.5223 1.4037 42.685   20.817  26.375    31.719  55.026    27.591  4.7951 1.9967 6.2495 1.9734 -1.454405      2.807339  
1 1 1 15 21 9  o 4.2107 1.3131 14.779   21.723  8.4557    31.548  20.479    29.955  4.0411 1.8269 4.3804 1.8866 -0.3393154     2.626156  
1 1 1 15 21 10 o 4.9348 1.3532 27.789   21.281  64.427    31.848  -1.7680   28.605  6.2588 2.1283 3.6108 1.6719 2.648052       2.706413  
1 1 1 15 21 11 o 3.5984 1.1819 -6.7346  20.679  14.811    30.724  -24.5782  27.960  4.1399 1.8424 3.0569 1.4809 1.082959       2.363776  
1 1 1 15 21 12 o 4.8494 1.3686 33.287   20.864  58.321    31.457  13.623    27.879  5.7581 2.1010 3.9408 1.7543 1.817235       2.737143  
1 1 1 15 21 13 o 4.6373 1.3715 36.311   21.364  33.520    32.067  38.538    28.649  4.5206 1.9494 4.7541 1.9296 -0.2334995     2.742959  
1 1 1 15 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 21 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 0  o 3.1391 1.5072 -10.4226 29.144  -34.3911  41.588  12.707    40.853  2.6864 1.8992 3.5918 2.3410 -0.000000      0.000000  
1 1 1 15 22 1  o 6.8873 1.3219 66.041   21.701  26.142    31.820  100.738   29.673  4.8366 2.0057 8.9379 1.7224 -4.101258      2.643779  
1 1 1 15 22 2  o 6.4281 1.4256 58.426   20.759  48.347    29.974  67.716    28.778  5.8438 2.0608 7.0123 1.9703 -1.168437      2.851184  
1 1 1 15 22 3  o 4.0203 1.2601 5.5195   20.378  15.287    28.803  -4.2700   28.836  4.3316 1.8574 3.7091 1.7034 0.6224234      2.520227  
1 1 1 15 22 4  o 5.1068 1.3662 29.992   21.202  3.5562    29.897  56.742    30.073  3.9640 1.7865 6.2495 2.0675 -2.285472      2.732407  
1 1 1 15 22 5  o 3.3725 1.1279 -15.4692 20.098  -7.5144   29.263  -22.5716  27.651  3.5887 1.6716 3.1562 1.5147 0.4325202      2.255812  
1 1 1 15 22 6  o 4.9212 1.4193 34.864   22.148  29.375    31.289  40.377    31.355  4.6982 1.9717 5.1442 2.0422 -0.4460678     2.838674  
1 1 1 15 22 7  o 3.5748 1.1687 -23.5857 20.445  30.662    32.251  -60.0382  26.437  4.7113 1.9907 2.4382 1.2249 2.273031       2.337400  
1 1 1 15 22 8  o 5.0607 1.3200 28.333   22.559  -22.4343  33.369  71.065    30.615  3.3912 1.6367 6.7303 2.0715 -3.339055      2.640062  
1 1 1 15 22 9  o 3.2966 1.1177 -17.3556 20.977  -6.3453   31.331  -26.3020  28.242  3.5712 1.6844 3.0220 1.4696 0.5492129      2.235404  
1 1 1 15 22 10 o 4.6090 1.3822 32.116   22.153  29.194    33.824  34.311    29.316  4.5150 1.9739 4.7030 1.9353 -0.1879964     2.764403  
1 1 1 15 22 11 o 5.7197 1.4524 61.720   22.648  42.768    34.031  76.786    30.342  4.8212 2.0415 6.6182 2.0665 -1.796944      2.904813  
1 1 1 15 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 22 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 0  o 13.191 1.5164 225.416  35.911  220.067   54.980  229.396   47.425  12.676 2.4261 13.705 1.8197 -0.000000      0.000000  
1 1 1 15 23 1  o 5.2555 1.4474 43.724   21.940  41.656    32.647  45.428    29.628  5.1438 2.0696 5.3673 2.0240 -0.2235050     2.894817  
1 1 1 15 23 2  o 10.468 1.2175 146.094  24.778  138.501   35.867  153.026   34.271  9.9687 1.8676 10.967 1.5625 -0.9983864     2.435006  
1 1 1 15 23 3  o 4.8518 1.4043 32.477   22.101  20.095    30.847  45.538    31.681  4.3495 1.8937 5.3542 2.0742 -1.004714      2.808633  
1 1 1 15 23 4  o 4.1446 1.2349 -1.7058  20.514  49.216    30.599  -43.2771  27.648  5.5480 2.0638 2.7412 1.3568 2.806763       2.469858  
1 1 1 15 23 5  o 4.5448 1.3332 21.837   21.633  49.988    31.028  -4.7916   30.178  5.5092 2.0725 3.5804 1.6775 1.928862       2.666339  
1 1 1 15 23 6  o 6.9169 1.5001 79.389   22.734  85.201    32.944  74.105    31.411  7.1629 2.1373 6.6709 2.1055 0.4919586      3.000232  
1 1 1 15 23 7  o 11.252 1.0801 165.054  24.044  144.876   34.227  184.710   33.783  10.345 1.6543 12.159 1.3892 -1.813529      2.160233  
1 1 1 15 23 8  o 3.7494 1.2138 3.4816   21.481  -20.5084  30.785  26.246    29.988  3.1779 1.5429 4.3208 1.8742 -1.142891      2.427539  
1 1 1 15 23 9  o 4.0618 1.2901 20.384   21.842  15.112    35.091  23.719    27.907  3.9823 1.8467 4.1412 1.8021 -0.1588404     2.580294  
1 1 1 15 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 23 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 0  o 3.4120 1.5992 14.216   28.638  28.561    42.533  2.3201    38.733  3.7653 2.4296 3.0586 2.0801 -0.000000      0.000000  
1 1 1 15 24 1  f 3.2824 1.1111 -14.8209 20.750  -2.4412   30.168  -25.9371  28.587  3.5564 1.6697 3.0085 1.4665 0.5478837      2.222290  
1 1 1 15 24 2  o 10.853 1.1811 161.250  24.673  140.742   35.216  181.020   34.577  9.8174 1.8617 11.889 1.4541 -2.071772      2.362289  
1 1 1 15 24 3  o 4.0639 1.2880 16.612   21.926  6.4004    31.486  26.227    30.551  3.7825 1.7523 4.3452 1.8882 -0.5627549     2.576068  
1 1 1 15 24 4  o 4.0055 1.2605 16.554   20.336  27.641    30.274  7.4379    27.451  4.3508 1.8852 3.6601 1.6739 0.6907690      2.521051  
1 1 1 15 24 5  o 3.5084 1.1637 -2.7885  21.080  16.259    29.959  -21.4662  29.667  3.9401 1.7809 3.0766 1.4984 0.8634856      2.327370  
1 1 1 15 24 6  o 4.4247 1.3509 31.261   21.672  39.994    32.818  24.508    28.860  4.6843 1.9950 4.1650 1.8221 0.5192604      2.701813  
1 1 1 15 24 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 24 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 25 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 26 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 27 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 28 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 15 29 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 1  0  o 5.1213 1.5392 32.672   13.740  0.0000    0.0000  32.672    13.740  5.1213 1.5392 5.1213 1.5392 -0.000000      0.000000  
1 1 1 16 1  1  o 17.074 0.6674 282.122  19.229  317.035   41.013  272.284   21.770  17.684 1.1596 16.464 0.6611 1.220003       1.334814  
1 1 1 16 1  2  o 11.729 0.8509 150.708  15.650  121.630   33.769  158.662   17.662  10.894 1.5500 12.564 0.7029 -1.670372      1.701887  
1 1 1 16 1  3  o 5.9244 1.1062 38.394   12.015  27.568    26.739  41.133    13.449  5.4736 1.9447 6.3751 1.0548 -0.9015489     2.212359  
1 1 1 16 1  4  o 13.608 0.7230 176.300  16.710  209.317   35.716  167.048   18.907  14.333 1.2460 12.883 0.7338 1.450456       1.446000  
1 1 1 16 1  5  o 14.038 0.7837 212.586  17.718  180.349   37.404  221.911   20.118  13.231 1.4135 14.845 0.6776 -1.613914      1.567483  
1 1 1 16 1  6  o 16.313 0.6868 259.576  19.222  292.466   39.992  249.695   21.920  16.891 1.1838 15.734 0.6966 1.157701       1.373563  
1 1 1 16 1  7  f 7.0884 1.1034 47.706   12.739  67.185    28.990  43.044    14.182  7.7887 1.8820 6.3881 1.1524 1.400534       2.206814  
1 1 1 16 1  8  o 25.583 0.6646 657.806  29.021  687.406   59.734  648.661   33.203  25.823 1.1566 25.344 0.6551 0.4793701      1.329223  
1 1 1 16 1  9  o 8.5477 1.1127 82.725   14.474  75.482    32.803  84.477    16.130  8.0193 2.0403 9.0761 0.8886 -1.056811      2.225402  
1 1 1 16 1  10 o 8.7419 1.1400 93.774   14.754  67.277    33.476  100.161   16.436  7.5763 2.1238 9.9074 0.8295 -2.331094      2.280022  
1 1 1 16 1  11 o 9.1647 0.8129 88.395   14.822  97.125    20.803  79.392    21.125  9.6519 1.0776 8.6776 1.2172 0.9742270      1.625709  
1 1 1 16 1  12 o 10.138 0.7802 107.283  15.801  100.277   21.862  114.944   22.863  9.7868 1.1169 10.489 1.0898 -0.7025738     1.560488  
1 1 1 16 1  13 o 27.039 0.5809 753.109  31.396  785.119   44.482  721.331   44.320  27.628 0.8050 26.451 0.8378 1.176615       1.161860  
1 1 1 16 1  14 o 12.097 0.7369 154.806  17.674  171.878   24.536  136.396   25.480  12.841 0.9554 11.352 1.1222 1.489128       1.473805  
1 1 1 16 1  15 o 2.5360 0.8545 -19.8446 12.199  -10.9986  16.001  -32.1245  18.853  2.6759 1.2430 2.3960 1.1728 0.2799187      1.708970  
1 1 1 16 1  16 o 3.6675 1.0581 4.3204   12.932  -8.0864   17.250  20.241    19.540  2.8970 1.3256 4.4380 1.6496 -1.541075      2.116211  
1 1 1 16 1  17 o 16.205 0.6516 275.092  21.069  266.970   28.662  284.641   31.078  15.965 0.8976 16.445 0.9449 -0.4797735     1.303276  
1 1 1 16 1  18 o 5.4026 1.1865 34.307   14.284  39.056    19.950  29.311    20.462  5.7473 1.6494 5.0578 1.7060 0.6895351      2.372936  
1 1 1 16 1  19 o 5.9880 1.1821 42.699   14.819  36.145    20.801  49.452    21.116  5.5159 1.7091 6.4601 1.6334 -0.9441490     2.364104  
1 1 1 16 1  20 o 9.2957 0.9401 95.315   16.498  68.320    22.468  126.897   24.303  7.6965 1.5136 10.895 1.1153 -3.198405      1.880105  
1 1 1 16 1  21 o 3.4960 1.0750 0.9753   14.024  -2.4930   19.142  4.9938    20.604  3.2841 1.4583 3.7079 1.5800 -0.4237661     2.150078  
1 1 1 16 1  22 o 9.0021 1.0380 92.518   17.851  100.357   23.831  82.497    26.944  9.6268 1.2377 8.3775 1.6668 1.249321       2.076092  
1 1 1 16 1  23 o 6.2710 1.3094 48.125   17.462  48.824    22.922  47.159    26.957  6.3680 1.7471 6.1739 1.9508 0.1941214      2.618724  
1 1 1 16 1  24 o 9.8388 0.9856 109.593  19.242  111.122   25.856  107.694   28.806  9.9947 1.2935 9.6829 1.4875 0.3118305      1.971207  
1 1 1 16 1  25 o 5.7747 1.3526 44.707   18.097  45.180    23.508  44.018    28.353  5.8662 1.8168 5.6832 2.0043 0.1829638      2.705163  
1 1 1 16 1  26 o 12.453 0.9185 188.099  22.160  212.651   29.732  157.415   33.239  13.689 1.0860 11.217 1.4816 2.471239       1.836995  
1 1 1 16 1  27 o 8.1607 1.3122 97.687   20.706  98.362    26.938  96.712    32.371  8.5203 1.6403 7.8011 2.0485 0.7191114      2.624342  
1 1 1 16 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 1  33 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 2  0  o 4.4782 1.5626 30.070   17.420  21.331    25.489  37.729    23.861  3.8955 2.1805 5.0610 2.2388 -0.000000      0.000000  
1 1 1 16 2  1  o 10.587 0.7201 113.532  15.233  106.988   21.397  120.258   21.692  10.275 1.0412 10.900 0.9951 -0.6248407     1.440228  
1 1 1 16 2  2  o 21.928 0.5696 484.996  24.978  484.338   35.110  485.671   35.542  21.914 0.8011 21.942 0.8099 -0.2807426E-01 1.139149  
1 1 1 16 2  3  o 9.3964 0.7711 90.004   14.462  92.821    20.033  86.938    20.898  9.5564 1.0481 9.2363 1.1313 0.3200855      1.542211  
1 1 1 16 2  4  o 9.4560 0.9437 92.487   14.252  94.672    30.501  91.877    16.119  9.3839 1.6872 9.5281 0.8459 -0.1441936     1.887354  
1 1 1 16 2  5  o 4.0207 1.1508 8.3326   11.801  12.468    27.031  7.3588    13.117  4.6549 1.8796 3.3865 1.3283 1.268441       2.301589  
1 1 1 16 2  6  o 5.3319 1.1644 14.906   14.217  61.653    27.818  -1.6204   16.541  7.4625 1.8682 3.2014 1.3903 4.261136       2.328716  
1 1 1 16 2  7  o 20.888 0.6849 432.988  24.127  470.508   50.983  422.160   27.388  21.337 1.1947 20.439 0.6700 0.8976746      1.369748  
1 1 1 16 2  8  o 8.1885 0.9617 56.490   13.120  104.609   30.266  45.356    14.559  9.8661 1.5338 6.5109 1.1606 3.355187       1.923455  
1 1 1 16 2  9  o 14.127 0.7956 201.251  18.379  218.747   40.396  196.684   20.639  14.349 1.4076 13.904 0.7422 0.4449434      1.591253  
1 1 1 16 2  10 o 5.2010 1.2182 28.273   12.701  25.768    30.138  28.814    14.006  5.2797 2.0292 5.1222 1.3486 0.1574907      2.436449  
1 1 1 16 2  11 o 5.1195 1.2584 19.842   13.202  47.895    30.244  13.237    14.674  6.3906 2.0713 3.8484 1.4297 2.542182       2.516781  
1 1 1 16 2  12 o 7.1305 1.2185 48.122   14.234  83.126    33.335  40.317    15.741  8.2505 2.0333 6.0106 1.3433 2.239846       2.436918  
1 1 1 16 2  13 o 20.142 0.7316 424.419  24.727  424.848   51.307  424.289   28.221  19.899 1.2892 20.385 0.6922 -0.4863338     1.463294  
1 1 1 16 2  14 o 9.5580 1.0855 98.713   16.348  112.301   36.039  95.192    18.344  9.5880 1.9459 9.5280 0.9627 0.5998039E-01  2.170960  
1 1 1 16 2  15 f 8.3409 1.1198 65.286   15.498  115.708   34.337  52.386    17.367  9.8432 1.8109 6.8386 1.3176 3.004531       2.239510  
1 1 1 16 2  16 o 4.2115 1.1415 17.739   13.714  -13.0114  31.642  24.852    15.218  3.7717 1.7506 4.6512 1.4653 -0.8795660     2.282918  
1 1 1 16 2  17 o 5.4834 1.1792 39.336   14.670  13.446    31.062  46.768    16.643  4.5537 1.9402 6.4131 1.3408 -1.859378      2.358351  
1 1 1 16 2  18 o 4.2122 1.2001 -8.8044  14.204  46.392    31.694  -22.6770  15.889  6.1014 2.1213 2.3230 1.1232 3.778442       2.400249  
1 1 1 16 2  19 o 8.4689 1.2063 80.346   16.591  93.829    36.416  76.814    18.638  8.4674 2.1472 8.4703 1.1002 -0.2826691E-02 2.412686  
1 1 1 16 2  20 o 6.4688 1.3575 39.759   15.582  77.141    36.442  31.396    17.237  7.7109 2.2339 5.2267 1.5428 2.484296       2.714900  
1 1 1 16 2  21 o 3.6320 1.1829 -17.7999 19.149  6.2576    31.816  -31.4644  23.978  4.4027 1.9199 2.8613 1.3825 1.541376       2.365893  
1 1 1 16 2  22 o 8.5294 1.0529 82.613   17.365  82.814    23.052  82.349    26.403  8.6823 1.3275 8.3764 1.6347 0.3059063      2.105865  
1 1 1 16 2  23 o 5.0657 1.0055 22.941   15.626  61.115    20.434  -30.8178  24.249  7.2653 1.4570 2.8661 1.3862 4.399248       2.011025  
1 1 1 16 2  24 o 4.3889 1.2375 18.608   16.004  18.613    20.177  18.599    26.279  4.2840 1.6565 4.4938 1.8388 -0.2098575     2.474934  
1 1 1 16 2  25 o 11.641 0.9437 153.829  21.634  144.650   27.969  167.502   34.135  11.323 1.2350 11.959 1.4272 -0.6359673     1.887327  
1 1 1 16 2  26 o 4.9698 1.3560 34.285   18.484  28.502    23.118  44.531    30.774  4.6130 1.7761 5.3266 2.0496 -0.7136521     2.712096  
1 1 1 16 2  27 o 6.5976 1.3971 68.900   19.744  55.239    25.490  89.386    31.215  5.8384 1.9021 7.3568 2.0468 -1.518435      2.794146  
1 1 1 16 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 3  0  o 2.7953 1.2506 -6.0146  16.523  17.463    23.701  -28.2132  23.047  3.5994 2.0666 1.9911 1.4089 -0.000000      0.000000  
1 1 1 16 3  1  o 3.6013 1.0452 3.6285   12.383  -4.2229   17.314  11.850    17.717  3.1681 1.3978 4.0345 1.5544 -0.8663378     2.090450  
1 1 1 16 3  2  o 13.620 0.6431 188.627  17.439  210.737   24.817  167.059   24.511  14.420 0.8605 12.819 0.9560 1.600960       1.286247  
1 1 1 16 3  3  o 13.890 0.6474 195.689  17.969  184.623   24.897  207.720   25.961  13.479 0.9235 14.301 0.9076 -0.8221874     1.294882  
1 1 1 16 3  4  o 9.5877 0.7853 94.006   15.037  87.182    20.903  101.325   21.648  9.2230 1.1332 9.9525 1.0876 -0.7295475     1.570679  
1 1 1 16 3  5  o 6.1362 1.0823 40.777   13.351  32.957    18.566  49.152    19.212  5.5277 1.5925 6.7447 1.4661 -1.217005      2.164609  
1 1 1 16 3  6  o 4.9217 1.1322 25.366   12.789  27.246    18.192  23.529    17.982  5.0601 1.6029 4.7833 1.5993 0.2767529      2.264333  
1 1 1 16 3  7  o 5.4225 1.3273 30.084   15.848  32.392    32.403  29.359    18.170  5.6706 2.1209 5.1744 1.5964 0.4962907      2.654594  
1 1 1 16 3  8  o 5.8126 1.2329 33.671   13.002  45.184    29.910  30.989    14.437  6.3089 2.0607 5.3164 1.3541 0.9924741      2.465726  
1 1 1 16 3  9  o 4.8890 1.1548 26.702   12.954  4.2031    29.700  31.988    14.395  4.3767 1.8817 5.4014 1.3392 -1.024699      2.309608  
1 1 1 16 3  10 f 13.887 0.7780 185.065  18.200  234.185   39.711  172.003   20.477  14.810 1.3407 12.964 0.7898 1.846319       1.556039  
1 1 1 16 3  11 o 11.640 0.9312 146.981  17.034  142.357   37.976  148.145   19.059  11.269 1.6849 12.012 0.7933 -0.7422075     1.862347  
1 1 1 16 3  12 o 6.2484 1.1935 46.055   13.559  36.871    31.957  48.071    14.973  5.7414 2.1142 6.7554 1.1082 -1.014001      2.387054  
1 1 1 16 3  13 o 11.153 1.0452 144.832  17.854  125.989   37.813  150.238   20.254  10.254 1.9141 12.052 0.8403 -1.797266      2.090444  
1 1 1 16 3  14 f 5.2075 1.2791 17.859   14.017  62.582    32.393  7.5550    15.548  6.9415 2.1299 3.4734 1.4171 3.468022       2.558210  
1 1 1 16 3  15 o 3.6453 1.0853 6.2312   13.619  -27.4443  30.105  14.897    15.271  3.3729 1.6083 3.9176 1.4579 -0.5446415     2.170695  
1 1 1 16 3  16 o 3.5644 1.1375 -5.0977  13.273  12.918    30.845  -9.1914   14.704  4.5279 1.9313 2.6009 1.2023 1.926996       2.275002  
1 1 1 16 3  17 f 3.7125 1.1313 6.0116   13.711  -20.0609  33.096  11.413    15.064  3.7401 1.7537 3.6849 1.4295 0.5528641E-01  2.262533  
1 1 1 16 3  18 o 6.7636 1.1858 61.806   15.532  31.664    33.059  70.345    17.595  5.3933 2.1106 8.1340 1.0816 -2.740625      2.371584  
1 1 1 16 3  19 f 15.328 0.8403 249.240  21.534  262.515   45.209  245.345   24.491  15.270 1.4803 15.386 0.7959 -0.1159906     1.680663  
1 1 1 16 3  20 o 4.1274 1.2456 -7.1192  14.693  37.804    34.789  -16.8719  16.209  5.7360 2.1859 2.5189 1.1950 3.217094       2.491233  
1 1 1 16 3  21 o 14.576 0.9122 232.629  22.242  226.867   45.636  234.424   25.472  14.123 1.6156 15.030 0.8474 -0.9063635     1.824373  
1 1 1 16 3  22 o 4.9388 1.3361 25.007   16.514  18.622    36.796  26.617    18.479  5.0203 2.1242 4.8572 1.6213 0.1630750      2.672203  
1 1 1 16 3  23 o 9.4212 1.3215 108.641  19.812  112.035   43.491  107.752   22.255  8.8600 2.3965 9.9825 1.1147 -1.122507      2.643065  
1 1 1 16 3  24 f 8.2953 1.3396 84.438   18.762  95.761    40.910  81.422    21.114  8.0289 2.3786 8.5618 1.2330 -0.5329533     2.679185  
1 1 1 16 3  25 o 4.2784 1.3311 8.0701   17.175  41.811    40.385  0.6200    18.977  5.3174 2.2362 3.2394 1.4443 2.078020       2.662122  
1 1 1 16 3  26 o 4.5041 1.3453 25.703   18.525  22.639    44.566  26.343    20.368  4.5627 2.1035 4.4455 1.6777 0.1171718      2.690660  
1 1 1 16 3  27 o 5.9047 1.4269 63.871   19.991  68.338    45.994  62.830    22.198  5.2682 2.3025 6.5412 1.6861 -1.273010      2.853866  
1 1 1 16 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 4  0  o 3.9211 1.4955 19.344   18.307  0.6257    26.431  36.602    25.380  2.9510 1.9083 4.8912 2.3031 -0.000000      0.000000  
1 1 1 16 4  1  o 13.112 0.6726 174.971  17.636  174.379   25.054  175.553   24.829  13.088 0.9571 13.135 0.9451 -0.4687786E-01 1.345115  
1 1 1 16 4  2  o 9.0506 0.8290 84.280   14.957  92.615    21.264  76.118    21.042  9.5050 1.1186 8.5963 1.2239 0.9087667      1.658053  
1 1 1 16 4  3  o 2.7413 0.8961 -13.5422 11.715  -6.6584   16.402  -20.7116  16.739  2.9618 1.3300 2.5209 1.2012 0.4409025      1.792189  
1 1 1 16 4  4  o 9.4567 0.8186 91.643   15.380  78.219    20.811  107.798   22.831  8.6893 1.1975 10.224 1.1165 -1.534706      1.637281  
1 1 1 16 4  5  o 7.5006 0.9756 60.310   14.293  53.316    19.879  67.794    20.563  6.9634 1.4734 8.0379 1.2792 -1.074553      1.951180  
1 1 1 16 4  6  o 6.8395 1.0625 52.478   14.191  42.492    20.368  61.897    19.782  6.1388 1.6312 7.5402 1.3619 -1.401324      2.124962  
1 1 1 16 4  7  o 13.197 0.8894 185.397  21.395  173.853   38.489  190.559   25.737  12.766 1.5074 13.627 0.9444 -0.8608332     1.778821  
1 1 1 16 4  8  o 5.8477 1.1241 38.086   13.684  29.608    18.998  47.226    19.726  5.1957 1.6372 6.4997 1.5409 -1.303998      2.248288  
1 1 1 16 4  9  o 4.9819 1.1501 27.070   13.138  27.339    17.667  26.738    19.653  4.9868 1.5796 4.9770 1.6719 0.9792328E-02  2.300120  
1 1 1 16 4  10 f 2.7259 0.9118 -12.6800 11.634  -61.1700  29.399  -3.6770   12.668  2.8050 1.3903 2.6467 1.1801 0.1583471      1.823573  
1 1 1 16 4  11 o 6.9380 1.1582 66.504   14.668  27.125    33.382  75.926    16.329  5.3309 2.1101 8.5451 0.9555 -3.214168      2.316301  
1 1 1 16 4  12 o 9.8420 1.2050 139.021  17.186  67.657    36.867  158.835   19.426  7.2557 2.2798 12.428 0.7815 -5.172612      2.410061  
1 1 1 16 4  13 o 4.9259 1.2936 22.186   13.989  37.602    32.457  18.668    15.503  5.6454 2.1205 4.2063 1.4822 1.439082       2.587190  
1 1 1 16 4  14 o 7.4111 1.2338 67.076   15.513  59.808    34.716  68.889    17.340  6.7675 2.2205 8.0548 1.0764 -1.287313      2.467654  
1 1 1 16 4  15 o 6.9953 1.2881 53.637   15.071  74.220    35.430  49.089    16.653  7.4050 2.2181 6.5856 1.3104 0.8193831      2.576259  
1 1 1 16 4  16 o 6.5759 1.2932 43.826   14.954  75.888    33.494  35.845    16.712  7.6099 2.1212 5.5420 1.4799 2.067890       2.586442  
1 1 1 16 4  17 o 8.2267 1.2398 97.977   17.173  47.264    37.958  111.029   19.257  6.1516 2.2966 10.302 0.9346 -4.150216      2.479506  
1 1 1 16 4  18 o 7.4125 1.1602 82.175   16.614  25.492    34.544  99.231    18.949  5.1293 2.1046 9.6957 0.9772 -4.566404      2.320441  
1 1 1 16 4  19 o 18.549 0.7784 362.286  24.383  370.192   50.275  359.854   27.881  18.390 1.3669 18.709 0.7451 -0.3184891     1.556803  
1 1 1 16 4  20 o 9.9424 1.2772 157.316  19.312  55.623    42.047  184.503   21.741  6.5303 2.4213 13.355 0.8140 -6.824381      2.554413  
1 1 1 16 4  21 o 10.948 1.1876 149.423  19.448  119.692   41.335  157.876   22.039  9.6031 2.1995 12.293 0.8964 -2.690012      2.375114  
1 1 1 16 4  22 o 4.1019 1.2585 7.9739   15.525  5.6438    37.236  8.4642    17.081  4.5814 2.0341 3.6224 1.4824 0.9590189      2.516973  
1 1 1 16 4  23 o 3.2144 1.0858 -12.5292 15.417  -43.7108  39.224  -6.8313   16.767  3.5620 1.7321 2.8668 1.3100 0.6952186      2.171697  
1 1 1 16 4  24 o 6.6526 1.4870 45.296   18.508  107.670   43.091  31.186    20.495  8.3138 2.4352 4.9913 1.7072 3.322537       2.973995  
1 1 1 16 4  25 o 10.331 1.4144 155.219  22.838  151.734   49.503  156.161   25.741  8.9503 2.6068 11.713 1.0989 -2.762297      2.828890  
1 1 1 16 4  26 o 3.4153 1.1966 -42.2389 16.140  46.846    42.979  -56.8643  17.415  5.0302 2.2114 1.8004 0.9146 3.229804       2.393123  
1 1 1 16 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 4  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 5  0  o 16.712 0.8931 290.095  29.443  285.783   42.110  294.219   41.183  16.576 1.2881 16.848 1.2376 -0.000000      0.000000  
1 1 1 16 5  1  o 4.0565 1.1005 11.953   12.773  19.566    18.554  5.0953    17.609  4.5162 1.6183 3.5968 1.4918 0.9194670      2.201024  
1 1 1 16 5  2  o 5.9973 1.1110 39.906   13.891  52.797    19.744  27.272    19.546  6.9313 1.4698 5.0633 1.6664 1.868087       2.221996  
1 1 1 16 5  3  o 11.010 0.7366 125.698  16.187  130.268   22.502  120.795   23.303  11.231 1.0017 10.788 1.0801 0.4437952      1.473116  
1 1 1 16 5  4  o 4.6431 0.9352 18.929   12.039  44.840    16.327  -11.9414  17.821  6.4098 1.3176 2.8764 1.3275 3.533458       1.870416  
1 1 1 16 5  5  o 4.6922 1.1552 22.300   13.293  22.211    18.643  22.392    18.960  4.6806 1.6269 4.7038 1.6404 -0.2317142E-01 2.310330  
1 1 1 16 5  6  o 7.5850 0.9715 62.272   14.195  61.845    20.069  62.700    20.082  7.5565 1.3787 7.6136 1.3692 -0.5710793E-01 1.943067  
1 1 1 16 5  7  o 4.4908 1.1198 18.442   13.054  30.671    19.270  8.0699    17.746  5.2528 1.6479 3.7288 1.5167 1.524015       2.239665  
1 1 1 16 5  8  o 12.326 0.7230 157.999  17.647  186.942   25.408  131.027   24.527  13.452 0.9444 11.201 1.0949 2.251577       1.445929  
1 1 1 16 5  9  o 5.0798 1.0709 25.604   13.803  1.7130    19.438  49.905    19.605  3.5217 1.5182 6.6379 1.5107 -3.116163      2.141779  
1 1 1 16 5  10 o 9.5901 1.1844 101.278  19.180  98.100    22.136  110.852   38.420  9.6309 1.1492 9.5493 2.0713 0.8157063E-01  2.368738  
1 1 1 16 5  11 o 7.2468 1.0655 59.522   14.936  61.847    21.462  57.339    20.799  7.3891 1.5034 7.1045 1.5103 0.2845984      2.131051  
1 1 1 16 5  12 o 5.2325 1.2394 28.296   12.960  39.342    29.305  25.611    14.450  5.7149 2.0353 4.7500 1.4151 0.9648962      2.478891  
1 1 1 16 5  13 o 3.1343 1.0125 -4.8265  12.831  -47.6772  32.132  3.3025    13.995  3.1542 1.5412 3.1144 1.3134 0.3978872E-01  2.024986  
1 1 1 16 5  14 f 7.6870 1.1710 68.319   15.399  73.476    31.805  66.741    17.599  7.5000 2.0581 7.8740 1.1175 -0.3740244     2.341935  
1 1 1 16 5  15 o 4.8011 1.1822 27.625   14.232  -0.4372   32.811  34.128    15.795  4.1824 1.8795 5.4198 1.4347 -1.237385      2.364475  
1 1 1 16 5  16 o 5.7890 1.2871 39.333   15.045  38.616    32.343  39.531    16.996  5.7160 2.1227 5.8619 1.4562 -0.1458912     2.574191  
1 1 1 16 5  17 o 4.4259 1.2683 15.162   14.294  20.819    33.818  13.931    15.772  4.9677 2.0645 3.8842 1.4738 1.083428       2.536614  
1 1 1 16 5  18 o 5.8902 1.2558 44.709   15.581  26.886    33.954  49.464    17.537  5.1864 2.1023 6.5940 1.3743 -1.407595      2.511633  
1 1 1 16 5  19 o 9.6916 1.0158 98.870   19.690  0.0000    0.0000  98.870    19.690  ?      ?      9.6916 1.0158 ?              ?         
1 1 1 16 5  20 o 15.484 0.8952 264.529  22.183  250.122   47.875  268.468   25.033  14.836 1.6135 16.133 0.7759 -1.296927      1.790371  
1 1 1 16 5  21 o 7.4315 1.1445 86.609   17.252  9.6144    37.507  107.268   19.429  4.7502 2.0776 10.113 0.9606 -5.362576      2.288956  
1 1 1 16 5  22 o 11.501 1.0357 125.062  19.505  202.442   45.959  108.063   21.541  12.974 1.7711 10.028 1.0740 2.946000       2.071305  
1 1 1 16 5  23 f 4.3704 1.2977 15.276   15.971  16.522    37.732  15.005    17.628  4.7738 2.0860 3.9671 1.5443 0.8066435      2.595444  
1 1 1 16 5  24 o 4.8714 1.2927 -16.2426 15.211  93.754    40.091  -34.7391  16.440  7.6721 2.3720 2.0707 1.0286 5.601369       2.585446  
1 1 1 16 5  25 o 3.5174 1.1501 1.8745   16.093  -25.6269  42.015  6.6030    17.422  3.6896 1.7938 3.3452 1.4397 0.3444262      2.300144  
1 1 1 16 5  26 o 2.8562 0.9936 -17.9724 15.871  -48.0257  39.328  -12.1263  17.346  3.1396 1.5647 2.5728 1.2251 0.5668378      1.987222  
1 1 1 16 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 5  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 6  0  o 5.0058 1.6425 38.919   19.941  22.586    29.099  53.381    27.382  3.9483 2.2798 6.0633 2.3652 -0.000000      0.000000  
1 1 1 16 6  1  o 2.6491 0.8670 -20.3194 11.492  0.5472    16.989  -37.9210  15.603  3.3040 1.4219 1.9941 0.9924 1.309908       1.733988  
1 1 1 16 6  2  o 12.600 0.6834 163.339  17.210  166.057   24.028  160.476   24.662  12.715 0.9448 12.485 0.9877 0.2307653      1.366847  
1 1 1 16 6  3  o 8.1154 0.9437 69.957   14.962  63.820    20.731  76.629    21.617  7.6719 1.4028 8.5589 1.2628 -0.8869166     1.887448  
1 1 1 16 6  4  o 5.5435 1.1277 34.030   13.207  36.649    18.491  31.303    18.869  5.7456 1.5662 5.3414 1.6229 0.4041882      2.255431  
1 1 1 16 6  5  o 9.7565 0.8222 100.076  15.925  85.972    22.361  114.592   22.686  9.0265 1.2386 10.486 1.0817 -1.459976      1.644483  
1 1 1 16 6  6  o 8.6146 0.9215 80.835   15.230  66.931    21.901  93.855    21.194  7.7669 1.4636 9.4623 1.1199 -1.695366      1.842909  
1 1 1 16 6  7  o 5.5871 1.1090 34.758   13.629  49.464    19.287  20.090    19.261  6.6489 1.4876 4.5253 1.6451 2.123598       2.217947  
1 1 1 16 6  8  o 9.8791 0.8285 103.391  16.288  117.304   23.504  90.534    22.593  10.545 1.1145 9.2134 1.2261 1.331388       1.656903  
1 1 1 16 6  9  o 10.451 0.8099 115.130  16.793  135.578   24.437  96.833    23.116  11.362 1.0754 9.5408 1.2114 1.820950       1.619886  
1 1 1 16 6  10 o 3.7780 1.1638 3.2318   15.318  -8.3519   30.272  7.2185    17.759  3.9097 1.7763 3.6464 1.5041 0.2632866      2.327550  
1 1 1 16 6  11 o 9.0993 0.8896 89.787   16.186  92.528    23.132  87.158    22.657  9.2388 1.2519 8.9597 1.2644 0.2790651      1.779283  
1 1 1 16 6  12 o 4.5627 1.1677 21.439   14.178  12.031    20.580  29.936    19.559  4.0344 1.6362 5.0910 1.6666 -1.056593      2.335494  
1 1 1 16 6  13 o 5.7313 1.1472 39.733   15.058  19.097    22.072  57.702    20.596  4.4332 1.7274 7.0293 1.5100 -2.596100      2.294382  
1 1 1 16 6  14 o 7.0868 1.1142 58.364   15.933  78.341    23.253  40.685    21.874  8.3898 1.3858 5.7839 1.7452 2.605902       2.228498  
1 1 1 16 6  15 o 5.8846 1.2824 42.674   15.077  32.318    35.534  44.947    16.650  5.4718 2.1735 6.2973 1.3617 -0.8255610     2.564771  
1 1 1 16 6  16 o 4.9890 1.2910 16.166   14.231  54.175    32.599  7.2174    15.818  6.4985 2.1527 3.4795 1.4255 3.019068       2.581906  
1 1 1 16 6  17 o 10.590 1.2173 146.243  18.567  107.560   40.907  156.280   20.837  8.9364 2.2810 12.243 0.8510 -3.306488      2.434594  
1 1 1 16 6  18 o 4.6540 1.1933 23.505   14.921  -9.6454   33.533  31.688    16.661  4.0482 1.8509 5.2597 1.5066 -1.211466      2.386585  
1 1 1 16 6  19 o 5.6700 1.2647 41.174   15.970  14.112    36.979  47.378    17.706  4.8831 2.0995 6.4570 1.4105 -1.573949      2.529359  
1 1 1 16 6  20 o 9.5471 1.2518 118.275  17.890  90.190    39.901  125.341   20.014  8.1512 2.3306 10.943 0.9145 -2.791808      2.503545  
1 1 1 16 6  21 o 10.809 1.2736 155.557  19.461  110.800   43.873  166.521   21.714  8.9773 2.3981 12.641 0.8589 -3.664080      2.547250  
1 1 1 16 6  22 o 5.8283 1.4018 28.216   15.944  81.830    38.767  17.302    17.491  7.5365 2.3329 4.1201 1.5548 3.416452       2.803556  
1 1 1 16 6  23 o 12.042 1.1591 178.198  20.776  166.397   45.454  181.315   23.360  11.024 2.1387 13.060 0.8943 -2.036147      2.318187  
1 1 1 16 6  24 o 3.8287 1.2728 -15.0883 15.831  51.340    43.088  -25.4543  17.021  5.3832 2.2891 2.2742 1.1134 3.109020       2.545528  
1 1 1 16 6  25 o 3.2357 1.1067 -10.0273 14.923  2.3562    38.133  -12.2669  16.217  3.9582 1.8643 2.5133 1.1932 1.444894       2.213458  
1 1 1 16 6  26 o 4.0139 1.2477 19.744   16.516  15.706    44.888  20.376    17.762  4.1119 1.9615 3.9159 1.5426 0.1960464      2.495412  
1 1 1 16 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 7  0  o 6.5193 1.6496 61.242   21.083  42.786    30.288  78.590    29.365  5.1338 2.5034 7.9047 2.1488 -0.000000      0.000000  
1 1 1 16 7  1  o 3.3148 1.0290 -2.0102  13.122  -0.7689   18.559  -3.2511   18.557  3.3671 1.4674 3.2626 1.4429 0.1044888      2.057913  
1 1 1 16 7  2  o 9.6948 0.8336 98.857   16.156  95.156    22.515  102.784   23.196  9.5057 1.1843 9.8839 1.1734 -0.3782158     1.667167  
1 1 1 16 7  3  o 11.073 0.7487 127.264  16.529  114.965   22.502  141.674   24.358  10.489 1.0726 11.657 1.0447 -1.167758      1.497323  
1 1 1 16 7  4  o 8.4288 0.9002 75.525   15.122  69.146    21.488  81.784    21.286  8.0515 1.3344 8.8060 1.2086 -0.7545271     1.800395  
1 1 1 16 7  5  o 15.334 0.6526 242.594  20.010  239.939   27.943  245.389   28.667  15.252 0.9161 15.417 0.9297 -0.1651411     1.305230  
1 1 1 16 7  6  o 3.3202 1.0230 -0.2317  12.744  0.8276    17.420  -1.4516   18.693  3.3168 1.4335 3.3237 1.4599 -0.6909132E-02 2.046038  
1 1 1 16 7  7  o 4.7984 1.1474 24.134   13.684  13.254    19.410  34.885    19.295  4.0854 1.6116 5.5114 1.6337 -1.425918      2.294779  
1 1 1 16 7  8  o 10.426 0.8125 114.971  16.935  110.929   23.836  119.090   24.065  10.233 1.1646 10.619 1.1331 -0.3856421     1.624900  
1 1 1 16 7  9  o 16.107 0.6515 270.003  20.983  262.667   29.668  277.345   29.680  15.879 0.9342 16.334 0.9085 -0.4553833     1.303100  
1 1 1 16 7  10 o 3.8400 1.1118 9.6032   13.584  12.322    19.932  7.2456    18.561  4.0119 1.6161 3.6682 1.5274 0.3436663      2.223691  
1 1 1 16 7  11 o 11.891 0.7903 152.931  18.366  118.996   26.170  185.865   25.781  10.480 1.2486 13.303 0.9690 -2.823016      1.580505  
1 1 1 16 7  12 o 4.0694 1.0719 10.394   14.072  -16.6277  21.194  31.695    18.818  2.9619 1.3935 5.1768 1.6292 -2.214835      2.143814  
1 1 1 16 7  13 o 3.8733 1.1763 1.6747   18.180  19.261    20.793  -55.3932  37.457  4.4047 1.6872 3.3419 1.6394 1.062745       2.352541  
1 1 1 16 7  14 o 10.382 0.8802 117.414  18.207  109.794   26.225  124.504   25.298  10.012 1.3096 10.753 1.1764 -0.7403297     1.760381  
1 1 1 16 7  15 o 4.8270 1.2316 25.364   15.237  26.991    21.757  23.799    21.344  4.9289 1.7539 4.7251 1.7297 0.2038326      2.463298  
1 1 1 16 7  16 f 4.0010 1.1568 10.904   14.857  4.7914    20.787  17.286    21.241  3.6844 1.5789 4.3175 1.6912 -0.6331697     2.313660  
1 1 1 16 7  17 o 5.2677 1.3313 30.603   15.213  26.339    37.855  31.425    16.613  5.3167 2.1948 5.2188 1.5073 0.9788752E-01  2.662548  
1 1 1 16 7  18 o 9.5245 1.2199 110.839  17.606  96.559    39.130  114.464   19.714  8.5909 2.2505 10.458 0.9425 -1.867207      2.439895  
1 1 1 16 7  19 o 11.714 1.0390 144.985  19.435  167.113   44.061  139.639   21.656  11.880 1.8544 11.548 0.9376 0.3318825      2.077950  
1 1 1 16 7  20 o 6.8535 1.2736 62.303   17.226  35.740    37.670  69.326    19.370  5.6789 2.2435 8.0281 1.2064 -2.349198      2.547266  
1 1 1 16 7  21 o 7.8913 1.3010 92.380   18.207  48.454    42.978  101.987   20.099  6.0150 2.3900 9.7677 1.0289 -3.752613      2.602026  
1 1 1 16 7  22 o 5.6376 1.2519 44.753   16.978  5.1268    39.979  53.473    18.753  4.5325 2.0521 6.7428 1.4347 -2.210292      2.503897  
1 1 1 16 7  23 o 10.809 1.3806 167.000  20.998  132.285   49.273  174.704   23.212  8.8518 2.6072 12.767 0.9091 -3.914971      2.761136  
1 1 1 16 7  24 o 3.7208 1.1796 8.1744   15.788  -11.1782  39.572  11.838    17.218  3.8420 1.8352 3.5996 1.4825 0.2423725      2.359190  
1 1 1 16 7  25 o 4.8456 1.3152 36.993   16.824  29.599    45.535  38.162    18.106  4.5037 2.0936 5.1876 1.5924 -0.6839061     2.630418  
1 1 1 16 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 7  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 8  0  o 4.3629 1.5258 23.403   19.491  -2.9344   26.815  52.905    28.381  2.7993 1.8490 5.9265 2.4275 -0.000000      0.000000  
1 1 1 16 8  1  o 9.2823 0.8511 90.759   15.776  84.188    21.865  97.895    22.785  8.9237 1.2251 9.6409 1.1817 -0.7172403     1.702165  
1 1 1 16 8  2  o 7.3309 1.0542 59.799   15.167  68.451    21.215  50.751    21.693  8.0018 1.3256 6.6600 1.6396 1.341814       2.108451  
1 1 1 16 8  3  o 3.8658 1.0493 5.7213   13.263  26.225    18.513  -15.8979  19.010  4.8903 1.6224 2.8413 1.3313 2.049045       2.098652  
1 1 1 16 8  4  o 10.569 0.7798 117.661  16.428  105.457   22.871  130.670   23.614  9.9818 1.1456 11.156 1.0583 -1.174630      1.559627  
1 1 1 16 8  5  o 3.7097 1.0867 7.0399   13.196  5.9634    18.623  8.1257    18.702  3.6520 1.5261 3.7673 1.5475 -0.1153033     2.173410  
1 1 1 16 8  6  o 8.7700 0.9133 82.487   16.014  79.603    22.488  85.454    22.810  8.6078 1.3062 8.9323 1.2768 -0.3244801     1.826639  
1 1 1 16 8  7  o 4.2427 1.1415 15.733   13.769  7.5738    19.960  23.141    19.018  3.8169 1.5862 4.6684 1.6421 -0.8514917     2.283049  
1 1 1 16 8  8  o 7.5345 1.0708 65.165   15.568  69.849    21.847  60.332    22.191  7.8595 1.4430 7.2094 1.5824 0.6501336      2.141580  
1 1 1 16 8  9  o 3.7985 1.0962 9.6004   13.269  4.9580    19.671  13.476    17.974  3.6298 1.5452 3.9673 1.5552 -0.3374691     2.192330  
1 1 1 16 8  10 o 6.9404 1.1345 56.647   15.452  51.802    22.280  61.138    21.449  6.5984 1.6830 7.2824 1.5217 -0.6840196     2.268912  
1 1 1 16 8  11 o 3.6545 1.0616 1.2106   13.818  22.576    20.186  -17.6296  18.955  4.5701 1.6807 2.7388 1.2973 1.831326       2.123145  
1 1 1 16 8  12 o 17.258 0.6615 312.778  22.791  319.153   33.389  307.217   31.185  17.400 0.9594 17.115 0.9111 0.2852364      1.323081  
1 1 1 16 8  13 o 3.6749 1.1918 -9.4849  16.533  7.7924    34.228  -14.7426  18.882  4.5233 1.9814 2.8265 1.3251 1.696820       2.383654  
1 1 1 16 8  14 f 5.6724 1.0618 32.033   15.378  71.297    22.488  -2.4546   21.075  7.9108 1.4756 3.4341 1.5272 4.476662       2.123663  
1 1 1 16 8  15 o 8.3591 1.0977 81.169   17.755  70.801    26.053  90.160    24.262  7.6715 1.7383 9.0467 1.3410 -1.375269      2.195375  
1 1 1 16 8  16 o 13.636 0.7649 198.086  20.825  184.833   29.330  211.563   29.575  13.150 1.1152 14.123 1.0471 -0.9727449     1.529716  
1 1 1 16 8  17 o 5.9536 1.2624 41.205   16.439  54.785    24.763  30.506    21.981  6.7390 1.8023 5.1683 1.7681 1.570726       2.524741  
1 1 1 16 8  18 o 4.6985 1.2568 22.327   16.320  17.235    24.155  26.604    22.137  4.4764 1.7876 4.9206 1.7672 -0.4442601     2.513638  
1 1 1 16 8  19 o 5.3070 1.3453 26.122   14.536  49.103    35.251  21.414    15.955  6.1945 2.2294 4.4195 1.5064 1.774965       2.690639  
1 1 1 16 8  20 o 8.2947 1.2060 74.955   20.006  0.0000    0.0000  74.955    20.006  ?      ?      8.2947 1.2060 ?              ?         
1 1 1 16 8  21 o 7.0226 1.3942 55.149   16.967  85.537    39.482  48.266    18.791  7.6749 2.3508 6.3704 1.4997 1.304503       2.788459  
1 1 1 16 8  22 o 3.9791 1.2330 9.9950   15.353  -5.0097   40.571  12.503    16.586  4.2303 1.9698 3.7279 1.4836 0.5023403      2.465972  
1 1 1 16 8  23 o 8.9634 1.3288 101.543  18.631  135.468   43.665  93.992    20.600  8.8743 2.4017 9.0525 1.1378 -0.1781483     2.657546  
1 1 1 16 8  24 o 3.7065 1.2361 0.7569   14.758  28.756    44.458  -2.7105   15.645  4.6243 2.1205 2.7887 1.2708 1.835670       2.472142  
1 1 1 16 8  25 o 4.1601 1.2940 19.535   16.145  44.162    41.587  15.165    17.519  4.6981 2.1131 3.6221 1.4940 1.076026       2.587906  
1 1 1 16 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 9  0  o 9.2786 1.4893 108.719  23.508  70.297    33.043  148.095   33.451  6.9252 2.5688 11.632 1.5078 -0.000000      0.000000  
1 1 1 16 9  1  o 3.4639 1.0531 -1.4814  13.839  -14.6990  19.689  11.426    19.456  2.9361 1.3688 3.9917 1.6007 -1.055551      2.106149  
1 1 1 16 9  2  o 11.581 0.7884 143.564  17.767  107.671   25.198  179.052   25.056  10.038 1.2551 13.124 0.9546 -3.085141      1.576859  
1 1 1 16 9  3  o 6.0707 1.1514 42.825   15.003  58.567    20.922  26.161    21.526  7.2006 1.5014 4.9408 1.7460 2.259822       2.302772  
1 1 1 16 9  4  o 6.5882 1.0826 48.164   14.849  28.347    20.229  71.318    21.866  5.0515 1.6963 8.1248 1.3457 -3.073314      2.165236  
1 1 1 16 9  5  o 8.3141 1.0315 81.446   16.056  35.720    22.490  128.976   22.929  5.5446 1.7850 11.084 1.0344 -5.539051      2.063015  
1 1 1 16 9  6  o 5.1370 1.1207 28.594   14.367  7.4125    20.703  48.270    19.954  3.8302 1.6055 6.4438 1.5641 -2.613599      2.241408  
1 1 1 16 9  7  o 5.0295 1.2061 29.012   14.460  29.627    20.777  28.434    20.136  5.0724 1.7190 4.9866 1.6923 0.8580971E-01  2.412269  
1 1 1 16 9  8  o 5.4718 1.1967 35.257   14.626  28.207    20.583  42.447    20.787  4.9771 1.7106 5.9666 1.6739 -0.9895692     2.393345  
1 1 1 16 9  9  o 5.4892 1.2208 35.640   14.917  38.335    22.006  33.349    20.291  5.6552 1.7588 5.3233 1.6936 0.3319745      2.441676  
1 1 1 16 9  10 o 5.2023 1.2376 32.126   15.256  36.233    22.082  28.374    21.103  5.4589 1.7699 4.9458 1.7303 0.5130982      2.475155  
1 1 1 16 9  11 o 4.3893 1.1201 14.344   14.356  38.074    21.164  -5.8830   19.539  5.6136 1.7214 3.1650 1.4337 2.448544       2.240242  
1 1 1 16 9  12 o 8.2006 1.0650 78.437   16.704  61.441    24.646  92.877    22.718  7.1413 1.7413 9.2599 1.2267 -2.118607      2.129977  
1 1 1 16 9  13 o 7.6384 1.0169 73.914   16.954  9.1521    24.731  131.341   23.288  4.1335 1.7448 11.143 1.0449 -7.009810      2.033744  
1 1 1 16 9  14 o 4.3852 1.1827 17.738   15.072  5.9338    22.248  27.751    20.491  3.8354 1.6382 4.9349 1.7062 -1.099523      2.365355  
1 1 1 16 9  15 o 16.812 0.7015 298.043  23.568  306.703   34.160  290.179   32.557  17.035 1.0026 16.589 0.9813 0.4464397      1.402912  
1 1 1 16 9  16 o 8.8077 1.4654 97.933   23.119  100.433   26.535  90.054    47.106  9.5792 1.3850 8.0362 2.5829 1.542950       2.930839  
1 1 1 16 9  17 o 4.2020 1.1830 11.346   15.651  26.077    22.734  -1.9257   21.579  4.9063 1.7868 3.4977 1.5509 1.408629       2.365983  
1 1 1 16 9  18 o 3.5827 1.1172 -2.1457  15.550  8.5896    24.100  -9.8031   20.354  4.0564 1.7178 3.1090 1.4290 0.9474151      2.234496  
1 1 1 16 9  19 o 11.153 0.9002 136.911  19.812  122.139   29.270  149.400   26.914  10.501 1.3936 11.806 1.1399 -1.304259      1.800429  
1 1 1 16 9  20 o 4.5449 1.2589 19.507   16.609  30.392    25.778  11.782    21.717  5.0789 1.8933 4.0109 1.6596 1.068024       2.517729  
1 1 1 16 9  21 o 8.7188 1.3309 77.178   17.832  136.408   45.115  66.212    19.413  9.7413 2.3440 7.6964 1.2612 2.044904       2.661783  
1 1 1 16 9  22 o 8.4263 1.3117 77.540   17.843  134.139   41.473  64.684    19.766  9.5169 2.2196 7.3358 1.3983 2.181141       2.623349  
1 1 1 16 9  23 o 3.2600 1.1087 -7.4814  15.272  -20.3376  41.531  -5.4711   16.423  3.7441 1.8116 2.7760 1.2788 0.9680917      2.217462  
1 1 1 16 9  24 o 5.2572 1.1775 48.322   16.927  0.8700    41.620  57.727    18.529  3.8885 1.8640 6.6259 1.4394 -2.737438      2.355096  
1 1 1 16 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 9  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 10 0  o 3.5905 1.4944 8.5651   20.764  37.414    29.971  -18.0630  28.795  4.6960 2.4466 2.4851 1.7167 -0.000000      0.000000  
1 1 1 16 10 1  o 7.5809 1.1023 65.613   16.454  82.953    23.564  49.116    22.985  8.7307 1.3495 6.4312 1.7433 2.299540       2.204612  
1 1 1 16 10 2  o 4.0903 1.0455 5.7586   14.309  35.328    19.451  -29.1222  21.126  5.5044 1.6423 2.6762 1.2942 2.828218       2.090921  
1 1 1 16 10 3  o 6.9147 1.1520 55.877   15.615  53.501    21.077  58.768    23.249  6.7750 1.5838 7.0544 1.6731 -0.2794247     2.303903  
1 1 1 16 10 4  o 10.014 0.8769 110.364  17.123  132.787   23.801  86.305    24.653  11.188 1.0636 8.8397 1.3945 2.348554       1.753813  
1 1 1 16 10 5  o 6.2932 1.1731 47.564   15.384  34.503    21.981  60.104    21.539  5.3951 1.7668 7.1912 1.5437 -1.796103      2.346168  
1 1 1 16 10 6  o 4.5176 1.1367 19.197   14.385  0.8895    20.938  35.563    19.796  3.5481 1.5521 5.4872 1.6613 -1.939150      2.273472  
1 1 1 16 10 7  o 5.9956 1.2185 43.208   15.523  37.097    22.326  48.926    21.597  5.5774 1.7767 6.4137 1.6680 -0.8362684     2.436933  
1 1 1 16 10 8  o 3.1761 1.0059 -3.6861  13.240  -8.1212   19.498  0.1088    18.036  3.0786 1.4090 3.2737 1.4361 -0.1951289     2.011819  
1 1 1 16 10 9  o 5.7440 1.2204 39.981   15.184  43.680    21.679  36.418    21.273  5.9932 1.7192 5.4948 1.7326 0.4984093      2.440814  
1 1 1 16 10 10 o 5.4509 1.1976 34.401   14.808  48.012    22.106  23.323    19.943  6.2834 1.7123 4.6183 1.6747 1.665151       2.395164  
1 1 1 16 10 11 o 7.4663 1.1111 66.782   16.341  45.035    24.228  84.932    22.134  6.0803 1.8371 8.8523 1.2502 -2.772024      2.222146  
1 1 1 16 10 12 o 11.978 0.8042 153.205  19.192  170.929   27.579  136.563   26.724  12.682 1.0873 11.273 1.1853 1.408850       1.608440  
1 1 1 16 10 13 o 5.5316 1.2594 36.911   16.224  27.555    24.007  44.777    22.012  4.9788 1.8326 6.0845 1.7280 -1.105703      2.518785  
1 1 1 16 10 14 o 10.215 0.9308 117.123  18.457  95.025    27.485  135.272   24.908  9.1834 1.4965 11.247 1.1073 -2.063492      1.861595  
1 1 1 16 10 15 o 14.551 0.7348 223.176  21.312  219.339   31.249  226.512   29.140  14.401 1.0850 14.701 0.9911 -0.3000927     1.469531  
1 1 1 16 10 16 f 10.034 1.3524 139.064  22.315  85.260    43.824  157.898   25.928  7.8524 2.4879 12.216 1.0612 -4.363443      2.704811  
1 1 1 16 10 17 o 11.306 0.9540 145.184  20.642  109.715   30.826  174.019   27.794  9.8305 1.5679 12.782 1.0872 -2.951830      1.907922  
1 1 1 16 10 18 o 5.0292 1.4056 24.669   21.995  37.355    24.955  -19.4934  46.562  5.6021 1.8840 4.4563 2.0865 1.145756       2.811265  
1 1 1 16 10 19 o 5.7993 1.2658 42.627   17.906  18.758    27.307  60.630    23.716  4.5667 1.8722 7.0318 1.7041 -2.465086      2.531665  
1 1 1 16 10 20 o 3.7002 1.1566 1.5549   17.021  -7.1767   26.084  8.0308    22.464  3.5416 1.6241 3.8589 1.6472 -0.3173800     2.313169  
1 1 1 16 10 21 o 3.3255 1.0826 -6.2165  16.252  -8.5760   26.291  -4.7572   20.676  3.4495 1.5992 3.2015 1.4597 0.2480183      2.165223  
1 1 1 16 10 22 o 4.0704 1.1963 16.724   16.977  0.4033    27.006  27.390    21.831  3.6000 1.6515 4.5408 1.7313 -0.9408765     2.392657  
1 1 1 16 10 23 f 4.1379 1.2404 20.429   15.879  10.487    40.257  22.261    17.279  4.1374 1.9382 4.1384 1.5486 -0.1021385E-02 2.480867  
1 1 1 16 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 11 0  o 2.4970 1.2228 -19.6237 21.120  -27.9005  30.813  -12.2892  29.006  2.3833 1.6748 2.6107 1.7822 -0.000000      0.000000  
1 1 1 16 11 1  o 6.2815 1.2172 47.539   15.739  48.478    21.606  46.476    22.972  6.3714 1.6739 6.1916 1.7677 0.1797924      2.434426  
1 1 1 16 11 2  o 7.9422 1.0488 72.760   16.047  90.643    22.504  54.259    22.889  9.1507 1.2296 6.7337 1.6995 2.416996       2.097642  
1 1 1 16 11 3  o 2.9865 0.9802 -12.6091 14.010  -14.4622  19.329  -10.5581  20.335  2.8823 1.3479 3.0908 1.4235 -0.2084279     1.960393  
1 1 1 16 11 4  o 4.7917 1.1466 20.609   14.971  -0.9726   20.551  45.013    21.854  3.4502 1.5225 6.1332 1.7148 -2.682953      2.293147  
1 1 1 16 11 5  o 2.8517 0.9469 -16.9542 13.905  -8.6401   19.458  -25.6308  19.878  3.0728 1.4068 2.6305 1.2680 0.4422879      1.893864  
1 1 1 16 11 6  o 10.198 0.8770 115.766  17.467  94.606    25.631  134.111   23.866  9.1975 1.3934 11.200 1.0655 -2.002050      1.754094  
1 1 1 16 11 7  o 6.1917 1.2253 46.906   15.792  44.285    23.096  49.207    21.642  5.9990 1.7895 6.3844 1.6743 -0.3853598     2.450603  
1 1 1 16 11 8  o 10.776 0.8367 125.746  18.033  125.582   25.378  125.914   25.630  10.773 1.1778 10.780 1.1888 -0.6599426E-02 1.673488  
1 1 1 16 11 9  o 3.9484 1.1311 8.5533   14.752  -5.5656   20.960  22.412    20.766  3.2967 1.4899 4.6000 1.7024 -1.303221      2.262233  
1 1 1 16 11 10 o 4.0897 1.1396 9.3310   15.404  -12.8327  22.984  27.405    20.756  3.2388 1.4993 4.9406 1.7167 -1.701789      2.279207  
1 1 1 16 11 11 o 6.0524 1.2889 44.573   16.897  42.516    24.642  46.398    23.215  5.9119 1.8648 6.1928 1.7798 -0.2808871     2.577809  
1 1 1 16 11 12 o 3.4349 1.0784 -2.3176  15.017  -10.8303  22.561  4.4541    20.122  3.2447 1.4962 3.6251 1.5534 -0.3804739     2.156779  
1 1 1 16 11 13 o 5.2716 1.2707 32.602   16.060  33.453    22.770  31.759    22.655  5.3253 1.7996 5.2178 1.7946 0.1075125      2.541484  
1 1 1 16 11 14 o 6.0723 1.1972 44.095   16.714  19.089    24.704  65.204    22.697  4.6108 1.8183 7.5338 1.5578 -2.923054      2.394356  
1 1 1 16 11 15 o 12.468 0.8403 166.154  20.907  176.346   30.862  157.510   28.422  12.808 1.2048 12.128 1.1718 0.6805172      1.680641  
1 1 1 16 11 16 o 5.8526 1.2283 37.563   16.594  64.813    25.461  17.439    21.879  7.3331 1.7587 4.3720 1.7153 2.961092       2.456669  
1 1 1 16 11 17 o 4.9091 1.2523 18.965   17.295  47.964    26.710  -1.9675   22.694  6.2433 1.9371 3.5749 1.5876 2.668347       2.504557  
1 1 1 16 11 18 f 5.8088 1.4252 44.537   20.083  26.781    41.926  49.825    22.879  5.2780 2.2515 6.3397 1.7480 -1.061791      2.850383  
1 1 1 16 11 19 o 4.2289 1.1878 12.292   17.046  -14.7137  26.429  31.529    22.306  3.3650 1.5744 5.0929 1.7790 -1.727911      2.375667  
1 1 1 16 11 20 o 11.301 0.9574 145.812  21.443  154.788   32.896  139.182   28.275  11.518 1.4280 11.083 1.2755 0.4348392      1.914720  
1 1 1 16 11 21 f 5.1380 1.3299 34.533   17.911  59.569    29.360  19.694    22.604  6.1274 2.0436 4.1486 1.7024 1.978731       2.659781  
1 1 1 16 11 22 o 3.5880 1.1082 5.3738   16.411  -18.7926  26.357  20.675    20.972  3.0584 1.4706 4.1176 1.6581 -1.059170      2.216308  
1 1 1 16 11 23 o 3.1770 1.0432 -17.8107 15.190  26.843    26.580  -39.4657  18.510  4.2601 1.8041 2.0940 1.0481 2.166147       2.086422  
1 1 1 16 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 11 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 12 0  o 12.293 1.1935 171.298  27.461  167.333   41.033  174.515   36.957  12.043 1.8285 12.544 1.5346 -0.000000      0.000000  
1 1 1 16 12 1  o 3.9989 1.1471 9.2006   15.517  23.627    20.712  -9.2565   23.428  4.6498 1.7036 3.3479 1.5367 1.301840       2.294277  
1 1 1 16 12 2  o 5.3998 1.0805 29.692   15.487  64.484    21.981  -4.6032   21.824  7.4208 1.5318 3.3789 1.5242 4.041946       2.160963  
1 1 1 16 12 3  o 4.0739 1.1494 12.093   14.851  -0.6166   21.428  23.842    20.602  3.4935 1.5475 4.6543 1.7000 -1.160839      2.298825  
1 1 1 16 12 4  o 4.5485 1.1772 19.542   15.297  2.0634    22.035  35.802    21.253  3.6462 1.5937 5.4509 1.7332 -1.804758      2.354497  
1 1 1 16 12 5  o 8.0785 1.0740 75.629   16.713  78.050    23.683  73.227    23.588  8.2275 1.4943 7.9294 1.5429 0.2981339      2.147937  
1 1 1 16 12 6  o 5.0877 1.2034 27.730   15.481  46.813    22.771  11.327    21.111  6.1790 1.7585 3.9964 1.6432 2.182632       2.406702  
1 1 1 16 12 7  o 5.5457 1.2431 35.628   16.066  50.847    23.585  22.452    21.944  6.4545 1.7727 4.6368 1.7432 1.817722       2.486234  
1 1 1 16 12 8  o 5.7577 1.2711 39.931   16.429  33.346    24.102  45.646    22.454  5.3496 1.8504 6.1659 1.7432 -0.8163028     2.542209  
1 1 1 16 12 9  o 4.2963 1.2227 13.476   16.517  23.645    23.545  3.6212    23.177  4.7777 1.8036 3.8149 1.6512 0.9628348      2.445314  
1 1 1 16 12 10 o 4.2053 1.1728 13.278   15.473  -1.7521   22.950  25.805    20.952  3.5857 1.5942 4.8249 1.7207 -1.239224      2.345689  
1 1 1 16 12 11 o 4.7001 1.2280 23.588   15.639  15.185    23.073  30.729    21.271  4.2832 1.7341 5.1169 1.7393 -0.8337359     2.456074  
1 1 1 16 12 12 o 8.1220 1.0847 74.053   17.180  89.089    25.857  62.168    22.988  8.9585 1.4431 7.2856 1.6196 1.672903       2.169299  
1 1 1 16 12 13 o 5.7196 1.2927 38.964   16.899  32.270    24.444  45.093    23.388  5.3097 1.8620 6.1295 1.7937 -0.8198109     2.585366  
1 1 1 16 12 14 o 7.5375 1.2240 68.130   18.330  50.397    25.890  85.952    25.955  6.4160 1.8899 8.6590 1.5559 -2.242929      2.447971  
1 1 1 16 12 15 o 10.288 0.9540 116.592  19.550  113.774   28.680  119.037   26.719  10.124 1.4165 10.452 1.2782 -0.3282318     1.907961  
1 1 1 16 12 16 o 6.3477 1.3397 49.890   18.749  38.232    27.717  59.723    25.457  5.6655 1.9829 7.0299 1.8022 -1.364370      2.679497  
1 1 1 16 12 17 o 9.1343 1.1382 100.965  19.633  72.459    28.609  126.337   26.991  7.5589 1.8958 10.710 1.2601 -3.150805      2.276360  
1 1 1 16 12 18 o 4.6829 1.2702 17.893   17.572  43.364    27.529  0.3785    22.828  5.7753 1.9786 3.5905 1.5935 2.184783       2.540500  
1 1 1 16 12 19 f 6.1807 1.3285 46.839   18.905  78.720    29.697  25.114    24.514  7.6806 1.9344 4.6809 1.8214 2.999732       2.656945  
1 1 1 16 12 20 o 6.4778 1.4002 61.083   19.548  70.735    30.763  54.547    25.316  6.7964 2.0739 6.1593 1.8817 0.6370764      2.800336  
1 1 1 16 12 21 o 5.6787 1.6106 56.499   26.139  53.633    29.475  67.053    56.567  5.7766 2.0429 5.5808 2.4906 0.1958137      3.221261  
1 1 1 16 12 22 o 3.5135 1.1393 2.6048   17.354  16.375    28.828  -5.2210   21.732  3.9697 1.7743 3.0574 1.4296 0.9123135      2.278600  
1 1 1 16 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 0  o 15.359 1.0232 256.852  30.571  249.261   45.364  263.167   41.377  15.064 1.5428 15.655 1.3444 -0.000000      0.000000  
1 1 1 16 13 1  o 4.2652 1.2038 15.513   15.658  9.6988    22.358  21.108    21.935  3.9874 1.6697 4.5429 1.7346 -0.5554323     2.407673  
1 1 1 16 13 2  o 5.9421 1.2440 43.325   15.998  36.716    23.009  49.510    22.259  5.5006 1.8079 6.3835 1.7094 -0.8828626     2.488072  
1 1 1 16 13 3  o 4.4522 1.0037 3.0946   14.873  51.078    21.239  -43.0799  20.835  6.5394 1.6298 2.3650 1.1719 4.174345       2.007338  
1 1 1 16 13 4  o 4.1386 1.1771 12.486   15.361  2.7779    21.872  21.935    21.580  3.6785 1.5981 4.5986 1.7287 -0.9201362     2.354220  
1 1 1 16 13 5  o 5.4344 1.2894 34.887   16.543  36.403    23.249  33.332    23.543  5.5306 1.8173 5.3382 1.8298 0.1924458      2.578882  
1 1 1 16 13 6  o 3.7619 1.1584 2.1749   16.380  5.3268    22.920  -1.1151   23.417  3.8704 1.6582 3.6535 1.6180 0.2169175      2.316831  
1 1 1 16 13 7  o 4.1525 1.1691 10.426   15.572  26.600    22.231  -5.1551   21.819  4.9132 1.7702 3.3917 1.5276 1.521488       2.338222  
1 1 1 16 13 8  o 5.2483 1.2829 32.185   16.383  28.898    25.300  34.559    21.499  5.0941 1.8802 5.4026 1.7458 -0.3085470     2.565784  
1 1 1 16 13 9  f 9.9624 0.9481 109.541  18.832  120.997   27.118  98.868    26.174  10.499 1.2914 9.4255 1.3884 1.073698       1.896187  
1 1 1 16 13 10 o 7.2412 1.2410 62.672   18.149  84.476    26.879  44.402    24.605  8.4754 1.6450 6.0070 1.8585 2.468485       2.481915  
1 1 1 16 13 11 o 4.4421 1.2511 16.596   16.712  18.323    23.411  14.801    23.863  4.5189 1.7739 4.3653 1.7649 0.1535869      2.502287  
1 1 1 16 13 12 o 5.0942 1.3004 28.692   17.021  33.359    24.656  24.443    23.527  5.3606 1.8705 4.8277 1.8070 0.5329280      2.600782  
1 1 1 16 13 13 o 20.191 0.6708 426.686  27.087  428.704   38.153  424.634   38.464  20.246 0.9422 20.137 0.9550 0.1084232      1.341622  
1 1 1 16 13 14 o 4.5356 1.2542 19.000   16.975  8.1736    25.903  27.149    22.474  4.1389 1.7678 4.9323 1.7795 -0.7933888     2.508300  
1 1 1 16 13 15 o 4.5029 1.2645 13.644   17.787  32.352    26.536  -1.6187   23.969  5.3296 1.9320 3.6761 1.6321 1.653501       2.529071  
1 1 1 16 13 16 o 4.6677 1.2939 21.895   17.938  13.233    26.280  29.451    24.546  4.3032 1.8065 5.0322 1.8529 -0.7289667     2.587823  
1 1 1 16 13 17 o 4.5135 1.2685 13.791   18.321  39.187    27.719  -5.9099   24.414  5.5436 1.9789 3.4834 1.5874 2.060184       2.536937  
1 1 1 16 13 18 o 5.2579 1.3734 34.799   18.982  42.253    28.944  29.174    25.143  5.6031 2.0198 4.9126 1.8616 0.6904864      2.746858  
1 1 1 16 13 19 o 5.1388 1.3425 36.579   18.638  28.174    28.584  42.795    24.581  4.7457 1.9270 5.5320 1.8698 -0.7863016     2.685096  
1 1 1 16 13 20 o 3.5034 1.1304 0.7552   17.112  0.3130    28.091  1.0161    21.578  3.6518 1.6786 3.3549 1.5143 0.2969561      2.260722  
1 1 1 16 13 21 o 4.6100 1.3737 32.962   21.366  21.436    44.650  36.385    24.333  4.3759 2.0471 4.8440 1.8324 -0.4681010     2.747417  
1 1 1 16 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 13 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 0  o 4.1381 1.6880 22.916   24.614  -0.1833   35.075  45.327    34.549  3.2019 2.1149 5.0743 2.6315 -0.000000      0.000000  
1 1 1 16 14 1  o 7.0461 1.2148 60.682   17.512  78.324    24.082  40.884    25.512  8.2792 1.5100 5.8129 1.9033 2.466378       2.429555  
1 1 1 16 14 2  o 6.6395 1.2659 53.251   17.329  61.859    24.803  45.044    24.220  7.1886 1.7432 6.0903 1.8361 1.098334       2.531773  
1 1 1 16 14 3  o 7.2791 1.2381 63.274   17.826  70.762    25.931  56.565    24.546  7.7136 1.7242 6.8446 1.7773 0.8689413      2.476230  
1 1 1 16 14 4  o 7.9080 1.1645 73.224   17.829  83.717    25.739  63.543    24.721  8.5193 1.5684 7.2968 1.7218 1.222443       2.329027  
1 1 1 16 14 5  o 4.7921 1.2728 23.631   16.808  16.093    23.992  30.896    23.554  4.3991 1.7727 5.1850 1.8270 -0.7859406     2.545685  
1 1 1 16 14 6  o 7.0302 1.5377 60.407   21.727  54.440    25.218  77.592    42.796  6.6458 1.8363 7.4145 2.4670 -0.7687664     3.075394  
1 1 1 16 14 7  o 5.5072 1.2695 35.512   17.375  16.562    24.915  53.452    24.242  4.4267 1.7985 6.5877 1.7923 -2.161055      2.539096  
1 1 1 16 14 8  o 7.3136 1.2254 65.392   17.992  47.885    25.730  82.145    25.169  6.2056 1.8972 8.4215 1.5515 -2.215941      2.450860  
1 1 1 16 14 9  o 14.360 0.7803 219.608  22.308  199.568   31.852  238.901   31.253  13.667 1.1653 15.053 1.0381 -1.386104      1.560617  
1 1 1 16 14 10 o 4.2868 1.2252 13.230   16.651  3.7457    24.173  21.794    22.971  3.8965 1.6864 4.6770 1.7777 -0.7804871     2.450323  
1 1 1 16 14 11 o 6.5738 1.2833 50.757   18.064  73.029    27.084  32.911    24.243  7.8144 1.7735 5.3332 1.8552 2.481266       2.566532  
1 1 1 16 14 12 o 6.9207 1.1810 57.977   18.513  21.830    26.895  90.526    25.521  4.7926 1.8949 9.0487 1.4102 -4.256031      2.362087  
1 1 1 16 14 13 o 9.2625 1.1517 102.696  20.084  78.569    30.209  121.809   26.887  7.9551 1.9205 10.570 1.2719 -2.614741      2.303499  
1 1 1 16 14 14 o 3.8304 1.1584 -0.4787  17.150  -22.9584  25.207  18.897    23.402  3.1412 1.4903 4.5195 1.7737 -1.378325      2.316706  
1 1 1 16 14 15 o 4.9872 1.2027 24.883   17.798  -11.6821  27.335  51.795    23.451  3.5252 1.6330 6.4492 1.7662 -2.924028      2.405429  
1 1 1 16 14 16 o 4.3625 1.2965 14.307   18.997  18.868    29.080  10.911    25.092  4.6031 1.9138 4.1219 1.7496 0.4811316      2.593051  
1 1 1 16 14 17 o 4.2625 1.2860 12.686   19.127  20.653    29.613  6.9837    25.055  4.6131 1.9258 3.9118 1.7048 0.7012575      2.571982  
1 1 1 16 14 18 o 4.0905 1.2149 8.9681   18.915  -20.4041  28.526  32.015    25.269  3.2557 1.5560 4.9253 1.8663 -1.669616      2.429861  
1 1 1 16 14 19 o 4.3879 1.2957 23.024   18.888  22.753    28.696  23.230    25.090  4.4060 1.8707 4.3698 1.7934 0.3621435E-01  2.591470  
1 1 1 16 14 20 f 3.0265 1.0262 -16.1357 17.927  -29.7007  28.970  -7.7180   22.821  2.9674 1.4528 3.0855 1.4498 -0.1181250     2.052477  
1 1 1 16 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 14 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 15 0  o 3.3341 1.5374 4.6025   24.993  8.5412    35.638  0.7905    35.061  3.4573 2.2283 3.2109 2.1187 -0.000000      0.000000  
1 1 1 16 15 1  o 7.5296 1.2537 68.699   18.691  56.595    25.937  81.775    26.959  6.7562 1.8604 8.3030 1.6811 -1.546854      2.507462  
1 1 1 16 15 2  o 4.9849 1.2561 23.873   17.680  47.420    25.158  0.8959    24.851  6.1770 1.8733 3.7928 1.6739 2.384207       2.512251  
1 1 1 16 15 3  o 7.9115 1.2067 75.349   19.034  54.928    26.934  95.719    26.901  6.5973 1.9232 9.2257 1.4580 -2.628401      2.413375  
1 1 1 16 15 4  o 8.0243 1.1840 76.532   18.337  79.733    27.134  73.841    24.877  8.1475 1.7192 7.9011 1.6284 0.2463207      2.368005  
1 1 1 16 15 5  o 11.713 0.8814 149.499  20.617  146.527   29.739  152.250   28.608  11.571 1.2851 11.855 1.2065 -0.2845879     1.762722  
1 1 1 16 15 6  o 4.6288 1.3026 19.370   18.124  16.277    26.559  22.065    24.794  4.5254 1.8498 4.7322 1.8345 -0.2067695     2.605202  
1 1 1 16 15 7  o 11.239 0.9397 136.764  20.786  169.849   30.403  107.726   28.483  12.590 1.2074 9.8884 1.4402 2.702003       1.879369  
1 1 1 16 15 8  o 4.1555 1.2047 8.6693   17.127  -9.8692   25.548  23.802    23.081  3.5230 1.6125 4.7881 1.7902 -1.265072      2.409384  
1 1 1 16 15 9  o 8.4831 1.1848 84.322   19.354  84.252    28.260  84.383    26.561  8.4373 1.7327 8.5289 1.6163 -0.9166908E-01 2.369534  
1 1 1 16 15 10 o 2.7184 0.9387 -39.5782 16.413  -22.2331  24.660  -53.3726  21.992  3.1209 1.4787 2.3159 1.1567 0.8049643      1.877359  
1 1 1 16 15 11 o 5.1221 1.3300 29.505   17.840  28.480    26.573  30.347    24.070  5.0933 1.9176 5.1509 1.8435 -0.5759430E-01 2.660014  
1 1 1 16 15 12 o 9.7860 1.0706 107.502  20.386  124.122   30.035  93.303    27.760  10.591 1.4179 8.9806 1.6044 1.610873       2.141183  
1 1 1 16 15 13 o 4.4055 1.2766 15.502   18.009  11.607    26.261  18.959    24.743  4.2751 1.8009 4.5359 1.8099 -0.2608128     2.553196  
1 1 1 16 15 14 o 11.651 0.9910 153.090  23.018  155.635   33.998  150.937   31.277  11.689 1.4543 11.613 1.3467 0.7628822E-01  1.982065  
1 1 1 16 15 15 o 4.0685 1.2568 6.5377   19.495  -3.0170   30.628  13.044    25.276  3.9248 1.7845 4.2122 1.7701 -0.2873471     2.513549  
1 1 1 16 15 16 f 5.1900 1.3392 32.006   20.691  1.5908    31.424  55.287    27.493  4.0245 1.8210 6.3556 1.9642 -2.331075      2.678426  
1 1 1 16 15 17 o 3.5927 1.1635 -2.8722  19.082  -12.5035  28.202  5.2599    25.914  3.4015 1.6024 3.7839 1.6874 -0.3823960     2.327061  
1 1 1 16 15 18 o 6.0987 1.4270 57.362   20.280  66.354    30.013  49.805    27.512  6.5032 2.0587 5.6942 1.9765 0.8090096      2.853950  
1 1 1 16 15 19 o 7.3417 1.4088 84.144   21.114  91.575    31.728  78.237    28.287  7.5606 2.0477 7.1228 1.9353 0.4378171      2.817505  
1 1 1 16 15 20 o 5.5530 1.1430 44.843   20.041  -20.6494  30.937  92.194    26.306  3.1329 1.5268 7.9731 1.7015 -4.840217      2.286061  
1 1 1 16 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 0  o 5.4159 1.9084 49.819   24.823  61.540    39.023  41.854    32.170  5.9250 2.8482 4.9067 2.5407 -0.000000      0.000000  
1 1 1 16 16 1  o 7.9176 1.2399 74.621   19.105  73.250    26.486  76.108    27.583  7.8545 1.7326 7.9807 1.7741 -0.1261868     2.479781  
1 1 1 16 16 2  o 3.9037 1.1875 4.7278   16.747  5.2436    23.302  4.1767    24.085  3.9007 1.6716 3.9067 1.6871 -0.5964279E-02 2.374989  
1 1 1 16 16 3  o 10.696 0.9327 123.829  19.882  110.579   27.397  138.571   28.899  10.066 1.3608 11.326 1.2758 -1.259795      1.865308  
1 1 1 16 16 4  o 8.7298 1.1112 87.217   18.721  70.393    26.630  103.657   26.324  7.7031 1.7662 9.7565 1.3491 -2.053415      2.222489  
1 1 1 16 16 5  o 12.352 0.8323 162.872  20.531  173.957   29.981  153.084   28.173  12.748 1.1759 11.957 1.1781 0.7906523      1.664557  
1 1 1 16 16 6  f 10.437 0.9408 119.295  19.584  113.835   28.259  124.341   27.166  10.167 1.3898 10.708 1.2685 -0.5413628     1.881649  
1 1 1 16 16 7  f 8.0987 1.1963 77.137   18.745  76.532    26.895  77.710    26.141  8.0445 1.7235 8.1528 1.6596 -0.1083622     2.392653  
1 1 1 16 16 8  f 5.6954 1.2943 37.155   18.534  13.573    26.731  58.985    25.719  4.4233 1.8367 6.9675 1.8242 -2.544181      2.588639  
1 1 1 16 16 9  o 7.1007 1.2992 61.971   18.618  58.275    26.915  65.363    25.782  6.8504 1.8987 7.3510 1.7740 -0.5005360     2.598469  
1 1 1 16 16 10 o 5.6113 1.3717 37.690   19.060  28.925    27.628  45.650    26.328  5.1451 1.9510 6.0774 1.9287 -0.9323316     2.743394  
1 1 1 16 16 11 o 6.3104 1.3473 46.714   19.199  70.313    29.079  28.478    25.562  7.5350 1.9231 5.0857 1.8874 2.449363       2.694587  
1 1 1 16 16 12 o 8.6522 1.2952 92.375   21.656  98.880    32.097  86.939    29.342  8.9113 1.8610 8.3932 1.8018 0.5180845      2.590317  
1 1 1 16 16 13 o 4.4433 1.3227 12.812   20.230  27.376    30.357  1.1768    27.132  5.0065 2.0023 3.8802 1.7288 1.126370       2.645355  
1 1 1 16 16 14 o 16.898 0.8373 313.963  28.266  319.732   41.046  308.760   38.983  17.016 1.2061 16.779 1.1617 0.2371922      1.674527  
1 1 1 16 16 15 o 3.9712 1.2480 5.1192   19.983  -1.8266   30.126  10.576    26.704  3.8511 1.7583 4.0914 1.7716 -0.2403147     2.496014  
1 1 1 16 16 16 o 8.1475 1.3581 95.715   22.026  78.890    32.101  110.683   30.278  7.1418 2.1047 9.1533 1.7170 -2.011475      2.716195  
1 1 1 16 16 17 o 5.2765 1.4118 42.136   20.564  52.195    30.138  33.372    28.129  5.7136 2.0608 4.8395 1.9302 0.8741107      2.823541  
1 1 1 16 16 18 o 5.6329 1.4627 54.852   21.440  61.070    32.775  50.201    28.347  5.7974 2.1400 5.4685 1.9946 0.3288879      2.925420  
1 1 1 16 16 19 o 5.7438 1.4650 60.991   21.477  76.211    32.895  49.682    28.354  6.2619 2.1620 5.2257 1.9777 1.036208       2.930095  
1 1 1 16 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 16 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 0  o 5.3271 1.9434 50.640   26.813  44.531    38.666  56.300    37.215  4.9873 2.7235 5.6668 2.7730 -0.000000      0.000000  
1 1 1 16 17 1  o 4.2455 1.2313 5.5240   18.320  -17.4772  25.563  29.813    26.269  3.3072 1.5477 5.1837 1.9154 -1.876473      2.462564  
1 1 1 16 17 2  o 12.420 0.8693 165.424  21.373  199.318   31.389  136.127   29.183  13.657 1.1492 11.183 1.3048 2.474027       1.738684  
1 1 1 16 17 3  o 4.7049 1.3004 19.835   17.994  29.866    26.224  10.909    24.737  5.1930 1.9147 4.2169 1.7602 0.9761086      2.600877  
1 1 1 16 17 4  o 4.0367 1.2015 5.8804   17.341  -10.1100  25.759  19.134    23.451  3.5282 1.6165 4.5451 1.7779 -1.016935      2.402917  
1 1 1 16 17 5  o 5.7728 1.3569 38.757   18.674  53.474    27.860  26.752    25.163  6.5524 1.9678 4.9933 1.8688 1.559149       2.713789  
1 1 1 16 17 6  o 4.6926 1.3054 20.120   17.627  27.178    28.164  15.574    22.601  5.0746 1.9585 4.3106 1.7264 0.7640438      2.610786  
1 1 1 16 17 7  o 4.8961 1.2601 23.586   18.105  -2.6877   27.777  42.994    23.874  3.8620 1.7328 5.9303 1.8300 -2.068310      2.520189  
1 1 1 16 17 8  o 4.7833 1.3309 21.273   19.244  8.7627    29.341  30.717    25.492  4.3547 1.8712 5.2119 1.8929 -0.8571634     2.661712  
1 1 1 16 17 9  o 3.8979 1.2075 0.5120   18.491  -13.1761  27.703  11.512    24.834  3.5640 1.6485 4.2318 1.7648 -0.6678638     2.414964  
1 1 1 16 17 10 o 4.8389 1.3396 22.561   19.954  4.6912    29.226  38.164    27.309  4.1337 1.8203 5.5441 1.9658 -1.410319      2.679149  
1 1 1 16 17 11 o 6.1115 1.4030 45.576   21.003  73.740    31.400  22.772    28.254  7.4598 2.0441 4.7632 1.9223 2.696608       2.805938  
1 1 1 16 17 12 o 4.0026 1.2662 0.6749   21.094  -9.8688   31.054  9.7070    28.742  3.7674 1.7436 4.2377 1.8365 -0.4703259     2.532322  
1 1 1 16 17 13 o 8.6436 1.3755 98.499   23.319  83.210    32.767  114.189   33.194  7.7890 2.0686 9.4982 1.8135 -1.709227      2.750952  
1 1 1 16 17 14 o 5.6416 1.4105 40.556   21.302  68.964    31.869  17.611    28.641  6.8803 2.1128 4.4030 1.8691 2.477318       2.820912  
1 1 1 16 17 15 o 6.7712 1.3834 73.066   21.728  45.616    32.772  94.596    29.025  5.2981 2.0927 8.2442 1.8099 -2.946076      2.766824  
1 1 1 16 17 16 o 3.3614 1.1304 -13.4193 20.468  -6.1819   31.145  -18.9215  27.156  3.5978 1.6915 3.1249 1.5000 0.4728155      2.260845  
1 1 1 16 17 17 o 3.7708 1.2182 6.9603   20.959  -6.8027   31.938  17.371    27.778  3.5134 1.6700 4.0282 1.7742 -0.5148082     2.436499  
1 1 1 16 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 17 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 0  o 11.239 1.4763 150.231  29.568  156.243   44.941  145.642   39.263  11.329 2.2296 11.149 1.9358 -0.000000      0.000000  
1 1 1 16 18 1  o 4.5351 1.2875 15.556   18.860  30.375    25.690  -1.7679   27.777  5.1757 1.8971 3.8946 1.7412 1.281034       2.575027  
1 1 1 16 18 2  o 10.773 1.0631 132.523  21.565  96.785    30.102  170.204   30.909  9.0210 1.7314 12.525 1.2339 -3.503598      2.126109  
1 1 1 16 18 3  o 4.2108 1.2499 6.4979   18.761  -11.1899  26.303  24.815    26.767  3.5138 1.6185 4.9079 1.9051 -1.394155      2.499790  
1 1 1 16 18 4  o 3.5448 1.1001 -9.8569  17.155  -46.0055  26.699  15.560    22.388  2.7944 1.3735 4.2952 1.7189 -1.500759      2.200285  
1 1 1 16 18 5  o 19.304 0.7180 393.193  27.684  375.051   39.409  410.867   38.898  18.834 1.0462 19.775 0.9835 -0.9412441     1.435917  
1 1 1 16 18 6  o 3.5364 1.1516 -14.0368 18.907  -1.2311   27.943  -24.8505  25.677  3.9384 1.7546 3.1344 1.4920 0.8040400      2.303150  
1 1 1 16 18 7  o 8.7321 1.2731 92.719   21.441  93.848    31.592  91.754    29.195  8.7235 1.8671 8.7407 1.7313 -0.1716042E-01 2.546257  
1 1 1 16 18 8  o 7.7016 1.2909 76.735   21.042  45.528    31.047  103.251   28.618  5.9120 2.0960 9.4912 1.5076 -3.579199      2.581889  
1 1 1 16 18 9  o 8.7432 1.3481 97.942   22.838  88.148    34.145  105.871   30.723  8.1372 2.0878 9.3492 1.7059 -1.211968      2.696105  
1 1 1 16 18 10 o 5.5925 1.4377 39.426   21.268  52.135    30.460  27.335    29.710  6.2120 2.0815 4.9730 1.9836 1.239009       2.875304  
1 1 1 16 18 11 o 10.097 1.2274 124.616  23.841  155.560   34.934  97.643    32.616  11.534 1.5145 8.6612 1.9320 2.872391       2.454850  
1 1 1 16 18 12 o 6.9492 1.4684 69.383   22.362  58.048    32.376  79.724    30.924  6.2952 2.1458 7.6032 2.0049 -1.308025      2.936702  
1 1 1 16 18 13 f 6.2822 1.4979 60.657   22.309  68.888    32.876  53.632    30.371  6.6340 2.1601 5.9304 2.0757 0.7035918      2.995736  
1 1 1 16 18 14 o 5.4553 1.4545 47.292   21.586  47.643    32.786  47.023    28.679  5.4169 2.1068 5.4938 2.0059 -0.7690525E-01 2.909002  
1 1 1 16 18 15 o 4.2216 1.3045 16.064   22.199  -7.5127   32.706  36.203    30.228  3.5924 1.7024 4.8508 1.9770 -1.258329      2.608989  
1 1 1 16 18 16 o 3.2947 1.1180 -12.2347 20.691  -4.2122   32.679  -17.6035  26.733  3.5557 1.6898 3.0336 1.4643 0.5220957      2.236018  
1 1 1 16 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 18 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 0  o 5.2018 1.7935 35.747   28.713  85.390    40.858  -12.6907  40.359  7.3045 2.8992 3.0992 2.1121 -0.000000      0.000000  
1 1 1 16 19 1  o 9.3123 1.2023 102.201  21.521  134.686   31.299  73.069    29.639  10.988 1.4242 7.6361 1.9376 3.352421       2.404665  
1 1 1 16 19 2  o 4.3988 1.2859 14.840   18.384  11.804    27.949  17.156    24.406  4.3611 1.8486 4.4365 1.7879 -0.7541704E-01 2.571751  
1 1 1 16 19 3  o 9.1713 1.2478 100.944  22.229  133.473   32.571  72.583    30.413  10.829 1.5039 7.5136 1.9916 3.315400       2.495647  
1 1 1 16 19 4  o 4.5093 1.3172 16.997   19.313  19.232    27.635  14.863    27.000  4.6137 1.8865 4.4050 1.8389 0.2086673      2.634467  
1 1 1 16 19 5  o 11.285 0.9843 143.252  22.068  163.901   31.778  124.021   30.668  12.143 1.3085 10.426 1.4707 1.716952       1.968552  
1 1 1 16 19 6  o 6.7270 1.3275 60.497   19.748  37.560    30.512  77.031    25.906  5.4868 2.0570 7.9671 1.6788 -2.480306      2.655063  
1 1 1 16 19 7  o 9.7062 1.2017 114.132  22.600  104.983   33.048  122.170   30.975  9.1260 1.8734 10.286 1.5056 -1.160372      2.403429  
1 1 1 16 19 8  f 4.0450 1.2624 1.1871   20.431  18.839    30.075  -13.9422  27.842  4.6196 1.9356 3.4704 1.6212 1.149161       2.524852  
1 1 1 16 19 9  o 5.6699 1.4486 42.918   22.021  26.954    32.596  56.320    29.867  4.9544 2.0400 6.3854 2.0571 -1.431026      2.897136  
1 1 1 16 19 10 o 5.0758 1.3450 23.389   21.510  62.575    31.429  -11.1420  29.503  6.5780 2.1093 3.5736 1.6692 3.004401       2.689909  
1 1 1 16 19 11 o 4.2494 1.2853 9.6823   21.192  -17.9190  30.766  34.601    29.232  3.4366 1.6351 5.0622 1.9837 -1.625669      2.570689  
1 1 1 16 19 12 o 2.7099 0.9525 -47.0316 19.751  -40.8331  29.458  -52.0940  26.622  2.8735 1.4182 2.5463 1.2719 0.3271966      1.904986  
1 1 1 16 19 13 o 8.6437 1.3086 115.730  23.661  60.973    35.713  158.569   31.589  5.8800 2.2210 11.407 1.3846 -5.527311      2.617213  
1 1 1 16 19 14 o 6.7256 1.4060 77.009   23.782  36.784    34.620  112.954   32.726  4.7712 2.0409 8.6800 1.9346 -3.908873      2.812082  
1 1 1 16 19 15 o 4.9233 1.4004 43.726   22.677  22.841    34.047  60.379    30.403  4.1718 1.8908 5.6748 2.0663 -1.503011      2.800864  
1 1 1 16 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 19 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 0  o 6.4622 1.9013 73.645   28.934  40.026    44.176  98.900    38.289  4.6406 2.7495 8.2837 2.6267 -0.000000      0.000000  
1 1 1 16 20 1  o 5.9321 1.4426 46.033   20.671  51.689    30.557  41.259    28.069  6.2025 2.0848 5.6617 1.9945 0.5407653      2.885211  
1 1 1 16 20 2  o 4.9982 1.3927 27.037   20.791  37.553    29.836  17.109    28.989  5.4627 2.0368 4.5337 1.9000 0.9289708      2.785400  
1 1 1 16 20 3  o 3.8599 1.2336 -2.0183  20.334  -3.6166   29.102  -0.4939   28.422  3.8320 1.7412 3.8878 1.7480 -0.5579376E-01 2.467249  
1 1 1 16 20 4  o 7.8263 1.5529 94.191   27.343  111.110   32.950  56.773    49.002  9.4392 1.8113 6.2134 2.5231 3.225706       3.105886  
1 1 1 16 20 5  f 12.312 0.9980 173.442  24.503  169.922   35.707  176.575   33.687  12.126 1.4723 12.498 1.3477 -0.3723373     1.995998  
1 1 1 16 20 6  o 11.364 1.0597 150.642  24.000  167.361   34.714  135.333   33.218  12.027 1.4432 10.702 1.5520 1.324880       2.119301  
1 1 1 16 20 7  o 5.4866 1.4219 41.108   20.877  30.856    32.832  48.067    27.051  5.0503 2.0596 5.9230 1.9609 -0.8727140     2.843810  
1 1 1 16 20 8  o 4.8569 1.4206 27.389   22.408  27.031    33.864  27.668    29.888  4.8770 2.0492 4.8368 1.9680 0.4017115E-01  2.841182  
1 1 1 16 20 9  o 3.3194 1.1255 -21.0345 21.300  -15.2868  31.827  -25.6968  28.665  3.5074 1.6671 3.1313 1.5127 0.3761055      2.251075  
1 1 1 16 20 10 o 5.0950 1.4514 40.047   22.617  47.630    34.034  34.050    30.267  5.3553 2.1271 4.8346 1.9753 0.5207214      2.902839  
1 1 1 16 20 11 o 3.5428 1.1798 -10.8439 21.150  8.4738    32.934  -24.4018  27.591  4.0372 1.8414 3.0484 1.4754 0.9888582      2.359514  
1 1 1 16 20 12 o 4.7304 1.3639 23.762   22.172  66.498    34.299  -6.9152   29.060  6.0287 2.1948 3.4321 1.6199 2.596597       2.727826  
1 1 1 16 20 13 o 12.703 1.0385 211.413  26.066  198.230   38.592  222.471   35.347  12.059 1.6002 13.348 1.3241 -1.289120      2.076985  
1 1 1 16 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 20 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 0  o 3.7239 1.6880 11.562   30.115  -16.5201  43.779  36.783    41.490  3.0514 2.1099 4.3964 2.6354 -0.000000      0.000000  
1 1 1 16 21 1  o 4.6352 1.3660 21.761   21.046  23.997    29.184  19.337    30.379  4.7120 1.9341 4.5585 1.9295 0.1535091      2.731945  
1 1 1 16 21 2  o 4.5606 1.3536 20.204   20.852  18.368    28.931  22.189    30.080  4.4708 1.8871 4.6503 1.9411 -0.1795673     2.707196  
1 1 1 16 21 3  o 5.0068 1.2769 20.348   19.992  63.111    29.289  -16.9618  27.357  6.7054 2.0185 3.3082 1.5645 3.397178       2.553869  
1 1 1 16 21 4  o 8.1761 1.3017 90.267   22.594  48.388    31.693  133.551   32.221  5.7922 2.1096 10.560 1.5256 -4.767816      2.603414  
1 1 1 16 21 5  o 6.1207 1.4854 55.630   21.936  56.818    31.599  54.525    30.475  6.1626 2.1194 6.0787 2.0818 0.8386421E-01  2.970860  
1 1 1 16 21 6  o 7.8350 1.3969 93.415   22.875  67.225    34.967  113.010   30.246  6.3613 2.2272 9.3087 1.6867 -2.947397      2.793768  
1 1 1 16 21 7  o 2.8217 0.9883 -45.3246 20.964  -56.3691  30.869  -35.8710  28.560  2.7453 1.3710 2.8981 1.4237 -0.1527946     1.976514  
1 1 1 16 21 8  o 2.9094 1.0122 -38.8602 20.735  -50.7371  31.404  -29.6803  27.609  2.8585 1.4202 2.9604 1.4426 -0.1018493     2.024375  
1 1 1 16 21 9  o 4.4795 1.2859 22.585   20.635  -10.3833  32.018  46.007    26.987  3.5283 1.6756 5.4306 1.9511 -1.902294      2.571846  
1 1 1 16 21 10 o 3.6310 1.1937 -2.9932  21.852  -26.5420  32.860  15.678    29.260  3.2188 1.5697 4.0432 1.7988 -0.8244562     2.387369  
1 1 1 16 21 11 o 3.8731 1.2529 11.601   21.617  15.733    32.568  8.3479    28.903  4.0157 1.8314 3.7306 1.7103 0.2850223      2.505818  
1 1 1 16 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 21 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 0  o 2.6851 1.3461 -33.6703 29.462  -4.5707   43.069  -59.2637  40.391  3.1006 2.1310 2.2697 1.6451 -0.000000      0.000000  
1 1 1 16 22 1  o 4.4495 1.3597 23.524   22.326  16.711    32.366  29.710    30.837  4.2405 1.8888 4.6586 1.9563 -0.4180841     2.719359  
1 1 1 16 22 2  o 3.9974 1.2495 10.911   20.103  -1.9853   28.556  23.583    28.306  3.5922 1.6658 4.4026 1.8629 -0.8104422     2.499093  
1 1 1 16 22 3  o 3.9415 1.2532 8.6722   20.715  3.2671    28.985  14.315    29.615  3.7642 1.7209 4.1187 1.8221 -0.3545296     2.506310  
1 1 1 16 22 4  o 4.9003 1.3948 34.448   21.094  40.820    30.032  28.242    29.634  5.1687 2.0147 4.6319 1.9294 0.5368161      2.789581  
1 1 1 16 22 5  o 4.8501 1.3065 21.523   20.597  67.078    31.185  -13.7225  27.430  6.4391 2.1042 3.2612 1.5494 3.177872       2.613061  
1 1 1 16 22 6  o 7.3751 1.4121 82.708   22.328  116.716   33.594  55.797    29.884  8.9385 1.9352 5.8116 2.0568 3.126856       2.824131  
1 1 1 16 22 7  o 4.0848 1.3013 10.345   22.598  34.637    34.376  -8.1406   29.988  4.7265 2.0281 3.4430 1.6311 1.283543       2.602620  
1 1 1 16 22 8  o 4.2154 1.2869 19.894   21.536  -6.6107   33.317  38.916    28.225  3.5589 1.6955 4.8719 1.9365 -1.313036      2.573880  
1 1 1 16 22 9  o 6.7593 1.5615 88.536   24.777  77.555    35.940  98.482    34.203  6.1335 2.2446 7.3851 2.1714 -1.251581      3.122974  
1 1 1 16 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 22 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 0  o 5.3458 1.7040 36.530   30.999  118.624   43.357  -49.3185  44.338  8.2151 2.9031 2.4766 1.7850 -0.000000      0.000000  
1 1 1 16 23 1  o 3.8702 1.2234 2.0739   20.551  35.216    30.566  -25.2669  27.762  4.7522 1.9679 2.9881 1.4540 1.764163       2.446750  
1 1 1 16 23 2  o 4.2038 1.3109 20.163   21.665  13.623    33.186  25.021    28.602  4.0615 1.8508 4.3461 1.8569 -0.2846684     2.621808  
1 1 1 16 23 3  f 7.2907 1.4981 90.138   23.409  79.913    33.409  100.000   32.810  6.6936 2.1774 7.8877 2.0581 -1.194048      2.996144  
1 1 1 16 23 4  o 4.2782 1.3262 22.551   21.967  36.978    32.085  9.8198    30.139  4.7231 1.9901 3.8332 1.7534 0.8899946      2.652347  
1 1 1 16 23 5  o 5.4328 1.4631 53.155   22.289  73.415    33.846  37.639    29.618  6.1505 2.1876 4.7152 1.9434 1.435337       2.926182  
1 1 1 16 23 6  o 4.1439 1.3047 19.483   22.962  -3.8877   33.022  41.361    31.951  3.5237 1.6813 4.7640 1.9955 -1.240284      2.609407  
1 1 1 16 23 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 23 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 24 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 25 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 26 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 27 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 28 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 29 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 29 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 16 29 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 1  0  o 17.887 0.8046 323.504  28.651  0.0000    0.0000  323.504   28.651  17.887 0.8046 17.887 0.8046 -0.000000      0.000000  
1 1 1 17 1  1  f 6.5397 0.8486 46.596   10.498  33.677    15.877  56.630    13.993  5.6067 1.4157 7.4727 0.9363 -1.866034      1.697254  
1 1 1 17 1  2  o 8.0570 1.0512 63.779   13.401  77.145    30.534  60.590    14.915  8.3907 1.8676 7.7233 0.9656 0.6674595      2.102418  
1 1 1 17 1  3  o 12.135 0.8482 158.162  16.441  138.976   35.366  163.452   18.569  11.546 1.5315 12.724 0.7297 -1.177701      1.696500  
1 1 1 17 1  4  o 18.923 0.6816 350.837  22.012  391.154   46.038  338.890   25.062  19.520 1.1793 18.327 0.6837 1.192476       1.363151  
1 1 1 17 1  5  o 11.973 0.8406 149.334  16.614  143.561   35.024  151.010   18.872  11.728 1.4932 12.217 0.7724 -0.4894810     1.681119  
1 1 1 17 1  6  o 15.912 0.7232 244.542  19.660  288.643   41.546  231.818   22.316  16.694 1.2444 15.131 0.7374 1.562752       1.446479  
1 1 1 17 1  7  o 7.9483 1.1692 81.774   14.724  48.205    33.049  90.086    16.446  6.5134 2.1680 9.3833 0.8763 -2.869884      2.338384  
1 1 1 17 1  8  o 13.265 0.8166 175.883  17.949  198.233   39.054  169.898   20.211  13.625 1.4332 12.904 0.7831 0.7204723      1.633175  
1 1 1 17 1  9  o 9.9982 0.9345 90.355   15.629  134.517   35.504  79.741    17.406  11.192 1.5861 8.8044 0.9885 2.387779       1.868919  
1 1 1 17 1  10 o 6.9352 1.2718 48.062   14.191  69.995    35.354  43.850    15.494  7.5402 2.2049 6.3302 1.2680 1.209968       2.543539  
1 1 1 17 1  11 o 7.5498 1.1984 64.678   14.326  63.513    34.049  64.929    15.792  7.1966 2.1786 7.9030 0.9991 -0.7063794     2.396814  
1 1 1 17 1  12 o 6.5982 1.0853 49.567   14.029  48.926    19.219  50.299    20.527  6.5693 1.4963 6.6270 1.5724 -0.5771923E-01 2.170518  
1 1 1 17 1  13 o 6.2340 1.0965 45.946   14.293  62.419    19.602  27.245    20.885  7.4951 1.3576 4.9730 1.7224 2.522150       2.193098  
1 1 1 17 1  14 o 9.7504 0.8679 104.306  16.639  116.732   22.663  89.773    24.508  10.472 1.0820 9.0285 1.3573 1.443813       1.735784  
1 1 1 17 1  15 o 4.8918 1.1209 26.497   13.496  39.619    18.661  12.108    19.541  5.8074 1.5694 3.9762 1.6007 1.831232       2.241716  
1 1 1 17 1  16 o 9.8767 0.8787 107.783  16.990  128.685   23.742  85.843    24.324  10.972 1.0820 8.7818 1.3849 2.189741       1.757430  
1 1 1 17 1  17 o 8.1923 0.9910 74.654   15.739  61.903    21.472  89.462    23.139  7.3213 1.5163 9.0633 1.2765 -1.741945      1.982076  
1 1 1 17 1  18 o 4.1010 1.0865 10.893   14.060  30.534    19.061  -12.5451  20.822  5.1327 1.6424 3.0693 1.4230 2.063435       2.173089  
1 1 1 17 1  19 o 10.754 0.8357 124.906  17.936  122.310   24.485  127.911   26.347  10.656 1.1489 10.852 1.2139 -0.1962023     1.671343  
1 1 1 17 1  20 o 3.0748 0.9983 -10.0569 13.997  -7.2052   18.928  -13.4990  20.795  3.0979 1.4063 3.0518 1.4174 0.4614377E-01  1.996696  
1 1 1 17 1  21 o 6.8139 1.2647 60.373   18.796  78.457    23.863  30.816    30.507  8.3030 1.4918 5.3249 2.0427 2.978109       2.529474  
1 1 1 17 1  22 o 10.928 0.9160 132.235  19.592  147.668   26.397  113.309   29.233  11.762 1.1222 10.093 1.4482 1.668748       1.832053  
1 1 1 17 1  23 o 6.3133 1.2625 50.741   17.895  69.531    24.483  29.188    26.221  7.5882 1.6594 5.0383 1.9031 2.549908       2.524953  
1 1 1 17 1  24 o 16.395 0.7671 291.280  25.087  289.382   34.233  293.481   36.871  16.384 1.0447 16.406 1.1237 -0.2272606E-01 1.534289  
1 1 1 17 1  25 o 9.1434 1.2059 104.461  21.252  72.565    28.393  145.103   32.050  7.2461 1.9261 11.041 1.4514 -3.794559      2.411752  
1 1 1 17 1  26 o 4.3657 1.2773 22.331   19.434  35.187    24.933  2.4284    31.022  4.9266 1.8570 3.8047 1.7544 1.121907       2.554677  
1 1 1 17 1  27 o 5.2958 1.3454 49.138   20.302  67.312    26.904  25.100    30.941  6.3670 1.9387 4.2247 1.8660 2.142343       2.690791  
1 1 1 17 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 2  0  o 6.0400 1.7627 53.296   21.151  55.820    29.981  50.795    29.843  6.2295 2.4855 5.8505 2.5001 -0.000000      0.000000  
1 1 1 17 2  1  o 18.468 0.6049 345.861  22.341  346.361   31.674  345.367   31.516  18.481 0.8569 18.455 0.8539 0.2561569E-01  1.209720  
1 1 1 17 2  2  f 16.255 0.6240 268.408  20.260  283.349   28.657  253.477   28.648  16.714 0.8573 15.796 0.9068 0.9187918      1.247902  
1 1 1 17 2  3  o 4.6051 1.1987 16.293   11.580  24.735    28.431  14.614    12.680  5.3041 1.9862 3.9061 1.3426 1.397936       2.397381  
1 1 1 17 2  4  o 18.450 0.6858 332.218  21.736  377.308   45.204  318.658   24.790  19.141 1.1808 17.759 0.6980 1.382496       1.371671  
1 1 1 17 2  5  f 4.9812 1.1413 28.015   12.778  3.6294    29.428  33.680    14.185  4.3851 1.8788 5.5774 1.2963 -1.192232      2.282640  
1 1 1 17 2  6  o 9.8064 0.9615 87.889   15.143  127.718   36.215  79.450    16.670  10.825 1.6727 8.7874 0.9485 2.037976       1.922921  
1 1 1 17 2  7  o 19.903 0.7221 412.095  23.954  404.544   50.044  414.340   27.282  19.599 1.2767 20.206 0.6751 -0.6063614     1.444187  
1 1 1 17 2  8  o 17.542 0.7401 317.747  21.619  317.132   45.444  317.927   24.579  17.379 1.3075 17.706 0.6941 -0.3274364     1.480286  
1 1 1 17 2  9  o 6.5725 1.1588 57.479   14.707  22.225    32.821  66.336    16.451  5.1630 2.0759 7.9821 1.0305 -2.819087      2.317634  
1 1 1 17 2  10 o 13.017 0.8994 184.846  18.741  170.317   40.363  188.839   21.160  12.447 1.6215 13.587 0.7787 -1.140347      1.798730  
1 1 1 17 2  11 o 6.4660 1.2977 39.735   14.260  70.577    34.389  33.330    15.671  7.4996 2.1693 5.4324 1.4247 2.067208       2.595358  
1 1 1 17 2  12 o 3.9775 1.1370 11.908   13.193  -15.4886  31.648  17.671    14.515  3.8146 1.7636 4.1404 1.4357 -0.3257630     2.274085  
1 1 1 17 2  13 o 11.111 0.9470 124.989  17.447  154.833   38.451  117.252   19.578  11.630 1.6531 10.591 0.9243 1.038493       1.893970  
1 1 1 17 2  14 o 8.2685 1.2326 77.433   16.324  86.266    36.985  75.296    18.192  8.1182 2.2159 8.4188 1.0804 -0.3006487     2.465281  
1 1 1 17 2  15 o 6.7514 1.1622 65.826   15.979  22.060    34.225  78.026    18.070  4.9574 2.0700 8.5454 1.0573 -3.587930      2.324365  
1 1 1 17 2  16 o 5.6487 1.0732 44.497   15.320  -15.2956  34.365  59.327    17.115  3.8832 1.8097 7.4143 1.1542 -3.531106      2.146428  
1 1 1 17 2  17 o 7.0364 1.2468 64.695   16.139  43.030    35.902  70.182    18.067  5.9554 2.2315 8.1173 1.1129 -2.161897      2.493631  
1 1 1 17 2  18 o 6.4780 1.1501 61.184   16.457  5.5990    36.624  75.246    18.421  4.5613 2.0216 8.3946 1.0972 -3.833305      2.300191  
1 1 1 17 2  19 o 4.7948 1.1640 26.693   15.493  -20.5866  34.477  38.657    17.343  3.8115 1.7881 5.7781 1.4908 -1.966594      2.328037  
1 1 1 17 2  20 o 7.5109 1.2630 77.805   17.688  42.097    37.742  87.856    20.023  5.9336 2.2731 9.0883 1.1016 -3.154665      2.525927  
1 1 1 17 2  21 o 5.5230 1.4040 33.658   17.048  38.235    39.275  32.596    18.924  5.7685 2.2870 5.2776 1.6293 0.4909501      2.808043  
1 1 1 17 2  22 o 7.1231 1.3136 68.441   18.913  38.913    39.403  77.280    21.558  5.8143 2.2953 8.4318 1.2784 -2.617527      2.627292  
1 1 1 17 2  23 o 3.6414 1.1953 -6.3692  16.710  -3.8270   37.530  -6.9977   18.661  4.2550 1.9501 3.0277 1.3829 1.227330       2.390676  
1 1 1 17 2  24 o 10.382 1.4005 132.744  26.381  166.171   48.459  118.665   31.451  10.786 2.3156 9.9784 1.5759 0.8077211      2.800965  
1 1 1 17 2  25 o 14.238 1.1515 255.768  30.315  277.048   53.922  245.934   36.656  14.026 1.9222 14.450 1.2683 -0.4245558     2.302974  
1 1 1 17 2  26 o 4.8251 1.4867 32.470   24.798  59.525    45.549  21.073    29.564  5.3999 2.3260 4.2503 1.8521 1.149635       2.973340  
1 1 1 17 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 3  0  o 4.8663 1.7213 37.057   20.489  39.556    29.446  34.711    28.528  5.0249 2.4653 4.7078 2.4030 -0.000000      0.000000  
1 1 1 17 3  1  o 8.4778 0.9835 78.933   15.596  53.637    22.547  102.137   21.595  6.9823 1.6422 9.9733 1.0826 -2.991002      1.966910  
1 1 1 17 3  2  o 17.691 0.6265 320.648  21.954  269.324   30.941  372.681   31.154  16.231 0.9531 19.150 0.8134 -2.918901      1.253039  
1 1 1 17 3  3  o 6.8470 1.0573 52.114   15.098  81.278    21.339  22.875    21.366  8.8436 1.2065 4.8505 1.7368 3.993098       2.114680  
1 1 1 17 3  4  o 18.606 0.6152 353.986  22.880  343.874   31.679  365.013   33.080  18.331 0.8641 18.880 0.8760 -0.5490227     1.230462  
1 1 1 17 3  5  o 7.4468 1.0254 59.684   14.914  46.940    20.158  75.095    22.167  6.4690 1.5732 8.4245 1.3156 -1.955556      2.050841  
1 1 1 17 3  6  o 4.1395 0.9765 16.451   12.131  -45.8085  28.581  30.133    13.398  3.0199 1.4708 5.2590 1.2848 -2.239073      1.952935  
1 1 1 17 3  7  o 7.6017 1.1739 57.451   14.379  75.548    33.434  53.344    15.928  8.0339 2.0685 7.1695 1.1108 0.8643947      2.347855  
1 1 1 17 3  8  o 5.4994 1.2352 20.988   12.948  63.763    30.743  11.764    14.276  7.2852 2.0328 3.7135 1.4038 3.571744       2.470417  
1 1 1 17 3  9  o 6.7335 1.1706 59.308   14.822  27.850    32.569  67.526    16.646  5.4092 2.1009 8.0578 1.0329 -2.648642      2.341116  
1 1 1 17 3  10 o 6.0198 1.3184 44.198   17.133  32.121    33.171  48.593    20.009  5.5280 2.1277 6.5115 1.5574 -0.9835143     2.636801  
1 1 1 17 3  11 o 7.7315 1.1616 89.815   15.870  25.862    35.335  105.976   17.763  5.3376 2.1512 10.125 0.8771 -4.787735      2.323162  
1 1 1 17 3  12 o 8.8327 1.1791 88.154   15.876  93.079    36.759  87.025    17.603  8.5496 2.1515 9.1159 0.9655 -0.5662260     2.358186  
1 1 1 17 3  13 o 7.8892 1.2059 63.669   15.631  95.853    34.957  55.626    17.476  8.7168 2.0411 7.0616 1.2847 1.655130       2.411739  
1 1 1 17 3  14 o 9.7062 1.1947 114.883  17.906  101.661   38.405  118.556   20.241  8.7979 2.1910 10.615 0.9535 -1.816634      2.389426  
1 1 1 17 3  15 o 6.7696 1.3159 41.516   15.581  94.704    36.021  29.273    17.281  8.5294 2.1206 5.0099 1.5587 3.519580       2.631832  
1 1 1 17 3  16 o 8.7172 1.2235 91.392   17.334  85.251    36.706  93.155    19.664  8.0587 2.2108 9.3758 1.0487 -1.317066      2.446906  
1 1 1 17 3  17 f 7.4960 1.2827 65.531   16.195  69.787    37.080  64.528    18.003  7.2338 2.2881 7.7583 1.1602 -0.5244856     2.565474  
1 1 1 17 3  18 o 11.177 1.0458 132.188  19.172  157.345   42.240  125.661   21.516  11.452 1.8442 10.903 0.9867 0.5496960      2.091551  
1 1 1 17 3  19 o 11.221 1.1374 152.451  19.655  123.094   40.317  161.604   22.511  9.9748 2.0879 12.467 0.9028 -2.491874      2.274755  
1 1 1 17 3  20 o 3.1251 1.0526 -15.6987 15.130  -37.2019  33.891  -10.3465  16.908  3.4545 1.6627 2.7958 1.2913 0.6586823      2.105268  
1 1 1 17 3  21 o 15.368 0.9701 267.028  23.682  247.457   51.049  272.395   26.733  14.535 1.7560 16.201 0.8250 -1.665639      1.940190  
1 1 1 17 3  22 o 4.8285 1.3508 23.142   16.970  24.019    37.297  22.913    19.057  5.1021 2.1476 4.5548 1.6392 0.5473723      2.701669  
1 1 1 17 3  23 o 10.247 1.3481 139.995  21.264  115.975   45.891  146.562   23.995  8.8060 2.4930 11.687 1.0266 -2.881189      2.696102  
1 1 1 17 3  24 f 4.2441 1.3415 6.1514   18.001  30.005    42.813  1.0293    19.839  5.1312 2.2325 3.3570 1.4879 1.774182       2.682925  
1 1 1 17 3  25 o 5.6581 1.4059 50.241   19.337  43.806    42.189  51.953    21.757  5.1722 2.2332 6.1440 1.7086 -0.9717903     2.811851  
1 1 1 17 3  26 o 3.2928 1.1332 -11.2916 17.871  -8.1462   42.920  -11.9514  19.657  3.8228 1.8477 2.7628 1.3123 1.060055       2.266310  
1 1 1 17 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 3  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 4  0  o 13.225 1.0337 186.964  26.485  187.775   37.748  186.177   37.171  13.249 1.4709 13.201 1.4527 -0.000000      0.000000  
1 1 1 17 4  1  o 7.4426 1.0382 62.310   15.074  89.235    21.352  35.559    21.284  9.2447 1.1548 5.6405 1.7257 3.604261       2.076477  
1 1 1 17 4  2  o 12.141 0.7375 153.173  17.696  125.119   24.653  182.994   25.417  10.956 1.1251 13.326 0.9537 -2.370318      1.474923  
1 1 1 17 4  3  o 5.1695 1.1814 27.613   14.232  18.021    19.082  39.637    21.366  4.4124 1.6321 5.9266 1.7087 -1.514157      2.362875  
1 1 1 17 4  4  o 12.053 0.7451 149.242  17.830  125.955   24.275  176.524   26.275  11.020 1.1014 13.086 1.0039 -2.065691      1.490244  
1 1 1 17 4  5  o 15.997 0.6342 261.738  20.284  255.347   28.340  268.453   29.046  15.796 0.8970 16.197 0.8967 -0.4004602     1.268337  
1 1 1 17 4  6  o 9.2688 0.8706 90.360   16.130  94.304    23.224  86.685    22.421  9.4656 1.2268 9.0719 1.2357 0.3937473      1.741261  
1 1 1 17 4  7  o 10.688 0.7988 119.947  17.035  110.836   24.068  129.094   24.116  10.261 1.1728 11.114 1.0849 -0.8530998     1.597628  
1 1 1 17 4  8  o 5.9373 1.1730 40.100   14.661  48.622    20.936  31.899    20.538  6.5344 1.6120 5.3403 1.7044 1.194125       2.345922  
1 1 1 17 4  9  o 9.4543 0.9844 86.657   15.545  118.041   34.669  78.759    17.392  10.227 1.6950 8.6818 1.0016 1.544996       1.968834  
1 1 1 17 4  10 o 12.600 0.8459 149.094  18.349  210.432   39.536  132.257   20.715  13.905 1.4216 11.295 0.9170 2.610686       1.691720  
1 1 1 17 4  11 f 5.1182 1.2251 29.473   17.805  -14.1686  33.382  46.824    21.049  3.9219 1.8125 6.3145 1.6488 -2.392613      2.450243  
1 1 1 17 4  12 o 5.8395 1.2455 41.491   14.522  35.306    31.444  43.167    16.372  5.5171 2.0840 6.1618 1.3645 -0.6446762     2.490968  
1 1 1 17 4  13 o 9.1495 1.1120 81.205   16.601  126.599   37.498  70.139    18.514  10.206 1.9072 8.0931 1.1438 2.112845       2.223928  
1 1 1 17 4  14 o 6.2043 1.3214 44.027   15.122  55.058    34.943  41.485    16.774  6.4222 2.2276 5.9863 1.4221 0.4358926      2.642836  
1 1 1 17 4  15 o 4.9546 1.1240 31.310   14.676  -18.5026  34.229  42.530    16.245  3.8103 1.7857 6.0988 1.3658 -2.288427      2.248089  
1 1 1 17 4  16 o 3.8676 1.1983 4.3187   14.282  4.2139    33.580  4.3419    15.780  4.4137 1.9470 3.3215 1.3974 1.092186       2.396557  
1 1 1 17 4  17 o 12.924 0.9210 174.384  20.141  200.709   42.418  166.721   22.886  13.228 1.6033 12.619 0.9068 0.6095829      1.841970  
1 1 1 17 4  18 o 3.6144 1.1803 -9.2604  14.930  6.3422    35.305  -12.6583  16.476  4.5567 2.0038 2.6720 1.2479 1.884686       2.360559  
1 1 1 17 4  19 o 3.8440 1.5093 12.132   16.952  0.0000    0.0000  12.132    16.952  ?      ?      3.8440 1.5093 ?              ?         
1 1 1 17 4  20 o 6.0824 1.3683 44.780   16.973  42.479    37.406  45.376    19.047  5.9252 2.2646 6.2396 1.5365 -0.3144269     2.736603  
1 1 1 17 4  21 o 5.1031 1.2376 31.671   16.449  -13.6288  39.158  41.377    18.125  4.2300 1.9577 5.9762 1.5145 -1.746240      2.475177  
1 1 1 17 4  22 o 3.3111 1.1146 -13.8321 15.656  -15.0190  35.738  -13.5502  17.416  3.9176 1.8323 2.7046 1.2695 1.213007       2.229110  
1 1 1 17 4  23 o 5.8184 1.4575 42.909   18.763  49.096    42.681  41.427    20.889  5.8956 2.3684 5.7411 1.6994 0.1544991      2.915057  
1 1 1 17 4  24 o 6.3842 1.4763 43.459   19.400  111.978   41.853  24.709    21.894  8.2724 2.3933 4.4960 1.7291 3.776425       2.952583  
1 1 1 17 4  25 o 6.2034 1.5510 52.054   20.323  106.738   45.011  38.051    22.777  7.2915 2.5283 5.1153 1.7971 2.176147       3.101946  
1 1 1 17 4  26 o 4.2226 1.3125 24.757   19.754  17.730    46.956  26.269    21.775  4.1953 2.0026 4.2500 1.6972 -0.5466890E-01 2.625088  
1 1 1 17 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 5  0  o 5.1722 1.7623 42.425   21.102  44.401    30.929  40.704    28.862  5.2802 2.5360 5.0642 2.4478 -0.000000      0.000000  
1 1 1 17 5  1  o 5.1080 1.1982 27.342   14.452  33.262    20.400  21.377    20.477  5.5063 1.6903 4.7097 1.6987 0.7966404      2.396426  
1 1 1 17 5  2  o 4.1736 1.1434 11.486   14.161  1.0128    19.763  22.538    20.302  3.5728 1.5355 4.7745 1.6947 -1.201660      2.286868  
1 1 1 17 5  3  o 4.3717 1.1685 16.534   13.973  15.119    19.205  18.125    20.369  4.2523 1.6232 4.4911 1.6812 -0.2387581     2.336983  
1 1 1 17 5  4  o 4.8056 1.0031 17.208   13.519  -13.9471  18.857  50.156    19.392  2.9039 1.3490 6.7074 1.4848 -3.803522      2.006134  
1 1 1 17 5  5  o 5.2735 1.1588 30.301   14.234  17.189    20.136  43.397    20.124  4.3780 1.6643 6.1691 1.6129 -1.791190      2.317602  
1 1 1 17 5  6  o 3.9619 1.1127 10.338   13.479  2.7784    19.456  17.316    18.692  3.5944 1.5336 4.3294 1.6126 -0.7349565     2.225330  
1 1 1 17 5  7  o 4.8042 1.1480 23.139   14.107  8.4892    19.997  37.653    19.904  3.8816 1.5980 5.7268 1.6486 -1.845228      2.296000  
1 1 1 17 5  8  o 17.465 0.6498 316.089  22.672  336.891   32.613  296.631   31.541  18.031 0.9044 16.900 0.9332 1.130766       1.299505  
1 1 1 17 5  9  o 11.218 0.8030 133.017  17.970  145.018   25.633  121.416   25.201  11.739 1.0918 10.698 1.1779 1.041184       1.606037  
1 1 1 17 5  10 o 5.9850 1.1877 42.462   14.925  36.328    21.749  47.922    20.519  5.5611 1.7517 6.4090 1.6045 -0.8479142     2.375464  
1 1 1 17 5  11 o 9.0521 0.9585 90.192   17.349  92.790    24.813  87.707    24.267  9.1823 1.3511 8.9219 1.3599 0.2603912      1.917007  
1 1 1 17 5  12 o 4.6576 1.2808 20.027   14.204  20.994    34.527  19.830    15.584  5.0143 2.0852 4.3009 1.4879 0.7133427      2.561571  
1 1 1 17 5  13 o 4.2392 1.2519 11.239   14.062  22.248    33.736  8.9235    15.470  4.9512 2.0602 3.5272 1.4228 1.424033       2.503741  
1 1 1 17 5  14 o 4.6178 1.2975 18.267   14.474  27.441    34.998  16.375    15.897  5.2004 2.1243 4.0351 1.4902 1.165310       2.594904  
1 1 1 17 5  15 o 5.7185 1.3000 41.060   16.356  22.199    36.547  45.784    18.289  5.1307 2.1404 6.3063 1.4762 -1.175635      2.600077  
1 1 1 17 5  16 o 5.3969 1.3718 27.371   15.930  51.990    35.332  21.090    17.847  6.3461 2.2375 4.4476 1.5878 1.898493       2.743648  
1 1 1 17 5  17 o 12.874 0.9529 184.364  20.031  179.359   42.261  185.814   22.749  12.393 1.7050 13.355 0.8517 -0.9614344     1.905899  
1 1 1 17 5  18 o 4.4994 1.3161 5.8631   15.976  38.414    35.968  -2.1376   17.832  5.7990 2.2196 3.1997 1.4148 2.599321       2.632132  
1 1 1 17 5  19 o 7.2425 1.3226 64.630   17.733  57.640    37.712  66.614    20.093  6.6490 2.3138 7.8360 1.2821 -1.187007      2.645240  
1 1 1 17 5  20 f 13.297 1.0477 209.909  21.844  174.741   46.134  220.072   24.800  12.050 1.9142 14.544 0.8526 -2.493959      2.095485  
1 1 1 17 5  21 o 7.7250 1.3305 75.530   18.055  70.453    39.509  76.870    20.299  7.0530 2.3706 8.3970 1.2087 -1.343987      2.660973  
1 1 1 17 5  22 o 8.6135 1.3527 106.317  19.109  73.585    44.466  113.732   21.163  6.9296 2.5026 10.297 1.0276 -3.367899      2.705346  
1 1 1 17 5  23 f 4.3235 1.3524 0.0033   16.898  49.114    42.799  -9.0662   18.392  5.7563 2.3501 2.8907 1.3392 2.865600       2.704864  
1 1 1 17 5  24 o 4.7699 1.3855 29.060   17.806  41.150    43.744  26.659    19.494  5.0495 2.2251 4.4903 1.6516 0.5592642      2.771065  
1 1 1 17 5  25 o 4.7199 1.4132 28.431   18.270  55.855    46.982  23.544    19.831  5.2182 2.3024 4.2217 1.6395 0.9964423      2.826449  
1 1 1 17 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 6  0  o 3.7724 1.5784 19.137   20.930  10.978    30.687  26.233    28.620  3.4496 2.1588 4.0952 2.3031 -0.000000      0.000000  
1 1 1 17 6  1  o 3.9677 1.1145 8.1100   14.125  21.983    19.889  -6.0086   20.064  4.6604 1.6749 3.2751 1.4709 1.385271       2.229082  
1 1 1 17 6  2  o 9.2239 0.9778 95.376   16.821  117.146   22.922  69.970    24.763  10.588 1.0825 7.8600 1.6287 2.727860       1.955650  
1 1 1 17 6  3  o 11.447 0.7674 136.673  17.562  132.141   24.493  141.467   25.194  11.250 1.0885 11.644 1.0819 -0.3932247     1.534721  
1 1 1 17 6  4  o 3.9371 1.1137 10.366   13.414  14.567    18.147  5.3047    19.919  4.1295 1.5775 3.7447 1.5724 0.3848445      2.227359  
1 1 1 17 6  5  o 13.996 0.7072 203.793  19.758  187.091   27.503  221.608   28.404  13.389 1.0270 14.604 0.9725 -1.214423      1.414422  
1 1 1 17 6  6  o 7.3809 1.1064 62.160   15.828  65.468    22.511  58.926    22.259  7.5962 1.5346 7.1655 1.5943 0.4307461      2.212834  
1 1 1 17 6  7  o 3.5913 1.0851 3.1300   13.829  4.8811    19.598  1.3937    19.515  3.6731 1.5520 3.5095 1.5171 0.1636362      2.170272  
1 1 1 17 6  8  o 10.010 0.9273 109.934  17.208  150.763   24.969  72.994    23.749  11.990 1.0413 8.0298 1.5348 3.959785       1.854663  
1 1 1 17 6  9  o 11.706 0.7725 145.398  18.084  143.980   25.557  146.821   25.594  11.646 1.0972 11.766 1.0876 -0.1203060     1.544907  
1 1 1 17 6  10 o 4.7516 1.1781 21.879   14.741  39.812    22.039  7.3624    19.829  5.7513 1.7554 3.7518 1.5718 1.999413       2.356296  
1 1 1 17 6  11 o 8.8123 0.9323 84.912   16.418  82.518    23.427  87.222    23.015  8.6716 1.3508 8.9530 1.2853 -0.2813520     1.864583  
1 1 1 17 6  12 o 4.8080 1.3142 5.0773   17.202  60.252    35.239  -12.1823  19.709  6.6538 2.2388 2.9622 1.3772 3.691587       2.628493  
1 1 1 17 6  13 o 11.293 0.8247 138.130  18.553  125.893   26.352  150.157   26.126  10.752 1.2255 11.834 1.1038 -1.082088      1.649325  
1 1 1 17 6  14 o 5.8268 1.3131 43.959   18.450  14.706    36.100  54.302    21.465  4.8507 2.0797 6.8029 1.6038 -1.952248      2.626278  
1 1 1 17 6  15 f 6.5040 1.3336 46.693   16.045  64.332    34.221  41.723    18.165  7.0158 2.1952 5.9922 1.5149 1.023652       2.667208  
1 1 1 17 6  16 o 5.6212 1.3986 32.102   16.351  55.811    36.970  26.337    18.231  6.4478 2.2871 4.7947 1.6103 1.653147       2.797141  
1 1 1 17 6  17 o 4.4599 1.0880 20.121   15.100  -58.5437  36.524  36.340    16.584  3.2861 1.6134 5.6337 1.4599 -2.347581      2.175906  
1 1 1 17 6  18 o 3.8750 1.1874 6.5856   14.835  -17.8041  36.344  11.462    16.250  3.9867 1.8590 3.7633 1.4777 0.2233858      2.374761  
1 1 1 17 6  19 f 8.9747 1.2903 94.851   18.202  98.873    41.294  93.881    20.279  8.5556 2.3440 9.3937 1.0794 -0.8380289     2.580557  
1 1 1 17 6  20 o 8.8741 1.2666 127.651  19.426  34.640    43.928  150.264   21.659  5.7450 2.3672 12.003 0.9022 -6.258177      2.533288  
1 1 1 17 6  21 o 7.8407 1.3271 80.885   17.963  69.572    40.417  83.670    20.053  6.9050 2.3957 8.7763 1.1424 -1.871252      2.654190  
1 1 1 17 6  22 f 4.8283 1.4184 18.158   16.815  44.972    44.223  13.626    18.181  5.7570 2.3740 3.8997 1.5529 1.857330       2.836753  
1 1 1 17 6  23 o 9.5337 1.3649 129.961  20.230  110.541   45.390  134.775   22.599  7.9833 2.5323 11.084 1.0194 -3.100928      2.729758  
1 1 1 17 6  24 o 7.1784 1.3223 85.558   19.063  57.982    47.412  90.875    20.820  5.4929 2.3696 8.8638 1.1744 -3.370883      2.644645  
1 1 1 17 6  25 o 4.8503 1.4154 32.792   17.773  69.658    43.908  25.568    19.436  5.4500 2.3139 4.2506 1.6305 1.199361       2.830702  
1 1 1 17 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 6  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 7  0  o 6.0343 1.8106 56.730   22.182  55.368    32.052  57.982    30.730  5.9053 2.5944 6.1633 2.5262 -0.000000      0.000000  
1 1 1 17 7  1  f 4.4774 1.1973 18.594   14.752  21.794    20.708  15.296    21.020  4.6584 1.7039 4.2964 1.6825 0.3620391      2.394614  
1 1 1 17 7  2  o 3.8844 1.1343 8.2011   14.300  5.9633    19.673  10.708    20.823  3.7306 1.5644 4.0382 1.6428 -0.3076081     2.268553  
1 1 1 17 7  3  o 20.484 0.6195 433.708  25.360  411.457   35.456  457.015   36.287  19.936 0.8892 21.032 0.8627 -1.095833      1.238927  
1 1 1 17 7  4  o 3.8641 1.1359 7.2045   14.526  2.8958    19.913  12.106    21.238  3.6016 1.5444 4.1265 1.6661 -0.5248642     2.271819  
1 1 1 17 7  5  o 9.1892 0.9069 90.670   16.623  86.206    23.946  94.821    23.093  8.9429 1.3388 9.4354 1.2237 -0.4924889     1.813829  
1 1 1 17 7  6  o 4.5769 1.1908 20.669   14.530  26.182    20.214  14.775    20.901  4.9064 1.6947 4.2474 1.6733 0.6589613      2.381607  
1 1 1 17 7  7  o 7.6338 1.0971 66.707   16.178  66.055    22.986  67.347    22.774  7.5868 1.5668 7.6808 1.5362 -0.9396935E-01 2.194227  
1 1 1 17 7  8  o 7.5937 1.0798 67.697   16.016  89.102    22.349  45.097    22.965  9.0779 1.2310 6.1096 1.7743 2.968348       2.159526  
1 1 1 17 7  9  o 5.1411 1.2408 30.607   15.314  29.584    22.154  31.544    21.191  5.0824 1.7731 5.1998 1.7362 -0.1174207     2.481622  
1 1 1 17 7  10 o 9.0521 1.0284 95.376   17.342  68.150    25.465  118.922   23.682  7.5536 1.7237 10.550 1.1223 -2.996879      2.056838  
1 1 1 17 7  11 o 4.1720 1.0675 4.4417   14.648  40.211    21.378  -27.2158  20.112  5.7413 1.7237 2.6027 1.2596 3.138571       2.134904  
1 1 1 17 7  12 o 4.5840 1.1584 19.756   15.338  -2.6987   22.722  38.551    20.788  3.5172 1.5734 5.6508 1.7005 -2.133646      2.316739  
1 1 1 17 7  13 o 3.6635 1.0938 1.2416   14.877  -16.8046  21.678  17.305    20.453  3.0163 1.4159 4.3107 1.6675 -1.294377      2.187564  
1 1 1 17 7  14 o 6.2499 1.2312 47.403   16.544  33.031    23.961  60.497    22.870  5.3257 1.8448 7.1741 1.6309 -1.848351      2.462329  
1 1 1 17 7  15 f 4.3221 1.1219 7.2110   16.071  -27.2391  22.811  41.162    22.645  2.8376 1.3654 5.8066 1.7807 -2.968977      2.243887  
1 1 1 17 7  16 o 6.2342 1.3111 48.737   15.903  36.756    37.846  51.306    17.525  5.7127 2.2513 6.7557 1.3443 -1.042994      2.622134  
1 1 1 17 7  17 f 11.048 1.1577 137.914  19.423  142.414   43.450  136.790   21.714  10.666 2.1116 11.430 0.9499 -0.7639828     2.315419  
1 1 1 17 7  18 o 12.766 0.9580 169.945  20.204  195.423   43.949  163.117   22.751  13.032 1.6861 12.500 0.9100 0.5319481      1.916039  
1 1 1 17 7  19 f 7.8894 1.2126 98.706   18.548  17.989    41.631  118.696   20.717  5.1493 2.2209 10.630 0.9745 -5.480289      2.425273  
1 1 1 17 7  20 o 10.533 1.0296 118.452  21.690  0.0000    0.0000  118.452   21.690  ?      ?      10.533 1.0296 ?              ?         
1 1 1 17 7  21 o 8.5846 1.3081 116.376  19.295  52.218    44.826  130.966   21.377  6.0772 2.4322 11.092 0.9636 -5.014835      2.616147  
1 1 1 17 7  22 o 6.0358 1.1419 56.322   17.670  -12.8707  41.372  71.758    19.541  4.0828 1.9287 7.9888 1.2230 -3.906061      2.283819  
1 1 1 17 7  23 o 5.0291 1.4329 31.572   17.757  59.688    44.204  26.162    19.391  5.5964 2.3458 4.4619 1.6463 1.134488       2.865844  
1 1 1 17 7  24 o 2.8970 1.3151 -24.0867 15.309  -158.9318 40.333  -1.3886   16.548  ?      ?      2.8970 1.3151 ?              ?         
1 1 1 17 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 8  0  o 7.6069 1.7505 79.564   23.534  81.509    34.508  77.872    32.179  7.6528 2.5351 7.5609 2.4147 -0.000000      0.000000  
1 1 1 17 8  1  o 7.0353 1.1142 56.695   15.307  61.923    21.490  51.311    21.809  7.4094 1.5016 6.6611 1.6465 0.7483296      2.228370  
1 1 1 17 8  2  o 3.2754 1.0318 -6.5421  14.144  4.6107    19.667  -18.4904  20.356  3.6644 1.5518 2.8864 1.3603 0.7779536      2.063627  
1 1 1 17 8  3  o 7.2370 1.1310 60.003   15.957  53.126    22.228  67.317    22.922  6.7688 1.6556 7.7052 1.5413 -0.9364524     2.261985  
1 1 1 17 8  4  o 4.0131 1.1368 10.231   14.251  1.1728    19.834  19.899    20.491  3.5148 1.5244 4.5115 1.6868 -0.9967060     2.273526  
1 1 1 17 8  5  o 5.0210 1.2309 28.004   15.093  25.193    20.802  31.130    21.931  4.8222 1.7150 5.2198 1.7662 -0.3976417     2.461839  
1 1 1 17 8  6  o 2.9733 0.9736 -12.2031 13.759  -16.3552  19.246  -7.8632   19.676  2.8202 1.3271 3.1265 1.4249 -0.3062754     1.947229  
1 1 1 17 8  7  o 5.2802 1.2355 32.475   15.666  22.244    22.596  41.944    21.739  4.6564 1.7648 5.9040 1.7297 -1.247577      2.471096  
1 1 1 17 8  8  o 5.3603 1.1924 32.411   15.471  49.851    21.798  14.707    21.963  6.4768 1.6715 4.2438 1.7010 2.233097       2.384829  
1 1 1 17 8  9  o 7.3801 1.1434 64.709   16.411  58.931    23.791  69.953    22.668  6.9858 1.7154 7.7744 1.5123 -0.7886324     2.286794  
1 1 1 17 8  10 o 5.2387 1.2677 32.710   16.104  28.041    23.849  36.624    21.834  4.9774 1.8274 5.4999 1.7575 -0.5225639     2.535388  
1 1 1 17 8  11 o 4.1509 1.0920 6.6821   14.748  36.781    21.341  -20.8379  20.406  5.5172 1.7347 2.7847 1.3267 2.732567       2.183916  
1 1 1 17 8  12 o 5.1936 1.2132 30.402   16.073  11.025    24.014  46.130    21.635  4.1715 1.7372 6.2157 1.6940 -2.044183      2.426414  
1 1 1 17 8  13 o 9.6609 0.9612 102.374  18.518  112.770   26.653  92.672    25.747  10.165 1.3111 9.1571 1.4058 1.007464       1.922302  
1 1 1 17 8  14 o 5.2596 1.1133 28.600   16.222  -8.9558   24.198  59.253    21.862  3.4235 1.5678 7.0957 1.5810 -3.672227      2.226563  
1 1 1 17 8  15 o 8.3697 1.3850 92.440   21.662  70.779    41.614  100.491   25.369  7.1621 2.4328 9.5774 1.3244 -2.415348      2.769967  
1 1 1 17 8  16 o 10.744 0.9165 125.654  19.548  108.778   27.503  142.883   27.788  9.9551 1.3814 11.533 1.2047 -1.577796      1.832903  
1 1 1 17 8  17 o 13.966 1.0818 200.975  27.624  176.901   32.325  266.171   53.194  12.782 1.2645 15.150 1.7556 -2.368487      2.163562  
1 1 1 17 8  18 o 4.7032 1.1093 7.7715   16.473  54.648    24.356  -31.7454  22.363  6.6948 1.7860 2.7116 1.3161 3.983218       2.218570  
1 1 1 17 8  19 o 5.4879 1.3952 32.452   16.414  44.266    38.254  29.787    18.172  5.9310 2.2844 5.0448 1.6024 0.8861589      2.790358  
1 1 1 17 8  20 o 11.637 1.2077 168.806  20.811  147.013   45.193  174.671   23.445  10.412 2.2369 12.861 0.9114 -2.449079      2.415447  
1 1 1 17 8  21 o 4.8947 1.3162 28.797   16.563  14.482    39.159  31.916    18.278  4.6970 2.0857 5.0924 1.6060 -0.3953748     2.632377  
1 1 1 17 8  22 o 6.9704 1.4621 66.099   18.235  91.298    45.793  61.351    19.878  6.9103 2.5329 7.0304 1.4614 -0.1200662     2.924277  
1 1 1 17 8  23 o 9.1868 1.3185 147.609  20.527  79.635    45.978  164.529   22.940  6.1601 2.4640 12.214 0.9391 -6.053381      2.636932  
1 1 1 17 8  24 o 4.0078 1.3162 4.3289   17.316  61.783    45.372  -5.4656   18.734  5.1596 2.2701 2.8560 1.3327 2.303550       2.632444  
1 1 1 17 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 8  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 9  0  o 3.5573 1.5065 10.041   21.627  -17.2846  31.646  33.987    29.625  2.6414 1.8182 4.4732 2.4025 -0.000000      0.000000  
1 1 1 17 9  1  o 4.9431 1.2072 25.021   15.420  41.205    22.388  10.412    21.271  5.8783 1.7637 4.0079 1.6488 1.870360       2.414412  
1 1 1 17 9  2  o 6.2217 1.1942 46.339   15.704  33.171    22.540  58.761    21.892  5.3349 1.7906 7.1084 1.5807 -1.773425      2.388488  
1 1 1 17 9  3  o 2.5654 0.8785 -27.7210 13.842  -29.7109  19.055  -25.4982  20.140  2.4684 1.2019 2.6624 1.2815 -0.1939471     1.756972  
1 1 1 17 9  4  o 9.2336 0.9247 93.126   17.064  89.688    23.605  96.890    24.696  9.0582 1.3030 9.4091 1.3124 -0.3508835     1.849324  
1 1 1 17 9  5  o 8.9587 0.9895 90.105   17.114  103.924   24.212  76.304    24.195  9.7908 1.2365 8.1265 1.5451 1.664241       1.978930  
1 1 1 17 9  6  o 5.0565 1.2141 28.035   15.230  40.450    21.944  16.496    21.156  5.8132 1.7466 4.2998 1.6868 1.513399       2.428132  
1 1 1 17 9  7  o 5.4025 1.1628 30.286   15.539  58.101    23.131  7.4093    20.977  6.9797 1.6778 3.8252 1.6103 3.154539       2.325532  
1 1 1 17 9  8  o 6.5571 1.2086 52.454   16.018  54.284    22.627  50.616    22.680  6.6854 1.6911 6.4287 1.7271 0.2567530      2.417161  
1 1 1 17 9  9  o 6.9807 1.1880 58.723   16.678  74.613    23.919  43.689    23.266  8.0001 1.5509 5.9613 1.8001 2.038845       2.376059  
1 1 1 17 9  10 o 3.5769 1.1178 -0.1947  15.708  -0.0525   22.803  -0.3230   21.669  3.6208 1.6005 3.5329 1.5610 0.8784223E-01  2.235639  
1 1 1 17 9  11 o 5.0162 1.2603 28.087   15.931  31.593    22.600  24.625    22.460  5.2282 1.7928 4.8043 1.7719 0.4239097      2.520642  
1 1 1 17 9  12 o 5.0678 1.1912 24.446   15.944  50.597    23.631  2.5954    21.600  6.4681 1.7736 3.6675 1.5907 2.800644       2.382471  
1 1 1 17 9  13 o 4.0623 1.1791 10.214   15.966  -2.2143   23.545  20.794    21.723  3.5964 1.6058 4.5283 1.7269 -0.9318445     2.358130  
1 1 1 17 9  14 o 7.6435 1.1235 72.743   17.872  27.927    25.984  112.976   24.620  5.0558 1.8977 10.231 1.2032 -5.175234      2.246947  
1 1 1 17 9  15 o 23.319 0.6573 568.106  30.608  540.717   43.664  594.565   42.917  22.733 0.9604 23.905 0.8977 -1.172005      1.314574  
1 1 1 17 9  16 o 6.3812 1.2471 46.431   17.441  73.437    26.412  25.552    23.224  7.8752 1.7247 4.8873 1.8019 2.987895       2.494281  
1 1 1 17 9  17 f 9.6962 1.0689 105.253  20.071  127.868   30.288  87.547    26.800  10.726 1.4119 8.6661 1.6054 2.060315       2.137887  
1 1 1 17 9  18 o 9.1319 1.1900 107.585  20.493  48.763    30.599  155.427   27.596  6.2172 2.0863 12.047 1.1454 -5.829428      2.379992  
1 1 1 17 9  19 o 9.9910 1.1108 118.882  20.995  94.487    30.661  140.419   28.809  8.7248 1.8162 11.257 1.2796 -2.532504      2.221688  
1 1 1 17 9  20 o 5.1730 1.3272 33.051   18.268  22.017    27.688  41.559    24.311  4.6649 1.8957 5.6811 1.8579 -1.016256      2.654334  
1 1 1 17 9  21 o 4.4336 1.3056 19.206   16.276  18.537    38.974  19.348    17.913  4.6995 2.0841 4.1677 1.5732 0.5317945      2.611203  
1 1 1 17 9  22 o 6.1274 1.5094 45.832   18.046  100.138   44.445  35.112    19.747  7.1876 2.5112 5.0672 1.6753 2.120427       3.018756  
1 1 1 17 9  23 o 8.1042 1.2211 127.316  20.412  44.322    48.739  144.968   22.478  4.8812 2.2316 11.327 0.9922 -6.446078      2.442247  
1 1 1 17 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 10 0  o 12.183 1.2455 168.234  28.475  174.997   41.315  162.115   39.299  12.422 1.7663 11.943 1.7566 -0.000000      0.000000  
1 1 1 17 10 1  o 11.531 0.8350 143.012  19.255  142.360   26.980  143.690   27.489  11.511 1.1720 11.552 1.1898 -0.4137230E-01 1.670055  
1 1 1 17 10 2  o 7.3601 1.1929 64.247   17.184  63.277    24.163  65.239    24.443  7.3017 1.6884 7.4186 1.6857 -0.1169634     2.385807  
1 1 1 17 10 3  o 4.7558 1.2233 23.851   15.464  31.737    21.250  14.975    22.545  5.2259 1.7384 4.2856 1.7215 0.9403038      2.446501  
1 1 1 17 10 4  o 14.466 0.7299 221.550  21.086  234.951   29.827  208.163   29.812  14.929 0.9990 14.003 1.0645 0.9254704      1.459845  
1 1 1 17 10 5  o 9.2975 1.0208 98.623   17.989  73.460    25.160  124.936   25.730  7.8618 1.6526 10.733 1.1986 -2.871418      2.041530  
1 1 1 17 10 6  o 9.7628 0.9211 105.536  17.908  97.470    25.676  113.176   24.989  9.3470 1.3735 10.179 1.2275 -0.8316860     1.842112  
1 1 1 17 10 7  o 4.5224 1.2070 20.649   15.178  27.486    21.218  13.485    21.722  4.9083 1.7335 4.1366 1.6798 0.7716675      2.413904  
1 1 1 17 10 8  o 6.4371 1.2259 50.895   16.365  41.430    23.521  59.777    22.784  5.8007 1.8208 7.0734 1.6421 -1.272721      2.451850  
1 1 1 17 10 9  o 3.7252 1.1313 4.3006   15.197  0.7212    22.349  7.3792    20.727  3.6383 1.5972 3.8120 1.6025 -0.1736896     2.262573  
1 1 1 17 10 10 o 11.413 0.8629 141.195  19.562  130.696   28.557  150.477   26.852  10.953 1.3037 11.874 1.1307 -0.9210253     1.725714  
1 1 1 17 10 11 f 11.249 0.8556 136.405  19.040  162.839   27.572  112.312   26.323  12.352 1.1161 10.146 1.2972 2.205434       1.711267  
1 1 1 17 10 12 o 3.0007 0.9852 -15.4943 14.752  -31.9911  22.064  -2.1590   19.837  2.6739 1.3000 3.3275 1.4807 -0.6535013     1.970385  
1 1 1 17 10 13 o 4.0702 1.2041 9.7354   16.321  9.6343    24.781  9.8128    21.688  4.1519 1.7492 3.9886 1.6551 0.1632547      2.408134  
1 1 1 17 10 14 o 15.572 0.7391 256.699  22.924  239.341   33.082  272.732   31.795  15.019 1.1014 16.125 0.9859 -1.105938      1.478190  
1 1 1 17 10 15 o 3.9275 1.1828 5.9677   16.469  -0.7779   24.631  11.422    22.148  3.7529 1.6609 4.1021 1.6844 -0.3492446     2.365559  
1 1 1 17 10 16 o 5.3480 1.2505 32.930   17.462  8.7050    26.741  50.939    23.057  4.2050 1.7961 6.4909 1.7404 -2.285856      2.500970  
1 1 1 17 10 17 o 13.538 0.8606 201.661  22.674  160.996   33.316  236.747   30.947  12.103 1.3764 14.974 1.0333 -2.871198      1.721106  
1 1 1 17 10 18 f 5.3716 1.1733 18.419   17.688  74.923    28.341  -17.6375  22.639  7.7095 1.8595 3.0337 1.4312 4.675802       2.346532  
1 1 1 17 10 19 o 10.556 1.0468 128.244  21.863  130.736   33.444  126.384   28.891  10.542 1.5863 10.571 1.3665 -0.2956676E-01 2.093688  
1 1 1 17 10 20 o 5.8378 1.6193 48.258   25.214  45.729    28.645  56.959    53.131  5.7303 2.0152 5.9453 2.5353 -0.2149858     3.238683  
1 1 1 17 10 21 o 7.3285 1.3590 80.213   20.349  71.432    30.675  87.115    27.195  6.6927 2.0758 7.9643 1.7547 -1.271633      2.718051  
1 1 1 17 10 22 o 4.7869 1.3814 35.707   21.506  15.318    44.967  41.754    24.488  4.3547 2.0426 5.2191 1.8603 -0.8644691     2.762795  
1 1 1 17 10 23 o 4.2448 1.3119 22.209   17.058  44.002    41.888  17.877    18.677  4.6997 2.1166 3.7900 1.5504 0.9096425      2.623743  
1 1 1 17 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 10 29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 11 0  o 21.377 0.9237 485.071  39.137  500.559   56.379  470.665   54.373  21.707 1.3096 21.048 1.3031 -0.000000      0.000000  
1 1 1 17 11 1  o 3.0859 1.0090 -12.8007 15.029  -2.4594   20.098  -25.9206  22.638  3.3270 1.4847 2.8448 1.3666 0.4822552      2.017906  
1 1 1 17 11 2  o 4.3697 1.1806 13.024   15.966  -7.2742   21.872  36.174    23.358  3.2914 1.5010 5.4480 1.8228 -2.156663      2.361243  
1 1 1 17 11 3  o 5.9774 1.2690 43.819   16.612  34.960    23.090  53.326    23.920  5.3794 1.8122 6.5754 1.7767 -1.196005      2.537908  
1 1 1 17 11 4  o 7.1008 1.1927 60.956   16.840  72.425    23.844  49.543    23.786  7.8627 1.5712 6.3389 1.7949 1.523777       2.385450  
1 1 1 17 11 5  o 3.8692 1.1451 5.6742   15.581  19.184    22.005  -7.9106   22.065  4.4437 1.7266 3.2947 1.5044 1.149036       2.290117  
1 1 1 17 11 6  o 10.956 0.8685 130.655  19.021  133.695   27.432  127.840   26.396  11.070 1.2390 10.841 1.2174 0.2294884      1.737021  
1 1 1 17 11 7  o 4.3946 1.2300 17.175   16.105  13.686    23.432  20.299    22.172  4.2534 1.7379 4.5358 1.7411 -0.2824383     2.460051  
1 1 1 17 11 8  o 4.0926 1.1592 10.769   15.247  -3.1474   22.077  23.459    21.082  3.4847 1.5555 4.7005 1.7193 -1.215803      2.318496  
1 1 1 17 11 9  o 8.2713 1.1163 79.590   17.842  107.429   25.582  53.223    24.896  9.9354 1.2874 6.6072 1.8241 3.328189       2.232640  
1 1 1 17 11 10 o 14.679 0.7528 229.125  22.062  246.781   31.494  212.113   30.914  15.261 1.0319 14.097 1.0965 1.163598       1.505671  
1 1 1 17 11 11 o 6.7885 1.2706 57.355   17.718  48.021    26.099  65.333    24.130  6.1862 1.9141 7.3908 1.6716 -1.204562      2.541227  
1 1 1 17 11 12 o 4.0565 1.1666 6.6289   16.208  -12.9694  23.239  25.192    22.617  3.2598 1.5085 4.8531 1.7799 -1.593332      2.333169  
1 1 1 17 11 13 o 3.8385 1.1719 2.3473   16.532  11.856    24.614  -5.4671   22.313  4.2519 1.7637 3.4251 1.5435 0.8267481      2.343732  
1 1 1 17 11 14 o 5.0451 1.3179 27.140   18.125  16.031    26.906  36.369    24.525  4.5430 1.8600 5.5473 1.8677 -1.004265      2.635897  
1 1 1 17 11 15 f 7.5760 1.3023 70.954   19.589  63.192    29.025  77.448    26.547  7.0777 1.9753 8.0744 1.6977 -0.9966931     2.604634  
1 1 1 17 11 16 o 3.1764 1.0515 -16.4815 16.549  -19.1523  25.466  -14.5290  21.774  3.2583 1.5312 3.0944 1.4416 0.1639147      2.103022  
1 1 1 17 11 17 o 6.0193 1.3903 46.580   19.111  46.973    29.737  46.303    24.945  5.9977 2.0564 6.0410 1.8716 -0.4330540E-01 2.780630  
1 1 1 17 11 18 o 15.563 0.8217 260.716  25.252  324.951   38.104  210.413   33.720  17.315 1.1003 13.811 1.2208 3.504744       1.643456  
1 1 1 17 11 19 o 7.7559 1.3532 79.442   20.704  86.095    31.656  74.469    27.370  7.9596 1.9930 7.5523 1.8310 0.4072914      2.706442  
1 1 1 17 11 20 o 3.5967 1.1957 -4.8293  20.521  -28.0431  42.356  2.2904    23.457  3.6845 1.7936 3.5089 1.5818 0.1756408      2.391456  
1 1 1 17 11 21 f 4.5285 1.3004 26.818   19.590  8.7790    30.440  39.572    25.596  3.9358 1.7855 5.1211 1.8910 -1.185274      2.600737  
1 1 1 17 11 22 o 3.8850 1.1976 14.648   18.535  -3.7844   28.107  28.831    24.655  3.3825 1.5954 4.3874 1.7866 -1.004844      2.395232  
1 1 1 17 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 0  o 11.481 1.4956 162.079  29.008  118.182   41.533  203.887   40.533  9.3731 2.5626 13.588 1.5428 -0.000000      0.000000  
1 1 1 17 12 1  o 5.9562 1.1341 41.583   16.941  74.263    23.199  4.2503    24.796  8.0102 1.5033 3.9022 1.6984 4.107944       2.268166  
1 1 1 17 12 2  o 8.6533 1.0748 85.739   18.175  83.773    24.791  88.023    26.725  8.6426 1.4343 8.6641 1.6013 -0.2155495E-01 2.149684  
1 1 1 17 12 3  o 9.5787 0.9595 101.685  18.332  105.151   25.364  97.895    26.526  9.7908 1.2953 9.3666 1.4160 0.4241714      1.919045  
1 1 1 17 12 4  o 3.4470 1.0705 -11.0596 15.574  -34.3458  21.295  15.719    22.837  2.5703 1.2557 4.3237 1.7340 -1.753408      2.140932  
1 1 1 17 12 5  o 3.9174 1.1512 7.1761   15.488  -5.2657   22.790  17.854    21.113  3.4611 1.5598 4.3737 1.6936 -0.9126930     2.302410  
1 1 1 17 12 6  o 5.8605 1.2955 41.212   17.579  27.063    25.291  54.437    24.450  5.0127 1.8740 6.7083 1.7894 -1.695600      2.591095  
1 1 1 17 12 7  o 3.9596 1.1805 6.8869   16.353  -2.8953   24.035  15.319    22.315  3.6290 1.6212 4.2902 1.7164 -0.6611664     2.361027  
1 1 1 17 12 8  o 3.6184 1.1412 -2.5842  16.797  1.4822    24.103  -6.4238   23.422  3.7792 1.6589 3.4576 1.5676 0.3215661      2.282395  
1 1 1 17 12 9  o 9.3108 1.0558 99.324   19.013  85.977    27.028  112.399   26.750  8.5288 1.6441 10.093 1.3252 -1.563939      2.111691  
1 1 1 17 12 10 o 9.8329 0.9989 107.291  19.611  99.487    27.381  115.510   28.100  9.4395 1.4503 10.226 1.3739 -0.7866926     1.997777  
1 1 1 17 12 11 o 5.0425 1.1989 22.512   17.442  -10.3812  25.456  51.622    23.947  3.5123 1.6083 6.5727 1.7785 -3.060412      2.397876  
1 1 1 17 12 12 o 4.1136 1.2250 7.8814   17.204  16.901    25.906  0.7652    23.011  4.5314 1.8365 3.6959 1.6216 0.8354411      2.449958  
1 1 1 17 12 13 o 12.087 0.9067 158.386  21.903  166.192   31.582  151.153   30.402  12.378 1.2757 11.795 1.2887 0.5827589      1.813343  
1 1 1 17 12 14 o 7.4340 1.2029 66.026   18.965  100.570   27.322  33.904    26.347  9.4938 1.4389 5.3742 1.9281 4.119624       2.405861  
1 1 1 17 12 15 o 12.175 0.9602 166.506  22.628  132.842   33.695  194.161   30.540  10.861 1.5512 13.489 1.1321 -2.627328      1.920340  
1 1 1 17 12 16 o 6.0157 1.3114 46.654   19.472  18.820    29.958  67.015    25.623  4.6673 1.9417 7.3641 1.7631 -2.696756      2.622722  
1 1 1 17 12 17 o 3.5714 1.1568 -6.9559  18.591  -8.9349   27.670  -5.3274   25.100  3.5989 1.6586 3.5439 1.6129 0.5500770E-01  2.313551  
1 1 1 17 12 18 o 5.4947 1.3906 38.294   19.824  55.602    29.739  24.453    26.595  6.3001 2.0546 4.6893 1.8746 1.610889       2.781281  
1 1 1 17 12 19 o 8.6833 1.2921 99.204   21.599  128.722   33.706  78.638    28.134  9.8530 1.7757 7.5135 1.8775 2.339490       2.584244  
1 1 1 17 12 20 o 3.0189 1.0261 -19.1033 17.172  -11.5806  28.247  -23.5138  21.628  3.3538 1.5872 2.6841 1.3008 0.6696835      2.052134  
1 1 1 17 12 21 o 5.7688 1.4094 53.859   20.263  79.722    31.481  35.563    26.478  6.7986 2.1019 4.7390 1.8781 2.059642       2.818761  
1 1 1 17 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 12 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 0  o 6.8302 1.8782 72.597   26.645  98.862    38.396  48.200    37.005  8.4618 2.5952 5.1986 2.7158 -0.000000      0.000000  
1 1 1 17 13 1  o 4.8841 1.3141 24.646   17.810  27.672    24.979  21.516    25.400  5.0385 1.8666 4.7297 1.8503 0.3088107      2.628229  
1 1 1 17 13 2  o 5.5367 1.3200 34.349   18.309  17.609    25.303  52.743    26.524  4.5368 1.8232 6.5366 1.9094 -1.999851      2.640058  
1 1 1 17 13 3  o 5.4914 1.3483 35.506   18.194  31.043    25.909  39.847    25.554  5.2379 1.9074 5.7449 1.9061 -0.5069823     2.696572  
1 1 1 17 13 4  f 10.512 0.9186 120.380  19.300  126.534   27.674  114.553   26.931  10.784 1.2831 10.240 1.3150 0.5440445      1.837269  
1 1 1 17 13 5  o 9.8595 0.9571 106.744  18.640  128.428   27.027  87.070    25.743  10.885 1.2415 8.8342 1.4570 2.050602       1.914221  
1 1 1 17 13 6  o 4.4978 1.3280 14.538   20.150  23.937    23.871  -8.7603   37.584  4.7732 1.8127 4.2224 1.9412 0.5508151      2.655924  
1 1 1 17 13 7  o 7.5860 1.2152 69.556   18.059  77.999    25.567  61.149    25.511  8.1243 1.6302 7.0476 1.8027 1.076724       2.430446  
1 1 1 17 13 8  o 4.8596 1.2584 23.405   17.540  2.7079    26.019  40.645    23.747  3.9390 1.7264 5.7802 1.8314 -1.841207      2.516873  
1 1 1 17 13 9  o 5.5782 1.2074 36.500   16.755  10.114    25.881  55.539    21.984  4.2563 1.7901 6.9000 1.6206 -2.643748      2.414724  
1 1 1 17 13 10 f 4.1264 1.1926 6.7107   16.596  26.067    24.405  -9.9390   22.635  4.9485 1.8427 3.3043 1.5144 1.644189       2.385134  
1 1 1 17 13 11 o 9.9303 1.0463 110.588  19.654  144.906   28.715  80.342    26.957  11.587 1.2391 8.2735 1.6864 3.313568       2.092654  
1 1 1 17 13 12 o 3.9965 1.2167 4.5490   17.874  -4.0856   25.538  12.839    25.024  3.6901 1.6582 4.3030 1.7811 -0.6128974     2.433471  
1 1 1 17 13 13 o 10.347 1.1279 127.201  21.554  88.137    31.435  161.860   29.610  8.4598 1.9039 12.235 1.2100 -3.775277      2.255878  
1 1 1 17 13 14 o 6.1620 1.4081 47.269   19.740  49.660    29.001  45.206    26.945  6.2807 2.0275 6.0433 1.9547 0.2374659      2.816289  
1 1 1 17 13 15 o 6.0303 1.3968 46.484   19.797  58.687    28.577  35.222    27.453  6.6968 1.9889 5.3639 1.9619 1.332921       2.793699  
1 1 1 17 13 16 o 4.7007 1.3416 20.439   19.949  34.151    28.857  7.8889    27.608  5.2787 1.9958 4.1228 1.7933 1.155853       2.683127  
1 1 1 17 13 17 o 3.2891 1.1041 -19.5725 19.588  -28.6370  30.427  -13.1568  25.598  3.2691 1.5740 3.3092 1.5487 -0.4005694E-01 2.208149  
1 1 1 17 13 18 o 4.9967 1.3954 34.119   20.662  29.432    32.691  37.237    26.663  4.8288 2.0202 5.1645 1.9255 -0.3356323     2.790842  
1 1 1 17 13 19 o 6.8589 1.4294 71.307   20.949  82.338    31.192  62.242    28.275  7.3434 2.0471 6.3743 1.9956 0.9691052      2.858795  
1 1 1 17 13 20 o 6.2451 1.4422 64.227   20.593  78.671    31.799  53.795    27.025  6.7717 2.1157 5.7186 1.9604 1.053178       2.884322  
1 1 1 17 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 13 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 0  o 4.7073 1.8676 39.402   26.510  43.105    38.675  36.121    36.410  4.8743 2.7011 4.5402 2.5799 -0.000000      0.000000  
1 1 1 17 14 1  o 16.398 0.7375 286.499  24.010  247.455   33.801  326.263   34.111  15.201 1.1118 17.595 0.9693 -2.393796      1.475037  
1 1 1 17 14 2  o 7.0052 1.3228 61.280   19.015  69.024    26.734  53.351    27.052  7.5086 1.8029 6.5019 1.9360 1.006724       2.645520  
1 1 1 17 14 3  o 3.6272 1.1347 -0.1610  16.245  -3.8785   24.273  2.8553    21.864  3.5849 1.6132 3.6696 1.5960 -0.8468223E-01 2.269306  
1 1 1 17 14 4  o 8.8292 1.1041 89.450   19.048  99.307    28.025  80.986    25.969  9.3698 1.4955 8.2886 1.6246 1.081158       2.208122  
1 1 1 17 14 5  o 13.028 0.8280 182.230  21.500  204.208   31.353  162.721   29.539  13.794 1.1365 12.262 1.2045 1.532162       1.655995  
1 1 1 17 14 6  o 5.8968 1.3308 42.186   18.055  51.002    25.082  32.705    26.011  6.4606 1.8479 5.3331 1.9155 1.127478       2.661622  
1 1 1 17 14 7  o 5.4889 1.2520 29.621   18.495  61.335    26.361  -1.1249   25.955  7.1357 1.8364 3.8420 1.7024 3.293756       2.504086  
1 1 1 17 14 8  o 6.3789 1.3283 49.600   18.844  33.366    26.847  65.364    26.456  5.3949 1.9452 7.3629 1.8094 -1.967933      2.656651  
1 1 1 17 14 9  o 15.169 0.7913 247.713  23.560  197.351   33.468  297.184   33.171  13.519 1.2378 16.819 0.9861 -3.299176      1.582582  
1 1 1 17 14 10 o 4.0525 1.2167 3.8766   17.999  20.068    25.497  -12.2088  25.413  4.6654 1.8449 3.4397 1.5867 1.225706       2.433383  
1 1 1 17 14 11 o 6.3661 1.3761 50.007   19.395  62.462    28.432  39.167    26.524  7.0541 1.9501 5.6781 1.9422 1.375983       2.752255  
1 1 1 17 14 12 o 5.0104 1.2711 24.611   18.735  -5.9920   29.214  45.988    24.416  3.8705 1.7531 6.1504 1.8411 -2.279896      2.542288  
1 1 1 17 14 13 o 8.7013 1.2249 90.614   20.544  100.239   30.056  82.173    28.146  9.1699 1.7015 8.2326 1.7626 0.9373341      2.449868  
1 1 1 17 14 14 o 4.9563 1.2699 22.580   19.314  -11.1899  28.480  51.333    26.279  3.6035 1.6684 6.3090 1.9149 -2.705430      2.539802  
1 1 1 17 14 15 o 4.5198 1.2888 11.056   20.569  -21.6779  29.715  41.170    28.500  3.4083 1.6173 5.6313 2.0070 -2.222966      2.577522  
1 1 1 17 14 16 o 8.3391 1.3334 95.890   22.595  64.791    34.464  119.333   29.923  6.6117 2.2141 10.066 1.4863 -3.454702      2.666702  
1 1 1 17 14 17 o 3.8902 1.2337 -2.1458  20.440  27.031    31.326  -23.7757  26.972  4.7059 1.9738 3.0744 1.4807 1.631447       2.467450  
1 1 1 17 14 18 o 5.2829 1.4071 42.375   20.112  46.696    30.475  39.041    26.769  5.4337 2.0518 5.1321 1.9261 0.3015862      2.814248  
1 1 1 17 14 19 o 4.3887 1.2557 22.860   19.933  -11.6248  31.346  46.270    25.827  3.4091 1.6298 5.3683 1.9108 -1.959226      2.511477  
1 1 1 17 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 0  o 2.9247 1.4056 -12.7693 25.103  -22.6985  36.141  -3.5137   34.894  2.7412 1.9006 3.1081 2.0712 -0.000000      0.000000  
1 1 1 17 15 1  o 4.2529 1.2405 10.795   17.481  0.5429    24.515  21.401    24.934  3.7908 1.6683 4.7150 1.8364 -0.9242446     2.480997  
1 1 1 17 15 2  o 7.0461 1.2033 56.511   19.219  21.011    26.300  97.194    28.155  4.7548 1.8758 9.3375 1.5076 -4.582714      2.406550  
1 1 1 17 15 3  o 5.9942 1.3624 43.147   18.484  40.656    25.080  46.109    27.349  5.8347 1.8857 6.1537 1.9671 -0.3190413     2.724894  
1 1 1 17 15 4  o 8.2153 1.2057 79.008   19.462  89.668    26.871  67.245    28.226  8.9906 1.4944 7.4401 1.8925 1.550438       2.411344  
1 1 1 17 15 5  o 3.6755 1.1571 -2.6584  17.261  -8.8177   25.502  2.5492    23.449  3.5509 1.6199 3.8000 1.6528 -0.2491019     2.314236  
1 1 1 17 15 6  o 8.4851 1.2128 84.109   20.256  119.097   29.843  54.222    27.582  10.364 1.4398 6.6063 1.9520 3.757555       2.425570  
1 1 1 17 15 7  o 6.6859 1.3963 55.132   20.023  63.849    29.382  47.574    27.360  7.1572 1.9838 6.2147 1.9654 0.9424982      2.792591  
1 1 1 17 15 8  f 3.8269 1.1674 -6.8482  18.568  -41.3054  27.754  21.070    24.982  2.9600 1.4433 4.6937 1.8353 -1.733691      2.334839  
1 1 1 17 15 9  o 18.563 0.7274 364.788  26.949  362.841   39.285  366.518   37.037  18.481 1.0628 18.644 0.9933 -0.1627808     1.454707  
1 1 1 17 15 10 o 6.7548 1.1808 51.713   20.192  3.5746    28.691  98.955    28.423  4.1302 1.8115 9.3795 1.5152 -5.249331      2.361635  
1 1 1 17 15 11 o 7.1093 1.3538 62.083   20.166  81.485    29.492  45.045    27.637  8.1871 1.8453 6.0315 1.9813 2.155595       2.707515  
1 1 1 17 15 12 o 4.0082 1.2268 3.1609   19.005  -14.8991  27.825  18.952    26.019  3.4763 1.6229 4.5400 1.8403 -1.063674      2.453645  
1 1 1 17 15 13 o 4.3929 1.3057 10.274   19.888  30.567    30.378  -4.9490   26.311  5.1470 2.0206 3.6388 1.6543 1.508184       2.611403  
1 1 1 17 15 14 o 5.2531 1.4419 33.108   21.354  39.654    33.632  28.686    27.641  5.5340 2.1390 4.9722 1.9343 0.5618196      2.883873  
1 1 1 17 15 15 o 6.7196 1.3354 63.783   22.701  17.497    34.172  100.348   30.372  4.5828 1.9942 8.8564 1.7765 -4.273596      2.670764  
1 1 1 17 15 16 o 6.2870 1.4645 60.332   21.556  78.257    32.633  46.456    28.711  7.0559 2.1322 5.5181 2.0082 1.537784       2.928977  
1 1 1 17 15 17 o 3.9712 1.2523 4.5566   20.947  29.569    30.890  -16.7346  28.500  4.6844 1.9622 3.2580 1.5566 1.426358       2.504613  
1 1 1 17 15 18 o 4.0630 1.2539 14.449   20.912  -12.6131  32.275  34.029    27.454  3.4250 1.6417 4.7010 1.8956 -1.275999      2.507747  
1 1 1 17 15 19 o 4.6255 1.3878 36.665   22.075  48.147    34.041  28.332    29.000  4.9519 2.0658 4.2990 1.8539 0.6528449      2.775650  
1 1 1 17 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 15 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 0  o 9.2776 1.6956 111.314  27.200  117.760   38.628  104.976   38.306  9.6725 2.3007 8.8828 2.4913 -0.000000      0.000000  
1 1 1 17 16 1  o 8.6510 1.1756 87.970   19.704  109.089   27.702  66.345    28.033  9.9522 1.3917 7.3498 1.8949 2.602401       2.351102  
1 1 1 17 16 2  o 5.4064 1.3646 33.407   18.790  26.808    26.236  40.354    26.922  5.0286 1.9026 5.7842 1.9568 -0.7556148     2.729281  
1 1 1 17 16 3  o 10.971 0.9890 132.959  21.279  103.877   29.650  163.843   30.555  9.6203 1.5410 12.321 1.2399 -2.700996      1.977934  
1 1 1 17 16 4  o 9.8145 1.0980 109.400  20.699  87.688    28.790  132.629   29.780  8.6207 1.7300 11.008 1.3526 -2.387619      2.195997  
1 1 1 17 16 5  o 7.3421 1.3034 66.208   19.653  85.275    27.763  47.058    27.824  8.5185 1.6893 6.1657 1.9855 2.352786       2.606841  
1 1 1 17 16 6  o 6.5934 1.2790 50.689   18.638  80.735    27.942  26.604    25.017  8.2189 1.7533 4.9679 1.8625 3.250922       2.557947  
1 1 1 17 16 7  o 6.5353 1.3753 53.319   19.339  59.999    28.234  47.415    26.542  6.9029 1.9559 6.1677 1.9339 0.7352190      2.750507  
1 1 1 17 16 8  o 5.8760 1.4073 41.589   19.775  50.184    29.106  34.219    26.951  6.3268 2.0300 5.4251 1.9497 0.9016623      2.814670  
1 1 1 17 16 9  o 3.6165 1.1630 -11.1329 18.679  5.0007    27.645  -24.6859  25.338  4.1251 1.7944 3.1079 1.4801 1.017186       2.326070  
1 1 1 17 16 10 o 11.140 1.0270 140.012  22.829  153.146   33.462  128.576   31.224  11.640 1.4374 10.640 1.4673 1.000314       2.054052  
1 1 1 17 16 11 o 11.008 1.0818 138.869  23.702  158.505   35.176  122.541   32.077  11.747 1.4973 10.270 1.5617 1.476439       2.163502  
1 1 1 17 16 12 o 5.7892 1.4936 44.333   22.352  45.074    34.227  43.782    29.515  5.8085 2.1784 5.7700 2.0439 0.3850985E-01  2.987110  
1 1 1 17 16 13 o 8.9989 1.3130 110.497  23.392  64.470    34.991  147.690   31.455  6.6449 2.2310 11.353 1.3853 -4.707966      2.626068  
1 1 1 17 16 14 o 5.7209 1.4314 46.936   22.108  24.904    35.044  61.501    28.493  4.8215 2.0577 6.6203 1.9905 -1.798744      2.862859  
1 1 1 17 16 15 o 5.6556 1.3814 48.032   22.031  14.789    31.846  78.544    30.510  4.1773 1.8662 7.1339 2.0373 -2.956580      2.762846  
1 1 1 17 16 16 o 4.1831 1.2876 16.303   20.843  1.4108    31.278  28.199    27.954  3.7854 1.7512 4.5808 1.8880 -0.7954767     2.575102  
1 1 1 17 16 17 o 4.1209 1.3050 17.908   22.422  9.1457    34.126  24.565    29.744  3.9373 1.8241 4.3046 1.8668 -0.3673353     2.610085  
1 1 1 17 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 16 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 0  o 5.3799 1.8262 47.306   27.589  10.752    40.739  78.271    37.495  3.6913 2.3803 7.0685 2.7703 -0.000000      0.000000  
1 1 1 17 17 1  o 4.4945 1.2717 13.990   18.740  32.037    25.582  -6.9099   27.530  5.2669 1.8988 3.7220 1.6921 1.544905       2.543382  
1 1 1 17 17 2  o 5.6781 1.3981 38.116   20.174  23.941    28.415  52.524    28.648  4.9158 1.9464 6.4405 2.0074 -1.524741      2.796144  
1 1 1 17 17 3  f 4.6734 1.3254 19.204   18.867  26.420    28.138  13.309    25.432  5.0217 1.9521 4.3252 1.7933 0.6964622      2.650836  
1 1 1 17 17 4  o 6.8402 1.4181 59.057   20.623  63.677    30.339  55.089    28.119  7.0661 2.0358 6.6143 1.9749 0.4517817      2.836271  
1 1 1 17 17 5  f 10.155 1.1271 117.772  21.990  143.234   31.783  94.390    30.457  11.400 1.3939 8.9101 1.7715 2.490335       2.254163  
1 1 1 17 17 6  o 5.0148 1.3920 24.978   20.220  27.618    30.913  23.005    26.731  5.1822 2.0371 4.8474 1.8976 0.3348527      2.783999  
1 1 1 17 17 7  o 4.6876 1.3318 17.509   19.161  33.962    29.981  6.1488    24.913  5.3904 2.0352 3.9849 1.7183 1.405470       2.663591  
1 1 1 17 17 8  o 5.8887 1.4143 44.932   20.548  32.011    31.129  54.911    27.355  5.2585 2.0508 6.5190 1.9482 -1.260427      2.828601  
1 1 1 17 17 9  o 4.2891 1.2993 8.4924   20.890  -11.1515  31.587  23.763    27.850  3.7831 1.7535 4.7950 1.9178 -1.011895      2.598621  
1 1 1 17 17 10 o 5.3789 1.4421 35.941   21.547  29.361    31.938  41.438    29.191  5.1051 2.0495 5.6527 2.0294 -0.5476093     2.884255  
1 1 1 17 17 11 o 7.4180 1.3829 77.182   23.434  36.744    34.923  110.305   31.607  5.3970 2.1512 9.4390 1.7383 -4.042068      2.765793  
1 1 1 17 17 12 o 6.3409 1.3554 53.146   22.745  9.6769    32.678  93.999    31.679  4.2913 1.9054 8.3906 1.9282 -4.099332      2.710832  
1 1 1 17 17 13 o 4.8748 1.3984 29.794   21.456  42.767    31.791  18.941    29.078  5.3761 2.0791 4.3735 1.8706 1.002597       2.796771  
1 1 1 17 17 14 f 4.9212 1.4086 33.914   22.131  49.862    31.848  19.024    30.775  5.5375 2.0960 4.3048 1.8824 1.232717       2.817189  
1 1 1 17 17 15 o 5.0576 1.4254 41.071   22.058  32.237    32.422  48.683    30.096  4.6947 1.9906 5.4205 2.0408 -0.7257595     2.850806  
1 1 1 17 17 16 o 3.9015 1.2593 9.8873   21.575  27.092    33.396  -2.4360   28.265  4.3633 1.9324 3.4397 1.6154 0.9236023      2.518621  
1 1 1 17 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 17 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 0  o 6.0275 1.9847 63.952   28.153  47.440    41.919  77.519    37.998  5.0784 2.8129 6.9766 2.8007 -0.000000      0.000000  
1 1 1 17 18 1  o 4.4289 1.2930 13.769   18.871  4.8210    26.598  22.839    26.779  4.0467 1.7602 4.8112 1.8945 -0.7644162     2.585975  
1 1 1 17 18 2  o 5.4069 1.3941 34.333   19.714  28.413    27.843  40.284    27.917  5.0948 1.9522 5.7190 1.9907 -0.6242375     2.788160  
1 1 1 17 18 3  o 11.983 1.0059 161.513  23.997  146.855   34.143  175.821   33.734  11.370 1.5014 12.596 1.3391 -1.226077      2.011820  
1 1 1 17 18 4  o 5.9049 1.4128 42.145   21.386  66.693    30.843  19.413    29.679  7.1158 2.0533 4.6939 1.9410 2.421907       2.825567  
1 1 1 17 18 5  o 5.7644 1.4333 42.211   20.314  46.137    31.250  39.337    26.733  5.9358 2.1030 5.5930 1.9480 0.3427925      2.866595  
1 1 1 17 18 6  o 8.0938 1.3759 84.704   21.956  79.763    33.021  88.620    29.395  7.7276 2.0873 8.4599 1.7930 -0.7323503     2.751711  
1 1 1 17 18 7  o 4.3451 1.2604 4.2715   20.886  -38.4328  31.408  38.124    27.964  3.1993 1.5544 5.4908 1.9844 -2.291523      2.520703  
1 1 1 17 18 8  o 4.5243 1.3407 15.214   21.427  -3.8054   32.589  29.697    28.438  3.9998 1.8271 5.0488 1.9626 -1.049000      2.681456  
1 1 1 17 18 9  o 6.6994 1.4526 62.389   22.559  40.987    32.548  82.174    31.294  5.5566 2.1151 7.8422 1.9915 -2.285666      2.905127  
1 1 1 17 18 10 o 4.8046 1.3820 24.608   21.603  9.2391    30.872  39.354    30.240  4.2135 1.8623 5.3956 2.0423 -1.182079      2.763948  
1 1 1 17 18 11 o 5.3149 1.4464 39.733   21.678  38.358    32.246  40.867    29.281  5.2484 2.0750 5.3814 2.0155 -0.1330118     2.892720  
1 1 1 17 18 12 o 6.5160 1.4552 66.695   22.836  98.224    33.689  39.891    31.062  7.9628 2.0892 5.0691 2.0261 2.893745       2.910332  
1 1 1 17 18 13 o 4.2941 1.3255 19.285   21.433  21.358    31.612  17.521    29.158  4.3836 1.9126 4.2047 1.8356 0.1788468      2.650937  
1 1 1 17 18 14 o 3.4252 1.1399 -8.3959  20.695  -27.6650  30.825  7.4156    27.923  3.1016 1.5143 3.7488 1.7042 -0.6471193     2.279792  
1 1 1 17 18 15 o 4.4767 1.3614 32.057   22.983  15.098    34.920  45.019    30.528  3.9925 1.8481 4.9609 1.9995 -0.9683769     2.722792  
1 1 1 17 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 18 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 0  o 5.1976 2.0192 52.655   30.237  56.243    43.938  49.428    41.676  5.3416 2.9076 5.0535 2.8027 -0.000000      0.000000  
1 1 1 17 19 1  o 10.299 1.2013 130.452  22.893  180.444   32.528  81.383    32.227  12.751 1.2755 7.8464 2.0360 4.904882       2.402550  
1 1 1 17 19 2  o 5.0834 1.4167 29.387   21.190  30.962    30.381  27.895    29.571  5.1592 2.0221 5.0075 1.9847 0.1516800      2.833392  
1 1 1 17 19 3  o 4.6984 1.2566 13.857   19.755  -24.7559  28.579  49.188    27.337  3.2763 1.5635 6.1204 1.9677 -2.844083      2.513279  
1 1 1 17 19 4  o 3.9338 1.3107 -13.6458 24.615  -10.6536  29.178  -21.0326  45.844  3.6397 1.6864 4.2280 2.0070 -0.5882080     2.621477  
1 1 1 17 19 5  o 8.6171 1.3588 95.724   22.818  97.470    32.641  94.056    31.910  8.6894 1.9286 8.5448 1.9147 0.1446629      2.717604  
1 1 1 17 19 6  o 3.6709 1.1722 -19.5215 20.299  21.491    29.323  -57.2581  28.128  4.6664 1.9295 2.6754 1.3317 1.990983       2.344382  
1 1 1 17 19 7  o 5.2160 1.3740 31.164   21.962  -0.9311   32.475  58.215    29.814  3.9997 1.8259 6.4324 2.0536 -2.432625      2.747916  
1 1 1 17 19 8  f 4.1155 1.2887 4.1954   21.935  -16.1129  31.678  22.900    30.402  3.5685 1.6864 4.6625 1.9492 -1.094048      2.577473  
1 1 1 17 19 9  o 4.6377 1.2167 4.4873   21.338  -65.5421  31.650  62.837    28.890  2.7333 1.3684 6.5420 2.0121 -3.808739      2.433339  
1 1 1 17 19 10 o 4.6920 1.3928 29.321   22.031  41.021    33.294  20.208    29.384  5.0916 2.0750 4.2923 1.8585 0.7992601      2.785634  
1 1 1 17 19 11 o 3.6793 1.2072 -2.8861  21.157  8.0575    31.559  -11.8194  28.513  3.9931 1.8140 3.3655 1.5933 0.6276240      2.414340  
1 1 1 17 19 12 o 5.9254 1.4275 58.625   22.484  31.379    32.452  83.778    31.181  4.6294 1.9780 7.2213 2.0587 -2.591848      2.854911  
1 1 1 17 19 13 o 9.0704 1.4083 129.095  24.785  126.230   36.707  131.495   33.602  8.7158 2.1250 9.4249 1.8486 -0.7091227     2.816567  
1 1 1 17 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 19 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 0  o 5.2489 2.0075 55.755   30.048  66.231    42.004  44.775    43.003  5.7721 2.9226 4.7257 2.7528 -0.000000      0.000000  
1 1 1 17 20 1  o 4.5197 1.3456 18.684   20.724  22.294    29.861  15.329    28.787  4.6701 1.9403 4.3692 1.8648 0.3009043      2.691165  
1 1 1 17 20 2  o 3.9846 1.2530 -4.1021  21.827  -35.5262  31.562  24.699    30.217  3.2051 1.5574 4.7641 1.9632 -1.559050      2.505934  
1 1 1 17 20 3  o 7.8077 1.4356 84.470   23.494  113.015   34.187  58.921    32.342  9.2627 1.9089 6.3526 2.1448 2.910130       2.871230  
1 1 1 17 20 4  o 5.8612 1.4244 46.635   22.893  15.237    33.421  74.392    31.422  4.4793 1.9601 7.2431 2.0672 -2.763726      2.848763  
1 1 1 17 20 5  o 4.9211 1.3450 28.021   21.347  -3.4560   33.552  49.428    27.670  3.9305 1.8167 5.9116 1.9839 -1.981113      2.690013  
1 1 1 17 20 6  o 5.2139 1.2966 29.161   22.186  -25.6140  33.479  72.047    29.624  3.4015 1.6411 7.0262 2.0078 -3.624692      2.593180  
1 1 1 17 20 7  o 3.1361 1.0665 -33.5295 21.416  -87.9319  33.892  2.6313    27.632  2.5884 1.3107 3.6839 1.6827 -1.095559      2.132956  
1 1 1 17 20 8  o 5.0800 1.4002 29.237   21.853  71.458    35.046  2.3780    27.952  6.4563 2.2314 3.7037 1.6920 2.752607       2.800348  
1 1 1 17 20 9  o 4.6948 1.3341 23.962   22.873  -19.6716  34.918  56.757    30.273  3.4880 1.6811 5.9016 2.0719 -2.413610      2.668139  
1 1 1 17 20 10 o 5.4737 1.5188 53.899   24.138  57.597    36.609  51.054    32.107  5.5377 2.2041 5.4096 2.0902 0.1280928      3.037556  
1 1 1 17 20 11 o 4.2826 1.3279 22.371   23.028  0.1949    34.310  40.550    31.065  3.7092 1.7535 4.8560 1.9946 -1.146876      2.655763  
1 1 1 17 20 12 o 4.8727 1.3701 38.538   23.711  -2.9798   35.423  72.239    31.915  3.6029 1.7252 6.1424 2.1290 -2.539481      2.740236  
1 1 1 17 20 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 20 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 0  o 2.8145 1.3848 -14.8706 27.538  -7.4694   40.561  -21.1987  37.506  2.9844 2.0554 2.6446 1.8562 -0.000000      0.000000  
1 1 1 17 21 1  f 3.9226 1.2300 3.6935   20.507  -21.9285  28.722  30.338    29.290  3.1566 1.5222 4.6886 1.9325 -1.531978      2.460050  
1 1 1 17 21 2  o 3.9150 1.2370 2.9573   20.930  29.764    30.178  -21.8888  29.053  4.6596 1.9445 3.1705 1.5294 1.489074       2.473921  
1 1 1 17 21 3  o 5.8820 1.3230 51.849   22.192  5.4005    33.498  88.183    29.627  3.9670 1.8270 7.7971 1.9140 -3.830147      2.646032  
1 1 1 17 21 4  o 3.5904 1.1571 -7.9614  20.561  -50.4363  32.641  19.981    26.474  2.9278 1.4535 4.2531 1.8008 -1.325382      2.314153  
1 1 1 17 21 5  o 3.9753 1.2403 -11.3193 21.821  44.358    32.813  -55.4653  29.218  5.2787 2.0912 2.6718 1.3342 2.606967       2.480555  
1 1 1 17 21 6  o 5.5409 1.4420 44.792   22.970  82.104    34.740  15.811    30.617  6.9284 2.2172 4.1535 1.8443 2.774825       2.884004  
1 1 1 17 21 7  o 4.3399 1.2978 20.984   21.614  -10.1930  34.380  41.361    27.794  3.5857 1.7122 5.0942 1.9508 -1.508467      2.595634  
1 1 1 17 21 8  o 7.5693 1.5433 97.641   24.671  114.663   37.006  84.022    33.099  8.1957 2.2080 6.9428 2.1567 1.252849       3.086544  
1 1 1 17 21 9  o 5.5319 1.5246 59.347   24.755  81.836    37.093  41.286    33.241  6.2791 2.2830 4.7847 2.0214 1.494368       3.049255  
1 1 1 17 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 21 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 0  o 4.8810 1.9722 50.441   33.437  98.372    50.352  12.629    44.722  6.3310 3.2012 3.4309 2.3044 -0.000000      0.000000  
1 1 1 17 22 1  o 4.4499 1.3376 20.865   22.402  -6.1954   31.144  49.876    32.247  3.5388 1.6723 5.3610 2.0882 -1.822157      2.675301  
1 1 1 17 22 2  o 4.4679 1.3533 26.645   21.718  36.670    31.514  17.576    29.973  4.8107 1.9956 4.1250 1.8285 0.6857409      2.706647  
1 1 1 17 22 3  o 3.3473 1.1319 -12.7023 21.404  -14.5473  31.255  -11.0729  29.373  3.3534 1.6096 3.3411 1.5918 0.1231551E-01  2.263803  
1 1 1 17 22 4  o 5.3494 1.3189 35.048   23.015  92.276    32.767  -20.6753  32.334  7.4293 2.1078 3.2695 1.5859 4.159785       2.637732  
1 1 1 17 22 5  o 4.1558 1.3158 19.639   22.880  7.7129    32.779  30.969    31.951  3.8281 1.7785 4.4834 1.9396 -0.6553235     2.631579  
1 1 1 17 22 6  o 4.3052 1.3065 24.910   21.639  1.5842    31.747  45.152    29.573  3.6107 1.7007 4.9998 1.9838 -1.389104      2.613052  
1 1 1 17 22 7  o 5.1353 1.4276 49.232   24.160  18.042    35.955  74.910    32.623  4.0524 1.8757 6.2181 2.1527 -2.165700      2.855194  
1 1 1 17 22 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 22 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 23 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 24 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 25 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 26 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 27 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 28 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 28 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 28 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 28 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 17 28 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 1  0  o 1.7512 1.2067 -10.1823 14.021  0.0000    0.0000  -10.1823  14.021  1.7512 1.2067 1.7512 1.2067 -0.000000      0.000000  
1 1 1 18 1  1  o 13.054 0.6281 173.173  16.395  173.605   23.399  172.756   22.978  13.068 0.8953 13.039 0.8811 0.2863407E-01  1.256138  
1 1 1 18 1  2  o 10.866 0.8087 105.737  15.414  156.516   32.575  91.087    17.497  12.277 1.3267 9.4558 0.9252 2.820706       1.617475  
1 1 1 18 1  3  o 4.9496 1.0627 29.190   12.776  -11.8563  28.806  39.242    14.255  3.8436 1.7409 6.0557 1.2192 -2.212083      2.125352  
1 1 1 18 1  4  o 8.0576 1.0342 53.567   14.195  108.805   31.591  39.593    15.889  10.086 1.5661 6.0293 1.3511 4.056579       2.068386  
1 1 1 18 1  5  o 3.9569 1.1812 -1.2152  12.613  24.897    30.337  -6.6727   13.869  5.2508 2.0309 2.6629 1.2069 2.587949       2.362477  
1 1 1 18 1  6  o 6.0395 1.2212 43.085   14.193  29.687    31.831  46.410    15.857  5.5282 2.0947 6.5508 1.2560 -1.022656      2.442391  
1 1 1 18 1  7  o 21.830 0.6952 465.435  26.044  538.815   54.412  443.628   29.663  22.748 1.1960 20.911 0.7093 1.836493       1.390474  
1 1 1 18 1  8  o 11.890 0.8617 140.630  17.094  165.503   37.154  133.951   19.253  12.357 1.5034 11.424 0.8427 0.9326563      1.723439  
1 1 1 18 1  9  o 10.015 1.2199 122.096  17.407  97.249    40.761  127.638   19.251  8.8844 2.2819 11.146 0.8636 -2.261066      2.439893  
1 1 1 18 1  10 o 9.0790 1.2667 97.552   19.969  89.783    38.163  100.481   23.433  8.4396 2.2281 9.7184 1.2056 -1.278779      2.533413  
1 1 1 18 1  11 o 12.090 0.9731 156.390  18.565  160.666   41.749  155.337   20.727  11.904 1.7535 12.275 0.8443 -0.3701239     1.946173  
1 1 1 18 1  12 o 11.066 0.9677 107.865  17.646  186.180   41.801  90.884    19.465  12.844 1.6273 9.2888 1.0478 3.554750       1.935460  
1 1 1 18 1  13 o 7.0909 1.0340 61.210   15.138  95.723    20.964  23.602    21.883  9.4689 1.1070 4.7130 1.7469 4.755984       2.068078  
1 1 1 18 1  14 o 4.6164 1.1868 22.803   14.176  22.648    19.968  22.961    20.128  4.6045 1.6749 4.6283 1.6819 -0.2381086E-01 2.373598  
1 1 1 18 1  15 o 4.4464 1.1825 20.252   14.337  23.255    20.233  17.223    20.318  4.6233 1.6853 4.2695 1.6591 0.3537903      2.364919  
1 1 1 18 1  16 o 8.7938 0.9979 87.428   16.905  93.114    22.794  80.476    25.202  9.2644 1.2302 8.3232 1.5716 0.9412661      1.995800  
1 1 1 18 1  17 o 13.365 0.7366 189.043  19.650  190.752   27.031  187.127   28.614  13.455 1.0045 13.276 1.0777 0.1794462      1.473270  
1 1 1 18 1  18 o 4.4358 1.2181 19.020   15.579  22.731    21.246  14.704    22.912  4.6193 1.7195 4.2523 1.7258 0.3670917      2.436153  
1 1 1 18 1  19 o 4.9606 1.2395 25.367   15.604  15.782    20.810  37.677    23.583  4.2702 1.6736 5.6510 1.8288 -1.380867      2.478982  
1 1 1 18 1  20 o 12.472 0.8048 166.433  20.003  175.479   27.726  156.614   28.886  12.868 1.0774 12.077 1.1959 0.7901678      1.609595  
1 1 1 18 1  21 o 10.186 1.4537 115.475  23.279  106.249   25.765  156.477   54.316  9.8468 1.3083 10.525 2.5964 -0.6781254     2.907416  
1 1 1 18 1  22 o 5.0492 1.2887 28.112   16.961  18.439    23.007  39.626    25.102  4.4341 1.7528 5.6644 1.8896 -1.230316      2.577377  
1 1 1 18 1  23 o 4.7929 1.2982 25.163   18.158  34.911    23.642  11.141    28.355  5.3069 1.8328 4.2788 1.8391 1.028162       2.596432  
1 1 1 18 1  24 o 10.129 1.1251 126.376  21.581  140.540   28.907  108.540   32.437  11.104 1.3017 9.1547 1.8355 1.948932       2.250229  
1 1 1 18 1  25 o 4.1165 1.2518 16.492   18.972  23.793    24.787  6.1642    29.480  4.3736 1.7873 3.8593 1.7532 0.5142748      2.503643  
1 1 1 18 1  26 o 4.1704 1.2663 20.546   19.519  30.008    26.182  8.7086    29.285  4.5271 1.8420 3.8137 1.7382 0.7134252      2.532655  
1 1 1 18 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 1  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 2  0  o 16.037 0.9903 271.478  30.823  228.835   43.432  314.752   43.752  14.667 1.5178 17.406 1.2725 -0.000000      0.000000  
1 1 1 18 2  1  o 17.484 0.6422 312.926  22.447  300.001   31.286  326.637   32.223  17.110 0.9143 17.859 0.9021 -0.7491188     1.284433  
1 1 1 18 2  2  o 10.192 0.8130 108.650  16.487  118.352   23.017  98.427    23.627  10.686 1.0770 9.6974 1.2182 0.9884682      1.626028  
1 1 1 18 2  3  o 8.2097 1.1160 74.932   14.881  72.411    31.566  75.652    16.874  7.8585 2.0026 8.5608 0.9855 -0.7022824     2.231950  
1 1 1 18 2  4  o 9.7567 0.9147 87.591   15.364  128.061   33.322  76.664    17.315  10.901 1.5284 8.6123 1.0052 2.288661       1.829314  
1 1 1 18 2  5  o 10.821 0.9315 112.837  16.328  141.798   37.508  106.066   18.137  11.462 1.6362 10.180 0.8908 1.282339       1.862947  
1 1 1 18 2  6  o 15.601 0.7598 236.476  20.159  282.511   42.926  223.450   22.834  16.387 1.3097 14.815 0.7706 1.571853       1.519608  
1 1 1 18 2  7  o 4.7652 1.2355 22.479   13.290  14.231    32.504  24.134    14.563  4.8372 2.0183 4.6932 1.4257 0.1439891      2.471067  
1 1 1 18 2  8  o 21.121 0.7545 469.247  26.041  456.181   55.650  472.911   29.466  20.680 1.3455 21.562 0.6833 -0.8820343     1.509063  
1 1 1 18 2  9  o 8.2137 1.2062 77.179   15.864  76.629    35.408  77.317    17.745  7.8303 2.1804 8.5971 1.0320 -0.7668276     2.412313  
1 1 1 18 2  10 f 8.4547 1.1717 66.589   15.989  111.106   37.312  56.576    17.696  9.6175 2.0048 7.2919 1.2134 2.325610       2.343415  
1 1 1 18 2  11 o 5.6062 1.3426 34.235   14.993  35.482    37.586  33.998    16.351  5.7463 2.2500 5.4660 1.4656 0.2802758      2.685242  
1 1 1 18 2  12 o 10.286 1.0902 112.577  17.327  133.964   39.489  107.478   19.283  10.451 1.9614 10.121 0.9526 0.3297329      2.180469  
1 1 1 18 2  13 o 12.825 1.0060 190.120  19.884  166.476   43.746  196.277   22.323  11.878 1.8415 13.772 0.8104 -1.894142      2.011951  
1 1 1 18 2  14 o 5.9641 1.3189 46.273   16.304  29.741    39.609  49.646    17.890  5.3648 2.2323 6.5634 1.4053 -1.198526      2.637814  
1 1 1 18 2  15 o 3.2133 1.0766 -10.6589 13.448  -13.9060  33.344  -10.0282  14.696  3.8587 1.7930 2.5680 1.1923 1.290684       2.153287  
1 1 1 18 2  16 f 12.848 0.9506 168.133  19.988  204.378   44.634  159.040   22.355  13.349 1.6718 12.348 0.9052 1.000868       1.901178  
1 1 1 18 2  17 o 5.2486 1.1897 35.732   16.025  -15.1934  37.934  46.793    17.680  4.1057 1.9094 6.3915 1.4199 -2.285874      2.379488  
1 1 1 18 2  18 o 7.4328 1.2383 80.039   17.932  31.985    38.139  93.677    20.318  5.4892 2.2270 9.3764 1.0835 -3.887217      2.476552  
1 1 1 18 2  19 o 7.1173 1.1832 77.212   18.499  1.8616    40.811  96.697    20.753  4.6873 2.1020 9.5473 1.0869 -4.860024      2.366317  
1 1 1 18 2  20 o 10.182 1.1560 109.505  19.584  139.876   41.233  100.659   22.254  10.662 2.0074 9.7015 1.1469 0.9603081      2.311907  
1 1 1 18 2  21 o 9.7543 1.3838 120.657  24.610  100.184   42.864  130.723   30.057  8.6048 2.4000 10.904 1.3783 -2.299186      2.767653  
1 1 1 18 2  22 o 7.4974 1.4859 55.941   19.673  122.541   44.963  40.173    21.878  9.2970 2.4013 5.6978 1.7507 3.599202       2.971735  
1 1 1 18 2  23 o 5.6243 1.2944 -1.9449  17.820  107.770   40.182  -28.8060  19.882  8.7232 2.2783 2.5254 1.2292 6.197882       2.588757  
1 1 1 18 2  24 o 6.9552 1.3698 74.171   20.461  47.841    45.783  80.742    22.872  5.5984 2.3691 8.3119 1.3759 -2.713496      2.739646  
1 1 1 18 2  25 o 4.9211 1.3929 35.822   20.528  17.192    47.718  40.053    22.739  4.5598 2.1275 5.2824 1.7983 -0.7225943     2.785754  
1 1 1 18 2  26 o 3.2803 1.1181 -9.2495  19.769  -49.4760  46.898  -0.5569   21.801  3.3712 1.6845 3.1893 1.4707 0.1819620      2.236178  
1 1 1 18 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 2  32 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 3  0  o 4.0472 1.6462 23.371   21.650  31.163    30.678  15.639    30.557  4.4307 2.4236 3.6636 2.2284 -0.000000      0.000000  
1 1 1 18 3  1  o 19.389 0.6216 385.412  24.094  396.531   33.990  374.182   34.160  19.679 0.8636 19.100 0.8942 0.5787067      1.243198  
1 1 1 18 3  2  o 4.7389 1.1813 21.828   14.389  30.376    19.858  12.379    20.877  5.2806 1.6749 4.1972 1.6664 1.083399       2.362654  
1 1 1 18 3  3  o 4.1859 1.1653 12.517   14.262  10.754    19.162  14.706    21.356  4.0106 1.5951 4.3611 1.6992 -0.3505197     2.330612  
1 1 1 18 3  4  o 11.082 0.8091 128.509  17.785  141.316   24.595  114.473   25.748  11.697 1.0513 10.466 1.2301 1.230652       1.618135  
1 1 1 18 3  5  o 14.438 0.6941 215.490  20.028  214.249   27.782  216.833   28.899  14.403 0.9645 14.473 0.9984 -0.7009792E-01 1.388155  
1 1 1 18 3  6  o 9.1832 1.1177 90.179   16.157  99.842    35.792  87.706    18.107  9.1723 2.0069 9.1940 0.9847 -0.2174473E-01 2.235430  
1 1 1 18 3  7  o 11.985 0.8679 135.467  17.617  184.544   38.663  122.606   19.791  13.063 1.4799 10.907 0.9073 2.155792       1.735876  
1 1 1 18 3  8  o 6.6611 1.2677 36.784   14.669  89.267    34.305  25.041    16.227  8.5638 2.0333 4.7583 1.5146 3.805451       2.535388  
1 1 1 18 3  9  o 5.8453 1.2999 39.065   15.114  36.561    33.857  39.689    16.890  5.7600 2.1653 5.9305 1.4387 -0.1705379     2.599716  
1 1 1 18 3  10 o 8.5955 1.1757 78.687   15.731  94.497    36.507  75.082    17.433  8.7289 2.1137 8.4622 1.0300 0.2667198      2.351315  
1 1 1 18 3  11 o 5.0128 1.0231 32.941   14.491  -47.8772  35.226  49.404    15.899  3.3476 1.6309 6.6780 1.2359 -3.330448      2.046298  
1 1 1 18 3  12 o 12.489 0.9773 171.120  19.425  172.530   42.796  170.755   21.800  12.158 1.7600 12.820 0.8503 -0.6619244     1.954652  
1 1 1 18 3  13 o 4.8342 1.2515 26.731   14.982  7.2897    35.373  30.981    16.539  4.5238 1.9968 5.1446 1.5091 -0.6208315     2.502935  
1 1 1 18 3  14 o 3.4565 1.1380 -8.4839  14.125  0.2254    34.070  -10.2916  15.522  4.2685 1.9169 2.6445 1.2270 1.624020       2.275948  
1 1 1 18 3  15 f 3.4409 1.0836 -0.2090  13.948  -28.6823  31.496  6.7376    15.557  3.4513 1.6455 3.4304 1.4105 0.2092242E-01  2.167295  
1 1 1 18 3  16 o 7.9473 1.2325 94.814   18.257  32.784    38.902  112.336   20.676  5.5685 2.2526 10.326 1.0011 -4.757598      2.465090  
1 1 1 18 3  17 o 3.7339 1.1418 4.3366   15.519  -33.0120  34.456  13.841    17.382  3.5262 1.6919 3.9416 1.5338 -0.4154015     2.283608  
1 1 1 18 3  18 o 9.3683 1.1180 74.460   17.937  167.787   38.927  49.304    20.210  12.213 1.5937 6.5240 1.5683 5.688668       2.235932  
1 1 1 18 3  19 o 9.6690 1.0928 99.265   21.132  0.0000    0.0000  99.265    21.132  ?      ?      9.6690 1.0928 ?              ?         
1 1 1 18 3  20 o 11.161 1.0058 117.783  19.676  187.809   41.861  97.925    22.291  12.783 1.6374 9.5395 1.1684 3.243063       2.011525  
1 1 1 18 3  21 f 6.2048 1.5408 43.555   22.903  73.127    39.826  28.943    27.994  7.2746 2.3779 5.1351 1.9599 2.139526       3.081513  
1 1 1 18 3  22 o 3.7730 1.1910 1.4806   17.620  -49.2335  42.326  12.111    19.379  3.6414 1.7770 3.9047 1.5863 -0.2632957     2.382030  
1 1 1 18 3  23 o 3.1749 1.0729 -16.6814 17.256  -54.1753  38.290  -7.1255   19.331  3.3080 1.6296 3.0417 1.3961 0.2662175      2.145843  
1 1 1 18 3  24 o 3.0852 1.0729 -23.0673 18.137  -36.6460  41.286  -19.8202  20.189  3.5074 1.7207 2.6629 1.2821 0.8444729      2.145876  
1 1 1 18 3  25 o 8.6274 1.5349 95.669   22.601  183.870   50.303  73.362    25.298  10.078 2.5062 7.1770 1.7728 2.900756       3.069883  
1 1 1 18 3  26 o 5.6882 1.5343 59.662   21.841  90.224    46.614  51.065    24.723  5.8622 2.4290 5.5142 1.8751 0.3479342      3.068596  
1 1 1 18 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 4  0  o 2.5669 1.2389 -16.0790 19.637  -3.6263   29.155  -26.4189  26.567  2.9132 1.9255 2.2206 1.5594 -0.000000      0.000000  
1 1 1 18 4  1  o 8.9125 0.9714 86.054   16.657  71.087    23.652  100.780   23.462  8.0169 1.5310 9.8082 1.1960 -1.791285      1.942789  
1 1 1 18 4  2  o 5.4586 1.2270 33.172   15.083  35.015    20.832  31.141    21.868  5.5856 1.7070 5.3317 1.7630 0.2539454      2.453979  
1 1 1 18 4  3  o 3.1566 1.0082 -7.5726  13.653  -2.6437   18.506  -13.4599  20.225  3.2744 1.4448 3.0389 1.4066 0.2355056      2.016476  
1 1 1 18 4  4  o 4.8942 1.2266 24.734   15.081  20.945    20.941  28.817    21.737  4.6373 1.7108 5.1511 1.7582 -0.5137863     2.453238  
1 1 1 18 4  5  o 8.8228 0.9905 84.318   16.879  69.310    23.327  100.810   24.453  7.8833 1.5347 9.7623 1.2524 -1.878948      1.980910  
1 1 1 18 4  6  o 5.9783 1.2339 41.343   15.649  41.521    21.378  41.138    22.971  5.9995 1.7026 5.9572 1.7864 0.4225779E-01  2.467774  
1 1 1 18 4  7  o 4.0702 1.0408 5.2322   13.961  34.470    19.377  -26.3218  20.130  5.4775 1.6403 2.6629 1.2817 2.814590       2.081635  
1 1 1 18 4  8  f 10.101 0.8827 108.959  17.803  116.868   25.369  101.285   24.990  10.482 1.2101 9.7209 1.2854 0.7610817      1.765409  
1 1 1 18 4  9  o 10.992 0.9800 121.447  17.805  150.876   39.475  113.931   19.949  11.527 1.7123 10.456 0.9539 1.070796       1.960064  
1 1 1 18 4  10 o 8.2905 1.2331 96.153   16.488  54.794    37.067  106.355   18.409  6.4895 2.2914 10.091 0.9121 -3.601945      2.466241  
1 1 1 18 4  11 f 3.2993 1.0895 -7.5357  13.523  -14.2023  32.882  -6.1787   14.836  3.8585 1.7887 2.7401 1.2444 1.118426       2.178962  
1 1 1 18 4  12 o 10.585 1.0518 112.591  18.142  152.618   41.571  103.175   20.163  11.304 1.8387 9.8658 1.0219 1.438467       2.103610  
1 1 1 18 4  13 o 7.5337 1.2444 74.758   16.951  53.733    34.906  81.246    19.391  6.3668 2.2254 8.7005 1.1144 -2.333718      2.488846  
1 1 1 18 4  14 o 9.7791 1.2230 111.916  18.784  114.049   40.707  111.339   21.174  9.3157 2.2169 10.243 1.0336 -0.9269400     2.446033  
1 1 1 18 4  15 o 7.1311 1.2155 75.294   17.979  16.161    39.782  90.472    20.155  5.0367 2.1717 9.2254 1.0924 -4.188669      2.430922  
1 1 1 18 4  16 o 8.7811 1.2811 104.831  18.515  70.086    39.039  114.915   21.031  7.1396 2.3553 10.423 1.0089 -3.283063      2.562295  
1 1 1 18 4  17 o 14.491 0.8956 220.797  22.080  242.929   45.713  214.062   25.217  14.650 1.5602 14.333 0.8797 0.3162651      1.791104  
1 1 1 18 4  18 o 8.4539 1.3217 94.195   18.695  69.438    40.955  100.711   21.011  7.1621 2.4136 9.7456 1.0780 -2.583586      2.643370  
1 1 1 18 4  19 o 5.0898 1.4025 21.952   16.693  41.851    39.234  17.554    18.446  5.9331 2.3055 4.2465 1.5979 1.686553       2.805100  
1 1 1 18 4  20 o 13.476 0.9612 192.740  21.746  211.537   45.747  187.252   24.717  13.564 1.6863 13.387 0.9232 0.1774120      1.922459  
1 1 1 18 4  21 o 4.9776 1.4130 25.201   22.700  -1.7192   39.834  38.149    27.625  4.4256 2.0211 5.5297 1.9754 -1.104058      2.826079  
1 1 1 18 4  22 o 4.2322 1.2630 13.945   17.374  -13.5796  39.774  20.435    19.315  4.1064 1.9245 4.3580 1.6360 -0.2516026     2.525939  
1 1 1 18 4  23 o 8.7776 1.4358 91.518   20.796  138.280   46.844  80.040    23.209  9.3998 2.4623 8.1553 1.4773 1.244505       2.871509  
1 1 1 18 4  24 o 6.9938 1.4897 79.285   21.519  80.222    49.490  79.066    23.896  6.1717 2.5242 7.8159 1.5830 -1.644274      2.979490  
1 1 1 18 4  25 o 6.9899 1.5269 81.681   21.540  105.132   47.297  75.544    24.195  6.6558 2.5458 7.3239 1.6866 -0.6680899     3.053808  
1 1 1 18 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 4  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 5  0  o 12.088 1.1699 160.634  26.695  162.276   39.251  159.221   36.413  12.104 1.7223 12.072 1.5837 -0.000000      0.000000  
1 1 1 18 5  1  o 6.2702 1.0651 42.068   16.049  5.6292    22.704  78.458    22.689  3.9555 1.6708 8.5849 1.3214 -4.629499      2.130187  
1 1 1 18 5  2  o 14.500 0.7087 218.148  20.536  227.144   29.020  209.123   29.065  14.811 0.9797 14.189 1.0242 0.6222372      1.417325  
1 1 1 18 5  3  o 15.740 0.6895 258.010  21.580  283.863   30.179  230.958   30.871  16.587 0.9097 14.893 1.0364 1.693497       1.379042  
1 1 1 18 5  4  o 8.2035 1.0196 73.986   16.389  71.389    22.980  76.675    23.380  7.9848 1.4939 8.4222 1.3880 -0.4373579     2.039186  
1 1 1 18 5  5  o 9.1178 0.9281 89.684   16.887  84.500    24.099  94.685    23.670  8.8323 1.3642 9.4033 1.2586 -0.5710783     1.856126  
1 1 1 18 5  6  o 5.1935 1.2244 29.940   15.061  24.039    21.158  36.001    21.443  4.7989 1.7272 5.5882 1.7359 -0.7893405     2.448808  
1 1 1 18 5  7  o 5.0281 1.1515 25.293   14.762  45.545    21.116  5.9338    20.645  6.2638 1.6592 3.7923 1.5971 2.471543       2.302918  
1 1 1 18 5  8  o 12.793 0.7690 173.482  19.582  155.115   27.735  191.737   27.650  12.077 1.1483 13.510 1.0233 -1.433455      1.538081  
1 1 1 18 5  9  o 8.9511 1.0036 89.296   17.521  100.069   25.507  79.672    24.109  9.5542 1.3349 8.3479 1.4991 1.206311       2.007277  
1 1 1 18 5  10 o 8.8154 0.9815 85.911   17.267  84.180    25.055  87.477    23.828  8.6988 1.4402 8.9320 1.3339 -0.2331638     1.962965  
1 1 1 18 5  11 o 6.5412 1.3357 49.153   15.449  59.480    37.130  46.991    16.989  6.6554 2.2970 6.4270 1.3639 0.2284198      2.671391  
1 1 1 18 5  12 f 4.6930 1.2587 23.788   15.062  4.7685    36.335  27.734    16.551  4.4958 2.0020 4.8901 1.5261 -0.3943129     2.517328  
1 1 1 18 5  13 o 11.214 1.1658 151.742  19.358  135.070   42.654  156.067   21.724  10.216 2.1553 12.212 0.8895 -1.995868      2.331664  
1 1 1 18 5  14 o 5.9132 1.2157 47.681   16.285  6.5462    37.099  57.499    18.125  4.6459 2.0481 7.1805 1.3104 -2.534578      2.431435  
1 1 1 18 5  15 o 5.8198 1.3625 43.880   19.920  12.166    38.934  55.125    23.184  4.8608 2.1216 6.7788 1.7101 -1.917978      2.725046  
1 1 1 18 5  16 o 3.7519 1.1057 5.9937   15.012  -54.4212  35.730  18.945    16.543  3.2593 1.5994 4.2446 1.5273 -0.9853363     2.211483  
1 1 1 18 5  17 o 12.616 0.9648 172.966  20.025  174.229   42.361  172.603   22.724  12.338 1.7167 12.895 0.8812 -0.5569563     1.929679  
1 1 1 18 5  18 o 6.3893 1.4378 45.248   17.544  62.332    40.092  41.202    19.511  6.8501 2.3856 5.9285 1.6058 0.9215951      2.875683  
1 1 1 18 5  19 o 5.9380 1.3504 45.279   17.585  27.319    39.306  49.774    19.663  5.3463 2.2241 6.5297 1.5320 -1.183357      2.700726  
1 1 1 18 5  20 o 4.7325 1.3582 16.403   16.796  35.340    36.995  11.486    18.851  5.5737 2.2165 3.8913 1.5702 1.682418       2.716334  
1 1 1 18 5  21 o 8.4373 1.5511 88.544   25.023  129.265   45.150  70.491    30.063  9.5557 2.3732 7.3189 1.9978 2.236722       3.102188  
1 1 1 18 5  22 o 4.6756 1.3182 24.547   17.933  -2.2737   42.472  30.367    19.784  4.3889 2.0339 4.9623 1.6775 -0.5733895     2.636431  
1 1 1 18 5  23 o 6.5413 1.5482 47.587   19.428  126.780   46.871  31.157    21.349  8.2824 2.5654 4.8001 1.7340 3.482263       3.096470  
1 1 1 18 5  24 o 9.0813 1.4137 135.121  21.710  109.463   48.832  141.443   24.237  7.0363 2.6092 11.126 1.0892 -4.089992      2.827421  
1 1 1 18 5  25 f 4.5678 1.4288 10.827   19.207  101.273   47.764  -6.6187   20.978  6.1880 2.4986 2.9475 1.3866 3.240454       2.857562  
1 1 1 18 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 5  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 6  0  o 5.9590 1.6233 50.521   21.043  81.781    31.674  25.823    28.154  7.8821 2.3128 4.0358 2.2784 -0.000000      0.000000  
1 1 1 18 6  1  o 11.723 0.7985 145.289  18.717  147.731   26.342  142.799   26.599  11.831 1.1133 11.614 1.1451 0.2168245      1.597069  
1 1 1 18 6  2  o 6.4428 1.2207 48.691   16.047  48.482    22.646  48.903    22.743  6.4293 1.7253 6.4562 1.7274 -0.2685261E-01 2.441410  
1 1 1 18 6  3  o 12.358 0.7666 160.964  18.888  166.237   25.999  155.072   27.485  12.602 1.0316 12.115 1.1344 0.4870853      1.533295  
1 1 1 18 6  4  o 2.7301 0.9209 -22.9382 14.052  -17.6347  19.643  -28.4977  20.111  2.8460 1.3397 2.6141 1.2638 0.2319255      1.841785  
1 1 1 18 6  5  o 4.9202 1.2224 25.076   15.506  35.918    21.694  13.753    22.172  5.5783 1.7482 4.2621 1.7089 1.316220       2.444703  
1 1 1 18 6  6  o 5.8084 1.2324 39.736   15.644  32.950    22.759  45.814    21.539  5.3653 1.7993 6.2515 1.6847 -0.8862586     2.464845  
1 1 1 18 6  7  o 4.1799 1.1844 13.818   15.038  16.206    21.950  11.706    20.644  4.3288 1.7118 4.0310 1.6374 0.2977552      2.368789  
1 1 1 18 6  8  o 13.286 0.7489 187.492  19.892  191.228   27.943  183.653   28.326  13.434 1.0400 13.138 1.0780 0.2962484      1.497874  
1 1 1 18 6  9  o 4.2506 1.1908 14.981   15.355  6.8405    22.973  21.554    20.642  3.9330 1.6719 4.5683 1.6960 -0.6353288     2.381507  
1 1 1 18 6  10 o 10.550 0.8980 121.523  18.905  133.233   27.429  110.927   26.092  11.054 1.2407 10.046 1.2986 1.007332       1.796026  
1 1 1 18 6  11 o 3.6943 1.1214 1.8506   15.703  -14.1373  23.442  14.864    21.150  3.2111 1.4959 4.1775 1.6711 -0.9664550     2.242834  
1 1 1 18 6  12 o 12.500 0.8345 169.139  20.853  165.119   29.624  173.086   29.359  12.336 1.2007 12.664 1.1592 -0.3279209     1.668968  
1 1 1 18 6  13 o 11.399 0.9008 142.217  20.008  179.014   28.590  106.894   28.011  12.971 1.1020 9.8269 1.4252 3.144505       1.801599  
1 1 1 18 6  14 o 13.687 0.9370 198.729  21.042  216.370   45.572  193.949   23.722  13.723 1.6604 13.651 0.8689 0.7183075E-01  1.874046  
1 1 1 18 6  15 o 3.2373 1.0909 -12.4136 14.849  -30.5761  36.882  -8.8996   16.223  3.7116 1.7726 2.7631 1.2721 0.9485757      2.181853  
1 1 1 18 6  16 o 9.7679 1.1250 85.958   18.770  161.912   41.297  66.181    21.073  11.868 1.7398 7.6676 1.4266 4.200478       2.249953  
1 1 1 18 6  17 o 10.026 1.2804 118.287  19.727  118.844   44.063  118.148   22.061  9.4789 2.3387 10.573 1.0433 -1.093579      2.560841  
1 1 1 18 6  18 o 12.356 1.0462 169.468  20.800  171.801   45.104  168.837   23.441  12.009 1.8779 12.704 0.9226 -0.6949196     2.092327  
1 1 1 18 6  19 o 4.8066 1.3184 23.382   16.949  5.9709    37.875  27.743    18.953  4.6694 2.0634 4.9438 1.6416 -0.2743845     2.636730  
1 1 1 18 6  20 o 6.8504 1.5328 55.641   20.475  0.0000    0.0000  55.641    20.475  ?      ?      6.8504 1.5328 ?              ?         
1 1 1 18 6  21 o 3.2537 1.1105 -26.4073 20.005  -40.1842  37.147  -20.7795  23.742  3.4885 1.6939 3.0190 1.4364 0.4694433      2.220902  
1 1 1 18 6  22 o 7.1171 1.4794 49.215   18.857  132.126   45.019  31.573    20.766  9.2536 2.4090 4.9807 1.7179 4.272821       2.958756  
1 1 1 18 6  23 o 3.3016 1.1432 -26.6640 16.567  16.980    39.139  -36.1906  18.286  4.4228 2.0134 2.1804 1.0834 2.242405       2.286358  
1 1 1 18 6  24 o 5.5970 1.4507 51.791   19.345  64.671    47.328  49.208    21.196  5.3815 2.3443 5.8125 1.7094 -0.4310369     2.901365  
1 1 1 18 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 7  0  o 3.7486 1.6058 17.903   22.534  10.625    32.935  24.310    30.898  3.4940 2.2074 4.0032 2.3327 -0.000000      0.000000  
1 1 1 18 7  1  o 6.8757 1.1884 55.329   16.765  36.098    23.563  75.047    23.858  5.5918 1.8291 8.1597 1.5178 -2.567896      2.376842  
1 1 1 18 7  2  o 9.8341 0.9364 104.852  18.287  115.807   25.538  93.323    26.199  10.415 1.2260 9.2528 1.4157 1.162695       1.872761  
1 1 1 18 7  3  o 10.018 0.9078 108.593  17.978  126.245   25.420  90.930    25.429  10.899 1.1662 9.1364 1.3916 1.762828       1.815627  
1 1 1 18 7  4  f 5.9572 1.1490 40.045   16.323  69.191    23.013  10.533    23.156  7.7832 1.5329 4.1311 1.7119 3.652066       2.297919  
1 1 1 18 7  5  o 7.1965 1.1884 61.330   16.850  53.789    23.697  69.042    23.963  6.6929 1.7504 7.7001 1.6079 -1.007240      2.376847  
1 1 1 18 7  6  o 4.2467 1.1141 10.906   15.146  -17.1721  22.261  35.105    20.666  3.0506 1.4329 5.4428 1.7064 -2.392173      2.228243  
1 1 1 18 7  7  o 11.176 0.8527 134.604  19.042  142.870   27.471  126.959   26.419  11.515 1.1929 10.838 1.2189 0.6772766      1.705461  
1 1 1 18 7  8  o 9.0321 1.0068 90.458   18.183  93.103    25.963  87.913    25.472  9.1663 1.4162 8.8978 1.4314 0.2684860      2.013583  
1 1 1 18 7  9  o 5.6895 1.2896 39.947   16.661  36.759    23.823  43.000    23.310  5.4854 1.8408 5.8937 1.8065 -0.4082842     2.579161  
1 1 1 18 7  10 o 5.9829 1.2276 42.716   16.723  63.486    23.946  22.940    23.366  7.2746 1.6798 4.6913 1.7906 2.583255       2.455159  
1 1 1 18 7  11 o 6.6794 1.2956 55.236   17.800  55.892    26.109  54.666    24.331  6.6879 1.8759 6.6708 1.7875 0.1712227E-01  2.591144  
1 1 1 18 7  12 o 8.8881 1.0666 89.453   18.489  86.114    26.796  92.487    25.544  8.6162 1.6143 9.1600 1.3943 -0.5438118     2.133112  
1 1 1 18 7  13 o 6.5186 1.2943 51.815   17.527  53.980    25.845  49.971    23.848  6.6220 1.8695 6.4151 1.7905 0.2069030      2.588656  
1 1 1 18 7  14 o 7.6464 1.1917 69.601   18.416  94.994    26.684  46.505    25.449  9.1928 1.4513 6.0999 1.8905 3.092870       2.383366  
1 1 1 18 7  15 o 3.9772 1.2048 5.8409   17.112  4.5128    24.575  7.0909    23.842  3.9474 1.7044 4.0070 1.7033 -0.5957747E-01 2.409623  
1 1 1 18 7  16 o 5.1362 1.3071 30.861   16.766  0.5004    40.710  37.062    18.399  4.6385 2.0881 5.6338 1.5728 -0.9952593     2.614178  
1 1 1 18 7  17 o 11.292 1.0065 125.680  19.603  174.975   41.845  111.819   22.189  12.321 1.6981 10.262 1.0811 2.059417       2.013010  
1 1 1 18 7  18 o 4.8632 1.2083 26.189   17.787  -48.8253  42.138  42.453    19.620  3.7249 1.8076 6.0014 1.6039 -2.276474      2.416629  
1 1 1 18 7  19 o 4.1441 1.2799 8.8322   16.513  0.5709    40.221  10.507    18.110  4.5150 2.0498 3.7731 1.5332 0.7419825      2.559786  
1 1 1 18 7  20 o 4.7783 1.3572 23.969   17.877  9.7605    42.401  27.040    19.715  4.7595 2.1378 4.7970 1.6727 -0.3750563E-01 2.714470  
1 1 1 18 7  21 o 3.8824 1.2646 -1.5455  20.589  -11.9887  41.402  1.8858    23.732  4.1232 1.9422 3.6417 1.6201 0.4814842      2.529162  
1 1 1 18 7  22 o 4.3330 1.3414 17.614   17.792  30.999    43.801  14.969    19.471  4.8230 2.1690 3.8431 1.5789 0.9798677      2.682806  
1 1 1 18 7  23 o 8.8009 1.4011 106.955  20.353  134.534   45.554  100.077   22.750  8.4168 2.5137 9.1850 1.2384 -0.7682600     2.802242  
1 1 1 18 7  24 f 4.3954 1.2033 30.282   18.863  -42.9344  46.936  44.386    20.600  3.4025 1.6978 5.3882 1.7056 -1.985661      2.406594  
1 1 1 18 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 7  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 8  0  o 13.953 1.1139 213.336  30.009  225.336   44.095  202.984   40.956  14.317 1.5902 13.590 1.5602 -0.000000      0.000000  
1 1 1 18 8  1  o 8.3408 1.0800 79.478   17.511  90.744    24.725  68.140    24.803  9.0882 1.3603 7.5934 1.6779 1.494800       2.160013  
1 1 1 18 8  2  o 3.4148 1.0775 -8.5063  15.468  -23.1170  20.821  9.4892    23.107  2.7783 1.3283 4.0512 1.6970 -1.272931      2.155004  
1 1 1 18 8  3  o 4.6633 1.2264 20.547   15.909  8.1478    21.748  34.820    23.334  3.9083 1.6422 5.4184 1.8218 -1.510066      2.452708  
1 1 1 18 8  4  o 9.7020 0.9267 103.009  17.957  102.459   24.750  103.621   26.095  9.6963 1.2762 9.7077 1.3440 -0.1135159E-01 1.853436  
1 1 1 18 8  5  o 5.9902 1.2400 42.931   16.481  28.318    23.322  57.509    23.295  5.0321 1.8131 6.9484 1.6920 -1.916314      2.480026  
1 1 1 18 8  6  o 10.058 0.9228 110.213  18.545  116.893   26.868  104.134   25.629  10.353 1.2975 9.7626 1.3126 0.5907907      1.845665  
1 1 1 18 8  7  o 5.1754 1.2729 31.506   16.138  29.152    22.336  34.076    23.341  5.0203 1.7781 5.3304 1.8220 -0.3101406     2.545786  
1 1 1 18 8  8  o 4.3018 1.1624 10.974   16.280  -15.8677  23.485  35.807    22.588  3.1640 1.4816 5.4396 1.7915 -2.275538      2.324740  
1 1 1 18 8  9  f 6.2083 1.3034 48.005   17.502  41.638    25.091  54.039    24.426  5.7981 1.8870 6.6184 1.7984 -0.8203783     2.606771  
1 1 1 18 8  10 o 8.8853 1.1078 91.988   18.753  65.355    26.346  119.340   26.700  7.3139 1.8107 10.457 1.2767 -3.142847      2.215554  
1 1 1 18 8  11 o 6.5990 1.2257 51.265   17.841  80.325    25.888  24.974    24.623  8.3142 1.6150 4.8838 1.8443 3.430449       2.451484  
1 1 1 18 8  12 o 2.9051 0.9704 -25.2571 15.534  -47.6227  22.510  -4.9209   21.465  2.4415 1.2112 3.3687 1.5164 -0.9272060     1.940740  
1 1 1 18 8  13 o 5.5792 1.2538 36.111   17.378  57.399    24.399  14.194    24.756  6.8461 1.7692 4.3123 1.7770 2.533731       2.507541  
1 1 1 18 8  14 o 6.4502 1.2668 51.228   18.376  26.662    27.081  72.195    25.018  5.0433 1.9270 7.8572 1.6448 -2.813966      2.533502  
1 1 1 18 8  15 o 4.8124 1.3090 21.245   18.108  34.459    26.917  10.322    24.474  5.4501 1.9496 4.1746 1.7474 1.275521       2.618059  
1 1 1 18 8  16 o 5.5022 1.3045 35.201   18.120  17.095    27.085  49.873    24.381  4.5927 1.8716 6.4118 1.8178 -1.819153      2.609056  
1 1 1 18 8  17 o 4.9016 1.3049 23.816   18.673  5.0066    27.867  39.145    25.157  4.1257 1.7980 5.6775 1.8916 -1.551798      2.609758  
1 1 1 18 8  18 o 4.0279 1.2491 7.4358   15.206  -5.3000   40.215  9.5606    16.426  4.4178 2.0225 3.6380 1.4665 0.7797978      2.498228  
1 1 1 18 8  19 o 5.7471 1.3794 44.781   22.337  -6.3801   43.930  62.620    25.940  4.4583 2.0670 7.0359 1.8272 -2.577540      2.758804  
1 1 1 18 8  20 o 7.9734 1.3742 89.424   19.598  71.341    43.923  93.920    21.899  6.7285 2.4785 9.2183 1.1878 -2.489811      2.748404  
1 1 1 18 8  21 o 4.4974 1.4163 8.2580   22.056  45.891    44.779  -3.7959   25.343  5.4996 2.3360 3.4953 1.6021 2.004296       2.832574  
1 1 1 18 8  22 o 3.7311 1.1575 8.2245   17.145  -40.7495  40.257  19.076    18.950  3.4112 1.6786 4.0511 1.5941 -0.6399770     2.314944  
1 1 1 18 8  23 o 5.4572 1.4192 50.977   19.350  54.721    47.394  50.229    21.197  5.0636 2.2683 5.8508 1.7063 -0.7871976     2.838403  
1 1 1 18 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  0  o 9.7914 1.5686 118.824  26.763  127.674   38.525  110.568   37.206  10.256 2.1291 9.3265 2.3042 -0.000000      0.000000  
1 1 1 18 9  1  o 3.4364 1.0520 -10.1562 15.305  16.933    21.223  -39.5077  22.091  4.3273 1.6917 2.5454 1.2508 1.781825       2.103912  
1 1 1 18 9  2  f 4.5491 1.1236 11.335   15.944  -21.8579  22.367  45.631    22.735  2.9430 1.3985 6.1551 1.7590 -3.212018      2.247163  
1 1 1 18 9  3  o 5.8159 1.1855 40.772   15.926  58.421    21.518  19.397    23.682  7.0828 1.5611 4.5490 1.7846 2.533813       2.371076  
1 1 1 18 9  4  o 3.7352 1.1486 1.3725   16.263  11.090    23.506  -7.5504   22.524  4.1234 1.7181 3.3470 1.5251 0.7764232      2.297297  
1 1 1 18 9  5  o 10.454 0.9174 121.431  18.832  97.212    26.613  145.721   26.652  9.2947 1.4316 11.613 1.1475 -2.318612      1.834714  
1 1 1 18 9  6  o 5.0899 1.2208 28.682   16.193  10.159    23.347  45.850    22.478  4.0602 1.7035 6.1196 1.7490 -2.059456      2.441547  
1 1 1 18 9  7  o 11.644 0.8350 146.724  19.440  144.508   27.605  148.905   27.381  11.545 1.1955 11.742 1.1659 -0.1966152     1.669923  
1 1 1 18 9  8  o 3.3477 1.0721 -9.5678  15.812  5.1009    23.131  -22.4359  21.665  3.8412 1.6561 2.8543 1.3619 0.9868958      2.144133  
1 1 1 18 9  9  o 8.8863 1.1150 92.211   18.701  134.100   27.054  53.883    25.879  11.151 1.2130 6.6213 1.8713 4.529959       2.230034  
1 1 1 18 9  10 o 7.8861 1.1989 73.486   18.354  78.820    26.207  68.352    25.712  8.2031 1.6545 7.5691 1.7355 0.6339769      2.397768  
1 1 1 18 9  11 o 5.2514 1.3102 31.960   17.344  25.627    25.401  37.491    23.738  4.9184 1.8694 5.5844 1.8364 -0.6659336     2.620465  
1 1 1 18 9  12 o 11.360 0.9425 146.215  20.637  112.193   30.435  175.167   28.076  9.9294 1.5326 12.790 1.0976 -2.860971      1.885065  
1 1 1 18 9  13 o 8.6590 1.1407 86.110   19.291  81.782    27.905  90.071    26.699  8.3203 1.7332 8.9977 1.4836 -0.6773920     2.281457  
1 1 1 18 9  14 o 9.6135 1.1116 105.968  20.636  95.006    30.140  115.641   28.313  8.9686 1.7431 10.258 1.3800 -1.289749      2.223239  
1 1 1 18 9  15 o 20.115 0.7150 428.357  28.571  382.686   41.017  471.402   39.820  18.997 1.0796 21.233 0.9377 -2.236359      1.429938  
1 1 1 18 9  16 o 9.4320 1.1476 104.667  20.685  85.874    30.287  121.096   28.318  8.3819 1.8557 10.482 1.3508 -2.100164      2.295273  
1 1 1 18 9  17 o 4.2277 1.2652 9.5581   18.254  14.516    28.200  5.9828    23.947  4.5088 1.8805 3.9465 1.6930 0.5623629      2.530324  
1 1 1 18 9  18 o 7.7763 1.3245 75.580   20.602  98.128    30.724  57.158    27.771  8.9291 1.7828 6.6234 1.9591 2.305684       2.648918  
1 1 1 18 9  19 o 7.4667 1.5714 71.753   23.266  101.702   44.084  60.190    27.392  8.1715 2.4802 6.7620 1.9302 1.409547       3.142743  
1 1 1 18 9  20 o 7.6011 1.4548 65.934   17.908  113.207   45.440  57.242    19.484  8.3178 2.5166 6.8844 1.4604 1.433388       2.909595  
1 1 1 18 9  21 o 6.2678 1.5295 66.827   23.252  64.424    43.620  67.781    27.482  5.7871 2.3687 6.7485 1.9356 -0.9613657     3.058942  
1 1 1 18 9  22 o 4.6634 1.3091 33.014   18.521  9.3649    44.363  38.006    20.383  4.2028 1.9890 5.1241 1.7024 -0.9212842     2.618106  
1 1 1 18 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 9  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 10 0  o 8.7476 1.7249 103.121  26.226  115.424   37.431  91.257    36.757  9.5263 2.2634 7.9689 2.6036 -0.000000      0.000000  
1 1 1 18 10 1  o 4.9888 1.2509 26.276   17.106  44.849    23.910  6.8041    24.482  6.0040 1.8275 3.9736 1.7084 2.030375       2.501701  
1 1 1 18 10 2  o 5.2918 1.2969 33.167   16.706  29.508    22.577  37.596    24.837  5.0416 1.7874 5.5419 1.8795 -0.5003481     2.593707  
1 1 1 18 10 3  o 5.3726 1.2965 34.622   16.676  34.172    22.600  35.160    24.707  5.3403 1.7929 5.4048 1.8733 -0.6447649E-01 2.593005  
1 1 1 18 10 4  o 9.0361 1.0713 93.706   18.605  74.185    25.873  114.611   26.773  7.8706 1.6938 10.202 1.3122 -2.331120      2.142620  
1 1 1 18 10 5  o 4.0506 1.1972 10.262   16.243  7.4391    22.772  13.185    23.175  3.9120 1.6638 4.1892 1.7219 -0.2772164     2.394443  
1 1 1 18 10 6  o 3.2201 1.0352 -14.0037 15.632  -36.2344  22.649  6.2212    21.603  2.6415 1.2914 3.7987 1.6182 -1.157157      2.070348  
1 1 1 18 10 7  o 7.9855 1.1655 74.757   17.998  69.048    25.158  80.743    25.759  7.6338 1.6922 8.3371 1.6030 -0.7032928     2.330941  
1 1 1 18 10 8  o 3.5882 1.1316 -3.0848  16.592  -9.0516   24.364  2.0748    22.657  3.4552 1.5789 3.7212 1.6215 -0.2660029     2.263255  
1 1 1 18 10 9  o 8.5516 1.1722 88.140   19.357  54.645    27.760  119.835   27.004  6.6133 1.9594 10.490 1.2872 -3.876584      2.344370  
1 1 1 18 10 10 o 3.8215 1.1561 1.9644   16.580  -14.2509  23.731  17.429    23.175  3.2363 1.5068 4.4067 1.7537 -1.170467      2.312105  
1 1 1 18 10 11 o 7.6914 1.2535 71.479   18.884  78.850    27.615  65.005    25.882  8.0845 1.7580 7.2983 1.7874 0.7862577      2.507019  
1 1 1 18 10 12 o 8.9003 1.1516 90.656   20.012  88.472    29.170  92.598    27.506  8.6756 1.7417 9.1250 1.5072 -0.4493704     2.303270  
1 1 1 18 10 13 o 7.1573 1.2225 63.829   19.015  31.762    28.609  89.206    25.450  5.3296 1.9930 8.9850 1.4163 -3.655350      2.444981  
1 1 1 18 10 14 o 4.1382 1.2431 8.2770   17.912  8.9564    26.143  7.6759    24.591  4.2067 1.7857 4.0696 1.7299 0.1370583      2.486245  
1 1 1 18 10 15 o 4.9259 1.3454 23.364   19.134  36.887    28.467  12.219    25.842  5.5541 2.0029 4.2977 1.7970 1.256321       2.690858  
1 1 1 18 10 16 o 4.8411 1.3285 20.363   20.034  -2.8294   30.190  38.611    26.779  4.0151 1.8037 5.6670 1.9510 -1.651895      2.657008  
1 1 1 18 10 17 o 6.3498 1.3140 51.838   19.906  22.669    29.225  77.081    27.187  4.7938 1.9478 7.9058 1.7642 -3.111991      2.628001  
1 1 1 18 10 18 o 3.6775 1.1690 -4.3346  18.798  -26.0939  29.843  9.9761    24.202  3.3222 1.5888 4.0327 1.7152 -0.7105432     2.338024  
1 1 1 18 10 19 o 4.0162 1.2583 6.1436   19.506  11.673    31.545  2.7205    24.819  4.3132 1.8954 3.7191 1.6555 0.5940597      2.516602  
1 1 1 18 10 20 o 3.8808 1.2124 6.5936   18.634  26.326    28.698  -7.7901   24.501  4.5203 1.8921 3.2414 1.5164 1.278904       2.424784  
1 1 1 18 10 21 o 6.5344 1.3753 69.958   21.480  42.183    32.779  90.861    28.436  5.0765 2.0628 7.9924 1.8197 -2.915949      2.750692  
1 1 1 18 10 22 o 4.5008 1.3994 29.150   22.094  54.922    41.811  19.166    26.024  5.0290 2.1967 3.9725 1.7342 1.056490       2.798798  
1 1 1 18 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 10 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 0  o 3.7326 1.5853 18.025   22.979  -3.5431   36.337  32.397    29.663  3.1378 2.0981 4.3274 2.3773 -0.000000      0.000000  
1 1 1 18 11 1  o 4.7219 1.2586 21.844   16.760  9.9940    23.116  34.976    24.335  4.0464 1.6963 5.3973 1.8597 -1.350948      2.517128  
1 1 1 18 11 2  o 5.8982 1.2764 40.876   17.464  22.867    23.861  61.655    25.630  4.7093 1.8065 7.0870 1.8037 -2.377684      2.552824  
1 1 1 18 11 3  o 9.2392 1.0194 95.092   18.818  91.436    25.937  99.156    27.345  9.0585 1.4317 9.4198 1.4514 -0.3612490     2.038707  
1 1 1 18 11 4  o 7.3642 1.1940 64.702   18.156  40.331    25.653  89.161    25.700  5.7676 1.9096 8.9609 1.4340 -3.193333      2.388058  
1 1 1 18 11 5  o 6.9390 1.2729 58.453   18.065  46.756    25.504  70.230    25.592  6.1794 1.8888 7.6985 1.7069 -1.519130      2.545828  
1 1 1 18 11 6  o 4.1502 1.2179 11.107   16.590  9.4021    24.604  12.528    22.467  4.1369 1.7429 4.1635 1.7016 -0.2666521E-01 2.435769  
1 1 1 18 11 7  o 3.9694 1.1308 1.5832   15.841  29.183    22.964  -23.4727  21.880  5.0776 1.8024 2.8611 1.3661 2.216484       2.261619  
1 1 1 18 11 8  f 7.1988 1.1997 62.736   17.150  50.523    24.677  74.146    23.851  6.4027 1.8335 7.9948 1.5476 -1.592073      2.399328  
1 1 1 18 11 9  o 13.089 0.8328 185.756  21.726  177.171   31.522  193.525   29.986  12.751 1.2361 13.428 1.1165 -0.6776800     1.665685  
1 1 1 18 11 10 o 5.6673 1.3639 38.362   18.480  42.811    27.160  34.526    25.218  5.9114 1.9652 5.4233 1.8918 0.4881048      2.727811  
1 1 1 18 11 11 o 13.337 0.8344 189.801  22.234  195.409   32.327  184.766   30.629  13.512 1.1962 13.162 1.1635 0.3498039      1.668716  
1 1 1 18 11 12 o 8.9404 1.1333 91.780   19.685  106.071   28.134  78.076    27.552  9.7828 1.4379 8.0981 1.7520 1.684644       2.266549  
1 1 1 18 11 13 o 7.6762 1.1178 73.347   19.993  7.5856    29.118  132.003   27.500  4.3051 1.8571 11.047 1.2447 -6.742270      2.235591  
1 1 1 18 11 14 o 5.8785 1.4052 41.960   19.679  51.406    29.359  34.253    26.519  6.3607 2.0386 5.3963 1.9346 0.9643965      2.810429  
1 1 1 18 11 15 f 3.6608 1.1219 -9.0747  17.576  -45.8555  26.676  19.139    23.363  2.7978 1.3747 4.5239 1.7732 -1.726170      2.243702  
1 1 1 18 11 16 o 4.8947 1.3608 25.906   19.570  19.386    31.177  30.145    25.139  4.7222 1.9740 5.0673 1.8735 -0.3451462     2.721534  
1 1 1 18 11 17 o 7.8664 1.4088 81.832   22.128  78.516    33.626  84.365    29.387  7.5693 2.1309 8.1635 1.8435 -0.5941143     2.817692  
1 1 1 18 11 18 o 7.6387 1.4002 78.427   22.031  103.879   32.887  57.707    29.673  8.8808 1.9084 6.3965 2.0494 2.484236       2.800368  
1 1 1 18 11 19 o 3.8178 1.2312 1.2288   20.324  17.085    32.392  -9.0656   26.100  4.3123 1.9067 3.3233 1.5580 0.9890471      2.462320  
1 1 1 18 11 20 o 4.2144 1.3018 17.930   20.324  20.093    33.079  16.619    25.759  4.3533 1.9258 4.0754 1.7523 0.2778950      2.603683  
1 1 1 18 11 21 o 7.5640 1.4150 96.490   22.493  78.897    34.713  109.221   29.530  6.4103 2.2205 8.7177 1.7544 -2.307383      2.829930  
1 1 1 18 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 11 28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 0  o 8.7054 1.7019 109.282  28.502  57.554    40.793  158.624   39.841  5.6401 2.8747 11.771 1.8225 -0.000000      0.000000  
1 1 1 18 12 1  f 7.2631 1.1733 59.552   17.934  30.977    23.861  96.649    27.187  5.2050 1.8384 9.3212 1.4584 -4.116212      2.346563  
1 1 1 18 12 2  f 4.3887 1.2559 13.782   17.329  4.6280    23.415  24.865    25.765  3.8702 1.6674 4.9071 1.8785 -1.036932      2.511766  
1 1 1 18 12 3  o 10.657 1.0115 127.137  20.329  92.104    28.059  165.846   29.494  8.8937 1.6378 12.420 1.1873 -3.526519      2.022922  
1 1 1 18 12 4  o 6.2876 1.2902 48.411   17.304  53.910    23.922  42.375    25.063  6.6791 1.7644 5.8961 1.8829 0.7830377      2.580385  
1 1 1 18 12 5  o 5.2162 1.3133 31.479   17.341  27.080    26.042  34.983    23.244  5.0080 1.8954 5.4245 1.8183 -0.4164591     2.626529  
1 1 1 18 12 6  o 2.7976 0.9538 -27.8043 15.731  -24.1692  23.703  -30.6654  21.029  2.9799 1.4226 2.6154 1.2710 0.3644893      1.907651  
1 1 1 18 12 7  o 4.8899 1.2732 24.643   17.579  7.2675    25.681  39.962    24.114  4.0724 1.7503 5.7075 1.8495 -1.635134      2.546375  
1 1 1 18 12 8  o 5.1165 1.3415 28.336   18.392  36.806    26.933  20.935    25.177  5.5546 1.9541 4.6785 1.8386 0.8761258      2.683070  
1 1 1 18 12 9  o 7.1291 1.2918 61.323   18.887  46.084    26.593  76.836    26.831  6.1623 1.9363 8.0959 1.7106 -1.933630      2.583674  
1 1 1 18 12 10 o 8.2597 1.2196 80.537   19.506  91.442    28.155  70.473    27.050  8.8651 1.6487 7.6542 1.7976 1.210865       2.439159  
1 1 1 18 12 11 o 8.8832 1.2065 92.538   20.653  94.737    29.544  90.437    28.883  8.9893 1.7057 8.7772 1.7068 0.2120724      2.412989  
1 1 1 18 12 12 o 4.4489 1.2842 13.380   18.430  26.650    27.231  2.1635    25.036  5.0272 1.9296 3.8706 1.6951 1.156616       2.568365  
1 1 1 18 12 13 o 4.5668 1.2426 12.317   18.549  -17.3144  26.610  40.323    25.870  3.3770 1.5800 5.7565 1.9182 -2.379472      2.485117  
1 1 1 18 12 14 o 11.161 1.0133 140.109  22.368  124.002   32.525  154.562   30.811  10.442 1.5574 11.880 1.2968 -1.437895      2.026626  
1 1 1 18 12 15 o 9.9035 1.1929 115.661  22.917  139.105   34.403  96.960    30.727  10.940 1.5723 8.8666 1.7943 2.073844       2.385755  
1 1 1 18 12 16 o 6.1494 1.4929 51.347   22.072  52.318    33.499  50.602    29.341  6.1568 2.1778 6.1420 2.0427 0.1487303E-01  2.985862  
1 1 1 18 12 17 o 5.6477 1.3322 33.575   21.554  79.805    31.716  -6.0971   29.381  7.5877 2.0441 3.7078 1.7089 3.879863       2.664335  
1 1 1 18 12 18 o 9.5939 1.3114 123.586  24.003  140.814   37.344  111.458   31.333  10.067 1.9249 9.1207 1.7816 0.9464588      2.622829  
1 1 1 18 12 19 o 3.3716 1.1116 -12.5005 19.787  -47.1421  31.636  9.7593    25.360  2.9138 1.4438 3.8294 1.6905 -0.9156587     2.223141  
1 1 1 18 12 20 o 6.3726 1.3446 59.639   21.671  115.319   33.654  20.193    28.326  8.6163 1.9926 4.1290 1.8057 4.487348       2.689106  
1 1 1 18 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 12 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 0  o 3.5098 1.5931 9.3008   25.593  1.4992    36.044  17.234    36.347  3.2616 2.1509 3.7580 2.3508 -0.000000      0.000000  
1 1 1 18 13 1  o 10.244 1.0683 120.614  20.900  96.385    29.607  144.681   29.508  8.9971 1.7078 11.490 1.2840 -2.493360      2.136688  
1 1 1 18 13 2  o 5.9565 1.1408 35.538   18.734  -13.4061  26.531  84.212    26.457  3.4553 1.6035 8.4577 1.6231 -5.002381      2.281600  
1 1 1 18 13 3  o 12.748 0.8641 178.830  21.694  202.861   29.889  152.075   31.537  13.774 1.0850 11.723 1.3451 2.050332       1.728133  
1 1 1 18 13 4  o 6.1342 1.3647 47.033   18.721  42.215    25.951  52.259    27.032  5.8350 1.9201 6.4334 1.9398 -0.5983171     2.729395  
1 1 1 18 13 5  o 4.0885 1.1746 5.1590   16.571  28.691    24.054  -16.0942  22.860  5.0519 1.8382 3.1252 1.4629 1.926704       2.349232  
1 1 1 18 13 6  o 5.0005 1.3315 26.285   18.183  22.087    25.402  30.696    26.039  4.7668 1.8543 5.2343 1.9113 -0.4675479     2.662996  
1 1 1 18 13 7  o 7.8230 1.3008 73.110   19.954  78.148    29.602  68.913    27.014  8.0518 1.8735 7.5942 1.8052 0.4576006      2.601625  
1 1 1 18 13 8  o 9.4848 1.1737 105.050  21.163  138.803   30.340  73.066    29.534  11.263 1.3469 7.7067 1.9225 3.556080       2.347337  
1 1 1 18 13 9  o 9.8740 1.1058 111.543  21.073  100.360   30.858  121.317   28.848  9.2332 1.7347 10.515 1.3718 -1.281788      2.211553  
1 1 1 18 13 10 o 9.4043 1.2100 105.430  21.701  73.365    30.901  136.633   30.483  7.6559 1.9972 11.153 1.3666 -3.496786      2.420008  
1 1 1 18 13 11 o 15.911 0.7945 271.299  25.244  256.887   35.860  285.459   35.543  15.457 1.1600 16.365 1.0860 -0.9078102     1.588985  
1 1 1 18 13 12 o 3.1989 1.0678 -21.5276 17.828  -15.2304  26.136  -27.0071  24.380  3.4097 1.5854 2.9882 1.4309 0.4215269      2.135669  
1 1 1 18 13 13 o 5.9983 1.3984 45.882   20.322  30.392    30.088  58.878    27.559  5.2008 2.0195 6.7959 1.9347 -1.595119      2.796705  
1 1 1 18 13 14 o 4.7085 1.2193 6.3504   20.776  -57.0727  31.534  55.002    27.618  2.9269 1.4487 6.4901 1.9616 -3.563262      2.438570  
1 1 1 18 13 15 o 13.440 0.9731 205.304  26.053  190.934   37.368  218.896   36.343  12.895 1.4489 13.985 1.2993 -1.089809      1.946155  
1 1 1 18 13 16 o 4.0033 1.2441 1.5492   20.775  -25.7439  31.134  23.456    27.893  3.3540 1.6090 4.6527 1.8981 -1.298687      2.488270  
1 1 1 18 13 17 o 3.5915 1.1913 -8.7722  21.408  1.3614    32.353  -16.6644  28.552  3.8906 1.7932 3.2923 1.5688 0.5982766      2.382608  
1 1 1 18 13 18 f 5.1565 1.4300 40.380   21.423  47.364    32.004  34.710    28.837  5.4195 2.0888 4.8935 1.9535 0.5260901      2.859956  
1 1 1 18 13 19 o 4.4595 1.3419 27.512   20.929  38.129    31.401  19.026    28.074  4.8180 1.9948 4.1010 1.7955 0.7170358      2.683814  
1 1 1 18 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 13 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 0  o 3.1154 1.4736 -8.1719  25.485  8.7428    37.385  -22.8569  34.834  3.5496 2.2857 2.6811 1.8606 -0.000000      0.000000  
1 1 1 18 14 1  o 4.8194 1.2992 18.090   19.061  -4.2727   26.636  41.560    27.287  3.7711 1.6941 5.8678 1.9701 -2.096615      2.598348  
1 1 1 18 14 2  o 8.2979 1.2910 82.359   20.858  76.135    29.249  88.798    29.752  7.9342 1.8733 8.6617 1.7771 -0.7275023     2.582057  
1 1 1 18 14 3  o 9.4437 1.1459 101.507  21.209  98.691    29.812  104.394   30.180  9.2294 1.6768 9.6580 1.5624 -0.4286375     2.291894  
1 1 1 18 14 4  o 4.7529 1.2107 7.9280   18.117  51.995    27.442  -26.1146  24.120  6.5093 1.9526 2.9966 1.4318 3.512627       2.421318  
1 1 1 18 14 5  o 6.3128 1.3417 47.920   18.871  64.203    27.444  33.316    25.991  7.2469 1.8781 5.3788 1.9166 1.868174       2.683433  
1 1 1 18 14 6  o 5.4086 1.3756 33.786   18.989  32.121    26.735  35.480    26.975  5.3152 1.9373 5.5020 1.9534 -0.1868501     2.751185  
1 1 1 18 14 7  o 4.2229 1.2652 9.2036   18.490  10.250    26.706  8.2400    25.626  4.2920 1.8125 4.1537 1.7658 0.1383023      2.530417  
1 1 1 18 14 8  f 20.261 0.7171 433.936  28.927  389.670   40.946  478.043   40.872  19.169 1.0680 21.352 0.9571 -2.182835      1.434104  
1 1 1 18 14 9  o 4.7910 1.3144 20.441   19.174  2.3641    27.701  37.067    26.566  4.0252 1.7724 5.5568 1.9415 -1.531688      2.628808  
1 1 1 18 14 10 o 3.4166 1.1124 -21.1276 19.091  -54.6788  28.772  5.2607    25.517  2.8156 1.3918 4.0177 1.7358 -1.202115      2.224873  
1 1 1 18 14 11 o 10.332 1.1237 121.532  23.166  124.319   34.054  119.132   31.605  10.404 1.6366 10.261 1.5401 0.1430960      2.247324  
1 1 1 18 14 12 o 6.9666 1.4158 63.228   21.474  82.438    30.871  45.220    29.889  8.0304 1.9432 5.9028 2.0595 2.127541       2.831523  
1 1 1 18 14 13 o 12.656 0.9873 181.159  24.977  187.661   36.024  175.140   34.661  12.871 1.3994 12.441 1.3931 0.4301567      1.974605  
1 1 1 18 14 14 o 5.3512 1.4698 35.822   22.480  38.043    33.216  33.945    30.535  5.4531 2.1207 5.2493 2.0356 0.2037992      2.939525  
1 1 1 18 14 15 o 8.3427 1.4313 94.342   24.487  135.704   36.988  62.070    32.672  10.192 1.8840 6.4935 2.1553 3.698333       2.862639  
1 1 1 18 14 16 o 4.7979 1.3183 12.097   22.254  71.785    33.662  -34.2427  29.660  6.5890 2.1877 3.0068 1.4717 3.582208       2.636654  
1 1 1 18 14 17 f 4.3823 1.3086 11.656   21.434  50.672    32.532  -18.2703  28.492  5.5440 2.1135 3.2205 1.5434 2.323466       2.617105  
1 1 1 18 14 18 o 5.0152 1.4187 42.661   22.122  31.919    32.959  51.467    29.842  4.5830 1.9764 5.4475 2.0358 -0.8645425     2.837356  
1 1 1 18 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 14 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 0  o 11.615 1.7185 174.220  33.183  115.006   47.485  230.734   46.390  8.7911 3.0073 14.439 1.6638 -0.000000      0.000000  
1 1 1 18 15 1  o 3.6303 1.1682 -8.1342  18.683  -2.7580   25.184  -14.7158  27.864  3.7175 1.6602 3.5430 1.6439 0.1744630      2.336393  
1 1 1 18 15 2  o 8.4454 1.2199 84.568   20.150  96.232    27.573  71.199    29.520  9.2947 1.4833 7.5961 1.9371 1.698644       2.439747  
1 1 1 18 15 3  o 7.4662 1.3148 69.235   20.287  90.247    28.114  46.406    29.304  8.8041 1.6575 6.1284 2.0415 2.675781       2.629647  
1 1 1 18 15 4  o 7.3233 1.3208 66.120   20.153  44.391    28.592  87.575    28.410  6.0150 2.0167 8.6316 1.7062 -2.616629      2.641604  
1 1 1 18 15 5  o 5.9754 1.2643 35.764   20.184  79.742    29.259  -4.1632   27.879  8.1100 1.8454 3.8408 1.7286 4.269227       2.528566  
1 1 1 18 15 6  o 17.840 0.7412 338.297  26.240  328.809   39.238  345.974   35.293  17.544 1.1183 18.137 0.9730 -0.5936432     1.482316  
1 1 1 18 15 7  o 7.4258 1.3381 70.492   20.517  50.703    30.801  86.277    27.508  6.2984 2.0928 8.5532 1.6680 -2.254801      2.676158  
1 1 1 18 15 8  o 4.0824 1.2160 -0.2726  19.402  -36.0765  29.817  26.020    25.551  3.2011 1.5455 4.9637 1.8777 -1.762565      2.431932  
1 1 1 18 15 9  o 5.0461 1.3909 25.501   20.093  33.850    30.913  19.394    26.440  5.4439 2.0639 4.6482 1.8652 0.7956705      2.781872  
1 1 1 18 15 10 o 8.8325 1.2829 94.974   21.851  113.146   32.774  80.433    29.318  9.6525 1.7626 8.0125 1.8645 1.639961       2.565807  
1 1 1 18 15 11 f 4.9332 1.3551 20.428   21.266  49.025    30.443  -6.8265   29.719  6.0758 2.0807 3.7906 1.7365 2.285199       2.710153  
1 1 1 18 15 12 o 5.6923 1.5109 42.588   23.288  43.254    33.447  41.962    32.445  5.7219 2.1520 5.6627 2.1215 0.5923223E-01  3.021840  
1 1 1 18 15 13 o 12.138 1.0859 173.884  26.271  175.639   38.742  172.390   35.745  12.116 1.5988 12.159 1.4699 -0.4285622E-01 2.171811  
1 1 1 18 15 14 o 3.7517 1.2328 -7.5470  22.344  -13.2863  32.987  -2.6817   30.372  3.6866 1.7357 3.8168 1.7511 -0.1301577     2.465530  
1 1 1 18 15 15 o 4.4301 1.2878 16.007   22.208  -32.0715  34.601  49.688    28.960  3.2714 1.5987 5.5889 2.0195 -2.317495      2.575677  
1 1 1 18 15 16 o 3.3872 1.1376 -16.1856 20.842  5.5450    31.185  -33.7263  28.018  3.8790 1.7777 2.8954 1.4199 0.9835293      2.275153  
1 1 1 18 15 17 o 4.1904 1.3121 21.045   21.783  17.108    33.667  23.880    28.569  4.1206 1.8725 4.2602 1.8386 -0.1395631     2.624274  
1 1 1 18 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 15 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 0  o 4.1955 1.7071 23.714   26.415  -10.3694  40.855  48.197    34.626  3.1719 2.1513 5.2190 2.6511 -0.000000      0.000000  
1 1 1 18 16 1  o 4.7612 1.3007 18.073   19.147  -3.5630   26.932  40.181    27.225  3.7855 1.7018 5.7369 1.9676 -1.951405      2.601465  
1 1 1 18 16 2  o 8.0979 1.3079 80.872   20.854  94.507    29.185  66.648    29.808  8.9417 1.6940 7.2542 1.9931 1.687512       2.615766  
1 1 1 18 16 3  o 7.5677 1.3521 71.208   20.485  74.601    29.114  67.882    28.827  7.7673 1.8917 7.3681 1.9323 0.3991427      2.704189  
1 1 1 18 16 4  o 12.442 0.9326 170.235  23.090  156.076   33.178  183.532   32.153  11.871 1.3974 13.012 1.2355 -1.140431      1.865285  
1 1 1 18 16 5  o 5.3288 1.3364 29.347   19.879  4.1470    28.821  52.214    27.454  4.1708 1.8228 6.4867 1.9547 -2.315888      2.672704  
1 1 1 18 16 6  o 7.8179 1.3553 74.055   21.080  91.192    31.739  60.530    28.197  8.6588 1.8861 6.9770 1.9468 1.681861       2.710638  
1 1 1 18 16 7  f 10.663 1.0342 127.363  21.986  141.364   32.514  115.569   29.843  11.210 1.4502 10.117 1.4749 1.093559       2.068458  
1 1 1 18 16 8  o 3.9286 1.2245 -3.6892  19.362  19.952    29.299  -22.0186  25.798  4.6927 1.9334 3.1645 1.5032 1.528186       2.448979  
1 1 1 18 16 9  o 4.2868 1.3172 9.2959   20.989  5.6934    31.819  12.071    27.927  4.2632 1.8872 4.3103 1.8381 -0.4710007E-01 2.634417  
1 1 1 18 16 10 o 3.9032 1.2569 -4.6790  21.871  -16.7557  32.997  4.7838    29.208  3.7128 1.7442 4.0937 1.8103 -0.3809278     2.513832  
1 1 1 18 16 11 o 4.8017 1.4137 23.141   22.309  20.811    35.154  24.712    28.866  4.8071 2.0564 4.7964 1.9404 0.1064777E-01  2.827363  
1 1 1 18 16 12 o 12.158 1.1563 185.213  25.980  146.950   39.466  214.477   34.514  10.540 1.9438 13.776 1.2527 -3.235565      2.312510  
1 1 1 18 16 13 o 3.5799 1.1970 -13.1340 22.018  -3.0780   34.767  -19.8683  28.451  3.9160 1.8234 3.2437 1.5513 0.6722908      2.394041  
1 1 1 18 16 14 o 4.4490 1.3595 22.494   21.927  28.239    33.571  18.220    28.958  4.6584 2.0016 4.2396 1.8403 0.4187417      2.719065  
1 1 1 18 16 15 o 5.2976 1.4639 46.637   22.485  55.328    33.124  39.210    30.619  5.6220 2.1352 4.9733 2.0032 0.6486874      2.927774  
1 1 1 18 16 16 o 3.1207 1.0806 -25.7551 21.955  -21.5251  35.050  -28.4863  28.165  3.3305 1.6235 2.9109 1.4267 0.4196048      2.161296  
1 1 1 18 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 16 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 0  o 5.1534 1.7980 29.294   30.296  -29.9144  42.723  89.180    42.967  2.8855 2.0156 7.4213 2.9780 -0.000000      0.000000  
1 1 1 18 17 1  o 5.1281 1.3878 25.166   21.172  45.739    30.127  5.0889    29.761  6.0306 2.0697 4.2256 1.8494 1.804964       2.775609  
1 1 1 18 17 2  o 5.7099 1.4231 38.727   20.545  52.734    30.405  26.958    27.871  6.3950 2.0771 5.0247 1.9458 1.370305       2.846103  
1 1 1 18 17 3  o 4.5726 1.2952 16.060   19.669  -8.6626   30.372  33.920    25.814  3.8164 1.7510 5.3289 1.9089 -1.512563      2.590326  
1 1 1 18 17 4  o 7.3269 1.4071 68.981   20.971  74.034    32.231  65.272    27.616  7.4843 2.0789 7.1695 1.8967 0.3147330      2.814126  
1 1 1 18 17 5  o 4.6645 1.3570 19.327   20.161  24.264    31.064  15.735    26.500  4.9174 2.0042 4.4116 1.8300 0.5058360      2.713994  
1 1 1 18 17 6  o 8.4033 1.3850 90.164   22.644  95.278    34.840  86.424    29.796  8.5009 2.0688 8.3058 1.8419 0.1951046      2.769941  
1 1 1 18 17 7  o 4.1670 1.2960 6.0083   21.039  -5.6681   33.715  13.454    26.924  4.0224 1.8453 4.3115 1.8202 -0.2890863     2.591950  
1 1 1 18 17 8  o 3.8188 1.2342 -4.5236  20.612  -5.8440   33.163  -3.6924   26.311  3.9754 1.8260 3.6623 1.6608 0.3131065      2.468360  
1 1 1 18 17 9  o 4.8667 1.4011 17.440   22.369  50.654    35.156  -5.1539   28.995  5.9856 2.2150 3.7477 1.7163 2.237894       2.802130  
1 1 1 18 17 10 f 4.0575 1.2862 -5.4014  21.988  28.603    34.585  -28.4686  28.486  4.9769 2.0797 3.1381 1.5140 1.838748       2.572408  
1 1 1 18 17 11 o 11.386 1.1234 154.951  25.186  196.836   39.248  125.628   32.839  12.718 1.5430 10.053 1.6333 2.665025       2.246885  
1 1 1 18 17 12 o 6.3805 1.3621 62.828   23.300  16.771    33.787  104.594   32.174  4.2731 1.9146 8.4879 1.9379 -4.214783      2.724213  
1 1 1 18 17 13 o 4.4724 1.3226 14.319   22.399  53.269    32.357  -21.5158  31.037  5.6606 2.1190 3.2842 1.5834 2.376382       2.645247  
1 1 1 18 17 14 o 4.3076 1.3012 18.303   22.106  -13.8352  32.753  45.190    29.958  3.4324 1.6476 5.1828 2.0144 -1.750408      2.602399  
1 1 1 18 17 15 o 6.7129 1.3342 71.639   24.886  145.428   36.737  9.0694    33.829  9.5949 1.9801 3.8309 1.7888 5.763917       2.668420  
1 1 1 18 17 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 17 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 0  o 6.6832 2.1183 77.999   30.218  97.029    46.659  64.251    39.659  7.4758 3.1200 5.8907 2.8660 -0.000000      0.000000  
1 1 1 18 18 1  o 6.1978 1.4415 51.043   21.013  41.593    30.189  59.924    29.266  5.6767 2.0602 6.7190 2.0167 -1.042295      2.882964  
1 1 1 18 18 2  o 3.3866 1.1233 -16.1919 19.194  -13.7299  27.858  -18.4170  26.483  3.4898 1.6274 3.2835 1.5487 0.2063255      2.246502  
1 1 1 18 18 3  o 5.1999 1.3736 29.829   20.539  50.310    29.212  9.8029    28.885  6.1451 2.0379 4.2547 1.8424 1.890440       2.747272  
1 1 1 18 18 4  o 4.4944 1.4216 2.4490   25.159  -11.5127  31.317  27.861    42.251  3.7408 1.7381 5.2479 2.2500 -1.507102      2.843121  
1 1 1 18 18 5  o 4.9127 1.3966 26.182   21.272  17.869    32.175  32.636    28.352  4.6450 1.9767 5.1803 1.9735 -0.5353193     2.793232  
1 1 1 18 18 6  o 7.4575 1.3105 78.123   21.973  37.824    34.829  104.766   28.320  5.4335 2.1538 9.4816 1.4934 -4.048065      2.620937  
1 1 1 18 18 7  o 6.4336 1.4890 58.776   22.003  63.569    32.778  54.846    29.684  6.6188 2.1569 6.2484 2.0534 0.3703470      2.978095  
1 1 1 18 18 8  o 4.6101 1.2996 14.252   21.735  -29.6030  32.888  48.255    28.960  3.3685 1.6255 5.8516 2.0281 -2.483085      2.599123  
1 1 1 18 18 9  o 3.8774 1.2311 -4.4618  20.262  27.528    31.815  -26.2896  26.281  4.7623 1.9928 2.9924 1.4462 1.769891       2.462256  
1 1 1 18 18 10 o 5.5304 1.3918 46.811   22.659  11.778    33.900  75.102    30.464  4.1376 1.8798 6.9231 2.0529 -2.785499      2.783549  
1 1 1 18 18 11 o 3.8222 1.2444 2.1946   22.001  -2.6885   32.660  6.2515    29.769  3.7607 1.7565 3.8837 1.7633 -0.1229465     2.488889  
1 1 1 18 18 12 o 4.2813 1.3033 15.843   22.453  -17.2624  33.039  44.257    30.608  3.3997 1.6377 5.1629 2.0278 -1.763178      2.606551  
1 1 1 18 18 13 o 2.9565 1.0325 -39.0845 21.420  -10.9362  32.205  -61.4144  28.684  3.4113 1.6364 2.5018 1.2593 0.9094739      2.064923  
1 1 1 18 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 18 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 0  o 3.6784 1.6811 1.5546   30.291  43.023    45.246  -32.1291  40.778  4.6569 2.7716 2.6998 1.9032 -0.000000      0.000000  
1 1 1 18 19 1  o 5.4801 1.4851 40.057   22.835  45.685    32.918  34.836    31.702  5.7264 2.1385 5.2339 2.0612 0.4925151      2.970135  
1 1 1 18 19 2  o 5.7794 1.4079 42.681   23.003  6.8287    33.506  74.642    31.636  4.2594 1.9077 7.2994 2.0711 -3.040036      2.815797  
1 1 1 18 19 3  o 3.5454 1.1607 -8.3074  19.517  -15.0058  29.632  -3.1752   25.938  3.4947 1.6452 3.5961 1.6378 -0.1013336     2.321452  
1 1 1 18 19 4  o 3.4258 1.1250 -15.4882 19.638  -43.1333  29.707  5.9671    26.171  2.9561 1.4522 3.8954 1.7186 -0.9392917     2.249955  
1 1 1 18 19 5  o 4.0810 1.2785 7.5581   20.912  -1.4095   31.442  14.672    28.005  3.8978 1.7858 4.2642 1.8301 -0.3663905     2.557040  
1 1 1 18 19 6  o 4.9225 1.3633 21.396   22.185  63.226    33.208  -12.3247  29.815  6.3506 2.1732 3.4944 1.6466 2.856201       2.726549  
1 1 1 18 19 7  o 4.4850 1.3507 18.704   22.350  46.709    33.173  -4.5734   30.244  5.3580 2.1089 3.6121 1.6882 1.745900       2.701398  
1 1 1 18 19 8  o 4.6874 1.3757 28.156   22.290  9.4689    32.844  44.112    30.349  4.0705 1.8497 5.3042 2.0368 -1.233697      2.751328  
1 1 1 18 19 9  o 4.2617 1.3254 14.733   22.818  -5.8523   32.598  34.509    31.951  3.6700 1.7271 4.8534 2.0110 -1.183376      2.650863  
1 1 1 18 19 10 o 3.7941 1.2346 1.4757   22.481  -21.1875  32.959  21.192    30.742  3.3227 1.6092 4.2654 1.8729 -0.9426901     2.469248  
1 1 1 18 19 11 o 5.3001 1.4904 52.239   23.755  61.096    34.332  44.105    32.902  5.6275 2.1650 4.9727 2.0488 0.6548653      2.980747  
1 1 1 18 19 12 o 4.3930 1.3683 30.684   23.948  17.894    35.914  40.924    32.136  4.0524 1.8753 4.7337 1.9930 -0.6813374     2.736559  
1 1 1 18 19 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 19 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 0  o 4.3562 1.9116 40.871   33.293  58.611    50.005  26.746    44.620  4.8484 2.8999 3.8641 2.4915 -0.000000      0.000000  
1 1 1 18 20 1  f 3.7822 1.2366 0.2420   21.793  6.9111    33.014  -4.9084   29.013  4.0096 1.8345 3.5547 1.6587 0.4548862      2.473166  
1 1 1 18 20 2  o 3.4559 1.1598 -12.0101 21.301  -4.4852   32.567  -17.6360  28.160  3.7008 1.7367 3.2111 1.5377 0.4896541      2.319620  
1 1 1 18 20 3  o 4.2518 1.3345 17.032   22.669  22.279    32.606  12.124    31.537  4.4188 1.9348 4.0847 1.8384 0.3340921      2.668945  
1 1 1 18 20 4  o 7.8468 1.5040 97.328   24.483  85.757    35.472  107.856   33.835  7.1533 2.2344 8.5404 2.0137 -1.387099      3.007921  
1 1 1 18 20 5  o 4.1429 1.3156 10.310   22.897  25.906    33.644  -3.1454   31.250  4.5881 1.9876 3.6978 1.7241 0.8903615      2.631204  
1 1 1 18 20 6  o 6.5049 1.3927 70.142   23.340  30.510    36.148  98.479    30.565  4.7128 2.0509 8.2971 1.8848 -3.584274      2.785478  
1 1 1 18 20 7  o 3.6366 1.2137 -5.5330  23.266  -16.0899  34.528  3.2470    31.488  3.4885 1.6789 3.7847 1.7530 -0.2961242     2.427304  
1 1 1 18 20 8  o 4.3888 1.3725 25.352   23.684  26.491    34.972  24.387    32.189  4.4333 1.9697 4.3443 1.9118 0.8906269E-01  2.744910  
1 1 1 18 20 9  o 3.3262 1.1375 -29.6062 23.056  18.367    34.474  -68.4314  31.013  4.1054 1.8769 2.5470 1.2855 1.558459       2.274938  
1 1 1 18 20 10 o 3.5493 1.2024 -6.1306  24.185  10.118    36.070  -19.4017  32.598  3.8775 1.8222 3.2210 1.5692 0.6565189      2.404732  
1 1 1 18 20 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 20 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 0  o 4.8429 2.0052 59.015   32.143  66.374    50.368  53.959    41.749  4.9735 2.9410 4.7123 2.7265 -0.000000      0.000000  
1 1 1 18 21 1  o 4.5528 1.3840 27.237   23.078  13.700    31.899  42.104    33.429  4.0728 1.8395 5.0328 2.0683 -0.9600334     2.768001  
1 1 1 18 21 2  o 4.1862 1.3046 13.840   22.926  38.562    31.366  -14.5152  33.592  4.9024 2.0078 3.4699 1.6664 1.432535       2.609227  
1 1 1 18 21 3  o 3.7285 1.2313 -6.1601  23.572  23.293    33.615  -34.6540  33.063  4.3532 1.9327 3.1038 1.5262 1.249405       2.462657  
1 1 1 18 21 4  o 3.8813 1.2761 6.0625   23.858  12.084    35.093  0.8876    32.532  4.0473 1.8662 3.7153 1.7410 0.3320119      2.552216  
1 1 1 18 21 5  o 3.6954 1.2337 -2.3808  23.811  15.101    35.292  -16.9864  32.259  4.0788 1.8773 3.3119 1.6011 0.7668972      2.467343  
1 1 1 18 21 6  o 5.1291 1.5035 52.426   25.197  55.206    37.571  50.154    33.968  5.1676 2.1642 5.0907 2.0877 0.7689428E-01  3.007039  
1 1 1 18 21 7  o 4.0706 1.3105 17.821   24.375  -2.9864   36.243  35.004    32.935  3.6261 1.7386 4.5150 1.9613 -0.8888822     2.620935  
1 1 1 18 21 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 21 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 0  o 5.9707 1.8070 72.410   34.815  -17.0212  52.251  143.817   46.690  2.9721 2.1065 8.9692 2.9367 -0.000000      0.000000  
1 1 1 18 22 1  f 3.9962 1.2919 15.830   23.668  -0.5470   34.340  30.649    32.666  3.6190 1.7234 4.3734 1.9252 -0.7543867     2.583886  
1 1 1 18 22 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 22 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 23 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 24 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 25 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 26 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 27 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 27 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 27 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 27 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 27 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 18 27 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 1  0  o 12.037 0.9638 149.854  22.861  0.0000    0.0000  149.854   22.861  12.037 0.9638 12.037 0.9638 -0.000000      0.000000  
1 1 1 19 1  1  o 6.5622 0.9875 47.296   12.940  65.237    18.503  30.118    18.105  7.8980 1.1714 5.2265 1.5901 2.671557       1.974983  
1 1 1 19 1  2  f 8.5985 0.7388 76.060   12.653  86.243    18.708  67.473    17.179  9.1311 1.0244 8.0658 1.0649 1.065323       1.477633  
1 1 1 19 1  3  o 12.539 0.8063 142.935  17.378  206.904   37.771  125.757   19.573  13.997 1.3493 11.082 0.8831 2.914928       1.612597  
1 1 1 19 1  4  o 8.2238 1.0899 61.777   14.950  98.391    33.039  52.350    16.764  9.3534 1.8317 7.0942 1.1815 2.259178       2.179718  
1 1 1 19 1  5  o 6.4660 1.2706 47.396   14.452  42.665    35.028  48.366    15.865  6.2291 2.2244 6.7028 1.2287 -0.4737225     2.541240  
1 1 1 19 1  6  o 5.9559 1.2830 25.877   14.437  75.618    33.505  14.537    15.999  7.9067 2.0879 4.0050 1.4918 3.901756       2.566089  
1 1 1 19 1  7  o 14.877 0.9056 249.225  20.918  209.606   45.647  259.756   23.534  13.797 1.6543 15.957 0.7374 -2.160446      1.811160  
1 1 1 19 1  8  o 4.5910 1.2757 17.684   13.693  16.160    35.440  17.951    14.846  4.9975 2.0979 4.1846 1.4520 0.8129315      2.551360  
1 1 1 19 1  9  o 6.5400 1.3304 44.497   15.435  64.367    35.230  39.777    17.171  7.1527 2.2256 5.9272 1.4585 1.225515       2.660898  
1 1 1 19 1  10 o 8.6808 1.1152 60.153   15.683  139.254   38.423  44.340    17.180  11.079 1.7340 6.2825 1.4027 4.796614       2.230376  
1 1 1 19 1  11 o 4.0648 1.2208 9.5726   14.479  2.4467    34.305  11.117    15.971  4.4029 1.9537 3.7266 1.4644 0.6763029      2.441659  
1 1 1 19 1  12 o 8.0075 1.2819 68.031   16.978  97.812    37.857  60.533    18.995  8.6740 2.1837 7.3409 1.3433 1.333086       2.563775  
1 1 1 19 1  13 o 11.668 1.0884 152.686  22.402  157.736   42.995  150.804   26.246  11.463 1.8754 11.874 1.1052 -0.4110575     2.176822  
1 1 1 19 1  14 o 4.4044 1.1498 20.380   13.422  23.304    17.384  16.063    21.121  4.5672 1.5720 4.2415 1.6785 0.3256326      2.299676  
1 1 1 19 1  15 o 3.8732 1.1261 9.7445   14.106  13.321    19.236  5.5843    20.746  4.0203 1.5984 3.7261 1.5865 0.2941926      2.252106  
1 1 1 19 1  16 o 6.5070 1.2533 51.155   16.702  51.445    22.458  50.796    24.984  6.5672 1.6975 6.4468 1.8444 0.1203456      2.506690  
1 1 1 19 1  17 o 4.7946 1.2284 22.175   16.264  5.7395    22.279  40.928    23.798  3.8161 1.6349 5.7731 1.8338 -1.957010      2.456774  
1 1 1 19 1  18 o 8.0978 1.1309 76.516   17.609  83.743    23.150  66.594    27.126  8.7730 1.3194 7.4227 1.8371 1.350266       2.261834  
1 1 1 19 1  19 o 5.7592 1.2549 39.798   16.228  47.934    22.271  30.590    23.695  6.3344 1.7156 5.1840 1.8318 1.150435       2.509753  
1 1 1 19 1  20 o 15.553 0.7411 256.767  23.010  262.215   31.843  250.812   33.287  15.757 1.0105 15.349 1.0844 0.4081621      1.482195  
1 1 1 19 1  21 o 8.8620 1.1593 97.323   19.537  143.161   27.093  47.670    28.198  11.543 1.1736 6.1809 1.9997 5.362227       2.318585  
1 1 1 19 1  22 o 6.7728 1.3526 58.928   19.089  54.305    25.899  64.426    28.246  6.5023 1.8831 7.0433 1.9423 -0.5410385     2.705290  
1 1 1 19 1  23 o 3.7965 1.1846 3.6384   17.353  1.1663    22.711  7.1066    26.900  3.5768 1.5883 4.0162 1.7580 -0.4393470     2.369220  
1 1 1 19 1  24 o 2.7272 0.9369 -30.0575 16.673  -12.8415  21.768  -54.4938  25.934  2.9645 1.4000 2.4899 1.2454 0.4745913      1.873816  
1 1 1 19 1  25 o 3.6513 1.1407 -19.8910 18.491  -60.7403  23.968  40.173    29.063  2.2542 1.1368 5.0485 1.9780 -2.794241      2.281437  
1 1 1 19 1  26 o 3.4463 1.1761 -10.2629 24.356  -11.9242  34.138  -8.5405   34.760  3.4065 1.6468 3.4861 1.6795 -0.7957840E-01 2.352165  
1 1 1 19 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 2  0  o 4.7218 1.7131 34.737   21.579  22.125    30.957  46.656    30.095  3.9867 2.3298 5.4570 2.5122 -0.000000      0.000000  
1 1 1 19 2  1  o 4.9086 1.1450 19.249   15.407  -5.9482   21.547  45.607    22.038  3.4421 1.5366 6.3751 1.6981 -2.932918      2.290091  
1 1 1 19 2  2  o 9.7152 1.1490 112.376  16.443  88.428    36.736  118.376   18.388  8.6691 2.1333 10.761 0.8544 -2.092017      2.298023  
1 1 1 19 2  3  o 13.256 0.8950 195.160  19.130  167.110   40.031  203.462   21.778  12.390 1.6155 14.122 0.7711 -1.732352      1.790056  
1 1 1 19 2  4  o 2.9773 1.0091 -26.3091 11.806  1.8879    28.066  -32.3712  13.014  4.1480 1.8062 1.8066 0.9003 2.341430       2.018129  
1 1 1 19 2  5  o 7.9346 1.2099 82.669   15.829  49.538    34.902  91.248    17.761  6.4753 2.2274 9.3938 0.9453 -2.918503      2.419753  
1 1 1 19 2  6  f 7.6208 1.2293 76.930   15.967  42.785    36.225  85.164    17.789  6.1745 2.2544 9.0671 0.9809 -2.892628      2.458551  
1 1 1 19 2  7  o 13.205 0.9518 186.404  19.619  190.165   44.687  185.506   21.836  12.981 1.7212 13.429 0.8130 -0.4476728     1.903555  
1 1 1 19 2  8  o 5.5392 1.2514 37.074   14.726  16.674    35.449  41.328    16.189  4.9971 2.0980 6.0813 1.3646 -1.084247      2.502739  
1 1 1 19 2  9  o 3.6745 1.1141 4.0413   14.280  -39.0265  34.247  13.106    15.711  3.4805 1.6743 3.8686 1.4702 -0.3881192     2.228198  
1 1 1 19 2  10 o 9.0716 1.1766 83.456   16.688  116.683   39.168  76.086    18.446  9.6720 2.0861 8.4711 1.0888 1.200876       2.353152  
1 1 1 19 2  11 o 7.5795 1.1822 90.372   17.142  17.744    39.455  107.271   19.032  5.0458 2.1691 10.113 0.9409 -5.067320      2.364382  
1 1 1 19 2  12 o 7.2600 1.3504 56.636   16.278  81.802    38.920  51.300    17.921  7.7903 2.3228 6.7297 1.3779 1.060602       2.700712  
1 1 1 19 2  13 o 7.8092 1.2667 93.425   18.095  35.012    42.889  106.075   19.958  5.6162 2.3288 10.002 0.9977 -4.386041      2.533471  
1 1 1 19 2  14 o 5.1355 1.4205 28.474   20.011  24.165    38.631  30.054    23.395  5.1794 2.1831 5.0917 1.8179 0.8773994E-01  2.840945  
1 1 1 19 2  15 o 3.7486 1.1932 0.4415   15.719  -15.9725  37.169  4.0166    17.347  4.0698 1.8918 3.4275 1.4548 0.6422696      2.386478  
1 1 1 19 2  16 o 6.4852 1.4019 47.309   16.812  63.725    38.801  43.516    18.653  6.8665 2.3490 6.1040 1.5307 0.7624569      2.803770  
1 1 1 19 2  17 o 5.8613 1.4432 38.245   17.472  51.071    41.058  35.409    19.307  6.2577 2.3771 5.4649 1.6375 0.7928252      2.886498  
1 1 1 19 2  18 o 4.7177 1.3026 21.762   16.845  1.6974    37.337  26.889    18.875  4.5416 2.0254 4.8937 1.6385 -0.3521137     2.605195  
1 1 1 19 2  19 f 9.3285 1.2384 93.951   23.106  0.0000    0.0000  93.951    23.106  ?      ?      9.3285 1.2384 ?              ?         
1 1 1 19 2  20 o 4.1089 1.2948 1.0006   17.362  13.814    38.966  -2.1732   19.393  4.9109 2.1333 3.3069 1.4681 1.604068       2.589637  
1 1 1 19 2  21 o 4.5821 1.3923 10.723   18.859  31.744    41.930  5.3917    21.116  5.4563 2.2858 3.7079 1.5902 1.748461       2.784504  
1 1 1 19 2  22 o 6.5057 1.4541 57.465   19.682  50.517    45.075  59.102    21.878  6.0218 2.4287 6.9896 1.5996 -0.9677777     2.908191  
1 1 1 19 2  23 o 6.1090 1.5291 50.084   20.417  65.286    46.713  46.495    22.700  6.2679 2.4913 5.9500 1.7739 0.3178992      3.058292  
1 1 1 19 2  24 o 5.4687 1.4278 48.691   20.851  32.198    49.184  52.305    23.022  4.8704 2.2322 6.0671 1.7807 -1.196653      2.855508  
1 1 1 19 2  25 o 3.6900 1.2427 -3.8226  19.612  22.059    43.763  -10.3265  21.938  4.4147 2.0523 2.9653 1.4019 1.449459       2.485466  
1 1 1 19 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 2  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 3  0  o 7.1374 1.8377 73.719   24.784  59.504    34.354  89.148    35.791  6.1194 2.6859 8.1553 2.5089 -0.000000      0.000000  
1 1 1 19 3  1  o 6.4481 1.2095 47.548   16.534  30.156    23.021  66.074    23.760  5.2570 1.8090 7.6393 1.6061 -2.382245      2.419097  
1 1 1 19 3  2  o 11.693 0.8336 144.209  19.438  156.277   27.519  132.191   27.462  12.207 1.1272 11.178 1.2284 1.028687       1.667151  
1 1 1 19 3  3  o 4.3804 1.2014 15.659   15.130  11.088    21.047  20.547    21.765  4.1046 1.6582 4.6563 1.7389 -0.5517225     2.402777  
1 1 1 19 3  4  o 7.3096 1.1771 61.300   16.894  70.554    23.531  51.455    24.271  7.9524 1.5351 6.6668 1.7848 1.285573       2.354156  
1 1 1 19 3  5  f 7.8029 0.9932 84.874   14.357  21.003    23.756  121.622   18.019  4.7308 1.8055 10.875 0.8285 -6.144204      1.986494  
1 1 1 19 3  6  o 10.081 1.0731 104.173  17.333  130.227   38.367  97.492    19.429  10.504 1.8960 9.6575 1.0059 0.8468409      2.146293  
1 1 1 19 3  7  o 4.7140 1.2740 20.424   14.215  19.334    33.302  20.666    15.719  5.0145 2.0630 4.4135 1.4952 0.6010203      2.547911  
1 1 1 19 3  8  o 9.4071 1.1697 93.108   17.056  113.852   39.321  88.299    18.930  9.6344 2.0999 9.1798 1.0311 0.4546785      2.339405  
1 1 1 19 3  9  o 8.6472 1.2074 79.096   16.422  101.843   38.100  73.905    18.199  8.9474 2.1548 8.3469 1.0902 0.6004667      2.414881  
1 1 1 19 3  10 o 6.3725 1.3432 49.419   16.153  47.568    38.063  49.826    17.840  6.1288 2.2975 6.6162 1.3923 -0.4874363     2.686400  
1 1 1 19 3  11 o 5.2431 1.2681 33.261   15.621  11.087    35.873  38.449    17.353  4.7250 2.0497 5.7612 1.4936 -1.036168      2.536144  
1 1 1 19 3  12 o 12.587 1.0216 170.021  20.712  193.795   46.199  164.041   23.171  12.691 1.8201 12.482 0.9282 0.2088003      2.043126  
1 1 1 19 3  13 o 5.2800 1.3795 26.324   15.792  49.434    36.778  21.100    17.487  6.1467 2.2673 4.4132 1.5721 1.733549       2.759074  
1 1 1 19 3  14 o 5.7232 1.4065 29.180   16.435  65.702    37.597  20.552    18.274  7.0163 2.3112 4.4302 1.6037 2.586052       2.813087  
1 1 1 19 3  15 o 5.4843 1.4560 23.631   19.606  64.072    39.595  10.495    22.567  6.8990 2.3725 4.0695 1.6885 2.829424       2.912010  
1 1 1 19 3  16 o 3.6823 1.1926 -14.6110 15.471  19.898    34.826  -23.0956  17.268  4.9239 2.0740 2.4408 1.1778 2.483165       2.385112  
1 1 1 19 3  17 o 7.1179 1.4194 57.941   18.374  73.028    39.948  53.893    20.692  7.4017 2.3786 6.8340 1.5496 0.5676780      2.838812  
1 1 1 19 3  18 o 4.2346 1.2996 7.5842   16.521  10.055    38.793  7.0367    18.260  4.8232 2.1112 3.6459 1.5163 1.177269       2.599246  
1 1 1 19 3  19 o 5.2556 1.4170 22.554   17.092  53.389    38.921  15.187    19.024  6.3907 2.3362 4.1204 1.6042 2.270391       2.834001  
1 1 1 19 3  20 o 5.0185 1.3960 24.268   17.401  23.707    41.368  24.388    19.180  5.3250 2.2526 4.7120 1.6495 0.6130085      2.791961  
1 1 1 19 3  21 o 3.5443 1.1785 -10.4429 17.665  -17.0249  38.665  -8.7067   19.858  4.0182 1.8878 3.0704 1.4114 0.9477377      2.357018  
1 1 1 19 3  22 o 6.9498 1.5109 62.095   20.134  79.943    44.951  57.616    22.519  7.0853 2.5210 6.8143 1.6662 0.2709818      3.021889  
1 1 1 19 3  23 o 6.9743 1.5736 67.557   21.333  97.433    48.959  60.555    23.701  7.1870 2.6213 6.7616 1.7419 0.4253759      3.147293  
1 1 1 19 3  24 o 8.6288 1.5336 97.618   23.107  167.712   49.079  77.657    26.191  9.7800 2.4997 7.4777 1.7774 2.302307       3.067209  
1 1 1 19 3  25 o 4.4019 1.3110 29.950   21.530  -9.8094   47.387  40.292    24.168  3.8268 1.8703 4.9769 1.8376 -1.150026      2.621958  
1 1 1 19 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 3  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 4  0  o 5.9388 1.4801 39.035   23.393  101.906   35.444  -9.4918   31.139  9.0482 2.2641 2.8294 1.9070 -0.000000      0.000000  
1 1 1 19 4  1  o 3.1880 1.0337 -11.4938 15.003  -7.0072   21.094  -16.0875  21.344  3.3225 1.4987 3.0536 1.4241 0.2689679      2.067419  
1 1 1 19 4  2  o 5.5059 1.1014 29.772   16.065  63.781    22.397  -6.2680   23.056  7.5145 1.5420 3.4974 1.5732 4.017041       2.202872  
1 1 1 19 4  3  o 13.952 0.7505 204.602  20.899  217.136   29.378  191.759   29.737  14.411 1.0193 13.493 1.1019 0.9178038      1.501087  
1 1 1 19 4  4  o 4.1945 1.1916 13.044   15.317  15.719    20.939  9.9658    22.465  4.2984 1.6804 4.0906 1.6899 0.2078800      2.383171  
1 1 1 19 4  5  o 4.8274 1.1592 20.649   15.763  44.103    21.670  -5.7067   22.971  6.1534 1.7030 3.5014 1.5731 2.652028       2.318361  
1 1 1 19 4  6  o 5.2003 1.1350 24.619   15.902  -5.4591   22.284  55.833    22.700  3.4559 1.5512 6.9448 1.6574 -3.488820      2.270082  
1 1 1 19 4  7  f 3.6652 1.0714 -1.7861  14.696  21.368    20.396  -26.7924  21.195  4.5885 1.6891 2.7420 1.3186 1.846517       2.142815  
1 1 1 19 4  8  f 21.914 0.7418 498.421  27.316  525.967   57.223  490.292   31.086  21.974 1.3021 21.853 0.7112 0.1205139      1.483666  
1 1 1 19 4  9  o 3.7284 1.1610 3.8628   14.753  -20.3868  35.348  8.9777    16.234  3.8539 1.8088 3.6029 1.4560 0.2510009      2.321982  
1 1 1 19 4  10 o 5.7094 1.2503 42.438   15.757  13.801    36.898  48.825    17.425  4.8505 2.0914 6.5682 1.3708 -1.717770      2.500620  
1 1 1 19 4  11 o 4.8170 1.3352 21.691   15.451  30.714    36.546  19.728    17.050  5.3375 2.1745 4.2966 1.5500 1.040913       2.670343  
1 1 1 19 4  12 o 7.8795 1.2666 71.999   17.140  81.165    36.260  69.361    19.450  7.7721 2.2215 7.9868 1.2176 -0.2146959     2.533293  
1 1 1 19 4  13 o 11.605 1.2018 166.000  20.050  138.329   44.949  172.874   22.403  10.325 2.2410 12.885 0.8693 -2.559867      2.403668  
1 1 1 19 4  14 o 9.7235 1.1786 107.633  19.072  112.779   38.403  105.949   21.973  9.4698 2.0842 9.9771 1.1012 -0.5073414     2.357189  
1 1 1 19 4  15 o 3.8745 1.2495 -2.7921  16.417  5.5439    39.170  -4.5684   18.082  4.6524 2.0747 3.0966 1.3930 1.555737       2.498960  
1 1 1 19 4  16 o 3.0576 1.0559 -27.7456 16.558  -35.7184  35.897  -25.5908  18.662  3.5913 1.7241 2.5240 1.2196 1.067327       2.111852  
1 1 1 19 4  17 o 6.4465 1.3420 55.135   18.292  30.059    39.811  61.845    20.594  5.5134 2.2605 7.3796 1.4470 -1.866220      2.683977  
1 1 1 19 4  18 o 9.1258 1.3371 109.276  19.736  83.168    42.678  116.378   22.259  7.7687 2.4545 10.483 1.0617 -2.714046      2.674290  
1 1 1 19 4  19 o 5.0197 1.3700 26.396   17.867  17.588    38.734  28.777    20.137  5.0280 2.1550 5.0114 1.6924 0.1655006E-01  2.740063  
1 1 1 19 4  20 o 7.5485 1.2763 89.090   20.017  21.351    45.677  105.190   22.269  5.2286 2.2897 9.8685 1.1283 -4.639896      2.552562  
1 1 1 19 4  21 o 5.4845 1.2799 41.125   18.273  -2.9636   40.675  52.272    20.452  4.3877 2.0180 6.5813 1.5749 -2.193632      2.559783  
1 1 1 19 4  22 o 7.5205 1.4416 80.629   20.827  74.017    46.883  82.255    23.247  6.6055 2.5327 8.4354 1.3780 -1.829916      2.883274  
1 1 1 19 4  23 o 3.8865 1.2258 10.082   19.140  -21.7360  41.691  18.579    21.545  3.7121 1.8006 4.0610 1.6637 -0.3489439     2.451572  
1 1 1 19 4  24 o 4.5304 1.3048 29.520   20.983  -19.6423  46.984  41.768    23.451  3.8198 1.8659 5.2410 1.8245 -1.421219      2.609687  
1 1 1 19 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 5  0  o 16.780 1.0106 299.248  33.309  310.923   48.594  288.903   45.746  17.082 1.4463 16.478 1.4120 -0.000000      0.000000  
1 1 1 19 5  1  o 10.691 0.8958 122.550  19.106  129.264   26.691  115.496   27.361  11.022 1.2108 10.360 1.3205 0.6623621      1.791598  
1 1 1 19 5  2  o 3.4419 1.0918 -7.3130  15.912  2.7695    22.340  -17.6959  22.670  3.7746 1.6274 3.1091 1.4558 0.6654689      2.183566  
1 1 1 19 5  3  o 11.628 0.8401 143.161  19.464  127.157   26.869  160.834   28.235  10.922 1.2300 12.335 1.1445 -1.412792      1.680151  
1 1 1 19 5  4  o 12.918 0.7829 175.964  20.192  163.230   28.342  189.091   28.776  12.422 1.1407 13.413 1.0727 -0.9903679     1.565873  
1 1 1 19 5  5  o 4.2685 1.1798 11.013   15.699  29.369    22.853  -5.3889   21.602  5.1436 1.8005 3.3935 1.5250 1.750146       2.359534  
1 1 1 19 5  6  o 7.2390 1.1818 61.864   16.772  57.790    24.236  65.607    23.235  6.9571 1.7449 7.5209 1.5942 -0.5638089     2.363508  
1 1 1 19 5  7  o 4.9419 1.2609 27.143   15.948  26.359    23.408  27.822    21.787  4.9142 1.8095 4.9695 1.7565 -0.5529404E-01 2.521805  
1 1 1 19 5  8  o 7.4381 1.1655 65.199   17.400  48.110    24.573  82.383    24.641  6.2670 1.8398 8.6091 1.4311 -2.342119      2.330908  
1 1 1 19 5  9  o 3.4656 1.0897 -2.2129  15.187  -4.4120   21.850  -0.1574   21.124  3.4134 1.5338 3.5179 1.5484 -0.1044962     2.179477  
1 1 1 19 5  10 o 3.8591 1.1577 5.4160   16.176  -7.9793   23.825  16.870    22.032  3.4110 1.5598 4.3072 1.7112 -0.8962052     2.315432  
1 1 1 19 5  11 o 4.8494 1.3633 20.132   16.271  35.025    37.573  16.694    18.052  5.5523 2.2251 4.1465 1.5759 1.405777       2.726679  
1 1 1 19 5  12 o 8.6634 1.2621 92.547   18.445  82.628    37.495  95.713    21.186  7.8658 2.2623 9.4610 1.1196 -1.595251      2.524203  
1 1 1 19 5  13 o 5.6009 1.2879 40.359   17.229  6.5190    38.846  48.645    19.223  4.7164 2.0866 6.4855 1.5102 -1.769113      2.575761  
1 1 1 19 5  14 f 6.8907 1.4423 52.522   17.873  78.306    41.092  46.506    19.848  7.5014 2.4126 6.2800 1.5813 1.221371       2.884600  
1 1 1 19 5  15 f 6.8848 1.4294 42.875   17.755  103.430   41.237  29.094    19.672  8.7559 2.3183 5.0137 1.6728 3.742215       2.858790  
1 1 1 19 5  16 o 5.7640 1.4492 27.176   16.982  69.051    40.788  18.395    18.677  7.1994 2.4087 4.3285 1.6120 2.870911       2.898334  
1 1 1 19 5  17 o 6.1672 1.1895 52.796   18.327  -12.5671  40.735  69.384    20.521  4.3367 2.0035 7.9978 1.2829 -3.661066      2.379020  
1 1 1 19 5  18 o 4.2442 1.3060 4.6709   16.954  22.030    37.569  0.2317    18.999  5.1179 2.1548 3.3705 1.4763 1.747378       2.612051  
1 1 1 19 5  19 o 3.3693 1.1177 -13.5269 17.501  -50.4823  37.962  -3.5531   19.722  3.4604 1.6874 3.2782 1.4663 0.1821156      2.235462  
1 1 1 19 5  20 o 7.6152 1.4946 68.032   21.950  0.0000    0.0000  68.032    21.950  ?      ?      7.6152 1.4946 ?              ?         
1 1 1 19 5  21 o 5.6010 1.4706 38.748   19.269  46.361    43.474  36.887    21.496  5.7931 2.3672 5.4089 1.7455 0.3842096      2.941142  
1 1 1 19 5  22 o 4.1934 1.3023 13.637   18.891  -2.6373   43.852  17.345    20.932  4.2809 2.0109 4.1059 1.6554 0.1750007      2.604640  
1 1 1 19 5  23 o 6.1112 1.5266 51.663   19.723  91.842    44.135  41.638    22.046  6.8144 2.4883 5.4080 1.7693 1.406411       3.053214  
1 1 1 19 5  24 o 6.4368 1.5192 74.925   21.733  92.602    51.105  71.023    24.013  5.8917 2.4987 6.9819 1.7288 -1.090205      3.038407  
1 1 1 19 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 5  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  0  o 13.501 1.1888 202.261  29.443  253.366   42.472  154.980   40.852  15.395 1.4065 11.607 1.9171 -0.000000      0.000000  
1 1 1 19 6  1  o 5.5881 1.3219 36.264   17.394  33.379    24.313  39.289    24.894  5.4053 1.8591 5.7710 1.8797 -0.3656621     2.643763  
1 1 1 19 6  2  o 6.7003 1.2416 53.376   17.362  37.289    24.395  69.891    24.717  5.6372 1.8619 7.7635 1.6431 -2.126279      2.483269  
1 1 1 19 6  3  o 8.1931 1.1113 76.513   17.815  68.305    25.079  84.875    25.311  7.6218 1.6896 8.7644 1.4440 -1.142644      2.222538  
1 1 1 19 6  4  o 7.4056 1.2156 65.342   17.687  71.038    25.006  59.640    25.022  7.7773 1.6582 7.0338 1.7778 0.7435479      2.431146  
1 1 1 19 6  5  o 3.6732 1.1336 1.3388   15.841  6.7286    22.077  -4.3814   22.744  3.8661 1.6411 3.4803 1.5643 0.3857884      2.267181  
1 1 1 19 6  6  o 8.5394 1.0732 83.936   17.676  70.813    25.579  95.929    24.454  7.7127 1.7037 9.3662 1.3054 -1.653470      2.146338  
1 1 1 19 6  7  o 10.491 0.9112 120.074  19.047  129.349   26.709  110.474   27.172  10.949 1.2197 10.034 1.3540 0.9153080      1.822382  
1 1 1 19 6  8  o 4.3604 1.1694 9.4535   16.295  39.079    23.970  -15.9982  22.218  5.6538 1.8446 3.0670 1.4377 2.586797       2.338748  
1 1 1 19 6  9  o 3.7968 1.1545 4.5217   16.057  -3.2603   23.272  11.593    22.184  3.5316 1.5852 4.0620 1.6788 -0.5303671     2.308968  
1 1 1 19 6  10 o 7.4245 1.2496 67.484   18.295  63.488    26.598  71.072    25.204  7.1468 1.8473 7.7022 1.6832 -0.5554256     2.499149  
1 1 1 19 6  11 o 3.3812 1.0880 -9.6367  16.236  1.2930    24.091  -18.7328  21.977  3.7758 1.6579 2.9865 1.4093 0.7892764      2.175952  
1 1 1 19 6  12 o 3.3074 1.0681 -10.9845 16.188  -24.8364  24.052  0.4862    21.887  3.0089 1.4355 3.6060 1.5819 -0.5970292     2.136104  
1 1 1 19 6  13 o 5.1704 1.3967 23.037   15.815  46.949    39.137  18.370    17.290  6.0998 2.3199 4.2410 1.5561 1.858783       2.793470  
1 1 1 19 6  14 f 4.1958 1.2602 10.541   15.941  10.613    34.350  10.521    17.997  4.6030 2.0012 3.7885 1.5323 0.8145025      2.520483  
1 1 1 19 6  15 o 4.0856 1.2804 -0.2501  15.714  18.298    38.231  -4.0210   17.238  5.0994 2.1618 3.0717 1.3726 2.027780       2.560731  
1 1 1 19 6  16 f 4.6753 1.2593 22.482   16.349  -4.9828   35.769  29.736    18.382  4.2674 1.9357 5.0833 1.6114 -0.8159356     2.518638  
1 1 1 19 6  17 o 8.9168 1.3678 104.804  19.630  82.864    44.557  110.088   21.867  7.6556 2.5158 10.178 1.0742 -2.522372      2.735537  
1 1 1 19 6  18 o 8.0121 1.3471 77.007   19.146  78.406    39.634  76.582    21.866  7.6351 2.3581 8.3890 1.3033 -0.7539654     2.694285  
1 1 1 19 6  19 o 8.4673 1.4803 94.938   23.539  91.805    45.945  96.053    27.410  7.7750 2.5547 9.1596 1.4962 -1.384591      2.960588  
1 1 1 19 6  20 o 6.0036 1.4255 48.453   19.385  39.062    41.244  51.116    21.962  5.5898 2.2974 6.4174 1.6884 -0.8275952     2.851044  
1 1 1 19 6  21 o 4.9298 1.4339 6.3939   18.296  78.098    44.570  -8.1380   20.065  6.8105 2.4985 3.0491 1.4077 3.761360       2.867765  
1 1 1 19 6  22 o 3.4594 1.1556 -4.7414  18.418  -24.3163  41.317  0.1130    20.575  3.6647 1.7811 3.2540 1.4728 0.4106421      2.311146  
1 1 1 19 6  23 o 9.8493 1.4986 152.411  24.690  156.619   52.456  151.214   27.984  8.4572 2.7264 11.241 1.2447 -2.784119      2.997113  
1 1 1 19 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 6  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 7  0  o 2.7565 1.3282 -12.3149 22.627  -19.5319  33.886  -6.5079   30.396  2.6900 1.8592 2.8231 1.8973 -0.000000      0.000000  
1 1 1 19 7  1  o 4.1924 1.2196 12.312   16.511  16.048    23.499  8.6695    23.204  4.3696 1.7567 4.0153 1.6922 0.3542857      2.439152  
1 1 1 19 7  2  o 6.5408 1.2952 52.718   17.806  60.580    24.840  44.406    25.539  7.0772 1.7618 6.0044 1.8989 1.072780       2.590320  
1 1 1 19 7  3  o 14.153 0.7618 213.177  21.492  192.325   30.119  234.809   30.676  13.411 1.1229 14.896 1.0297 -1.484397      1.523547  
1 1 1 19 7  4  o 10.459 0.9231 119.786  19.193  133.031   27.051  106.359   27.236  11.100 1.2185 9.8184 1.3870 1.281497       1.846227  
1 1 1 19 7  5  o 5.6602 1.3029 38.339   16.926  41.415    24.391  35.482    23.508  5.8468 1.8565 5.4737 1.8287 0.3731523      2.605851  
1 1 1 19 7  6  f 13.875 0.7769 206.201  21.517  197.930   30.948  213.939   29.935  13.570 1.1403 14.179 1.0556 -0.6088800     1.553895  
1 1 1 19 7  7  o 4.9750 1.3062 27.721   17.363  32.794    25.177  23.119    23.978  5.2508 1.8847 4.6992 1.8089 0.5516520      2.612376  
1 1 1 19 7  8  o 7.8380 1.1810 74.957   18.377  51.206    26.796  96.052    25.252  6.3660 1.9340 9.3100 1.3562 -2.943979      2.362087  
1 1 1 19 7  9  o 7.0266 1.2761 61.288   18.166  52.796    26.285  69.053    25.135  6.4757 1.9034 7.5774 1.7003 -1.101664      2.552239  
1 1 1 19 7  10 o 3.0630 1.0239 -19.9885 16.351  -19.2254  24.894  -20.5675  21.683  3.2080 1.5096 2.9179 1.3837 0.2900920      2.047788  
1 1 1 19 7  11 f 13.516 0.8511 198.466  22.744  173.098   32.986  221.459   31.404  12.597 1.3093 14.436 1.0877 -1.838946      1.702170  
1 1 1 19 7  12 o 3.5673 1.1307 -6.9851  17.303  7.6847    24.170  -22.4062  24.781  4.0225 1.7126 3.1120 1.4768 0.9105186      2.261363  
1 1 1 19 7  13 o 4.7888 1.2103 15.463   17.727  50.130    25.686  -16.0661  24.496  6.3354 1.8866 3.2423 1.5166 3.093060       2.420585  
1 1 1 19 7  14 o 3.5594 1.1423 -7.5874  17.621  -7.5908   24.266  -7.5836   25.630  3.5107 1.5932 3.6082 1.6374 -0.9748840E-01 2.284617  
1 1 1 19 7  15 o 4.2833 1.2658 11.226   18.269  5.1322    26.835  16.491    24.941  4.0953 1.7746 4.4712 1.8055 -0.3759618     2.531605  
1 1 1 19 7  16 o 3.9601 1.2732 -22.7996 16.411  34.173    40.154  -34.2249  17.982  5.6456 2.2869 2.2747 1.1198 3.370897       2.546383  
1 1 1 19 7  17 o 11.036 1.2201 129.523  20.533  164.397   48.119  121.759   22.704  11.355 2.1982 10.717 1.0593 0.6384954      2.440132  
1 1 1 19 7  18 o 12.951 1.3302 235.206  23.105  149.182   51.345  257.049   25.873  10.198 2.5296 15.704 0.8238 -5.506312      2.660396  
1 1 1 19 7  19 o 5.1999 1.4529 25.922   18.542  49.593    41.949  20.174    20.671  6.0049 2.3690 4.3950 1.6825 1.609910       2.905711  
1 1 1 19 7  20 o 5.2912 1.4456 36.845   22.075  14.688    44.622  44.025    25.401  4.8308 2.1793 5.7516 1.9000 -0.9207997     2.891266  
1 1 1 19 7  21 o 8.5756 1.3885 116.212  20.946  89.126    46.670  123.044   23.440  6.7253 2.5392 10.426 1.1241 -3.700677      2.776936  
1 1 1 19 7  22 o 3.5061 1.1443 -1.1614  18.641  -55.8076  43.747  10.962    20.605  3.3416 1.6629 3.6706 1.5724 -0.3289919     2.288588  
1 1 1 19 7  23 o 3.3379 1.1650 -21.8082 18.093  25.571    42.982  -32.0110  19.946  4.3447 2.0245 2.3311 1.1535 2.013553       2.330081  
1 1 1 19 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 7  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  0  o 8.4160 1.6426 97.291   27.583  161.393   41.155  45.013    37.166  11.821 1.8842 5.0111 2.6911 -0.000000      0.000000  
1 1 1 19 8  1  o 6.0772 1.3328 45.327   17.891  43.144    25.086  47.587    25.523  5.9397 1.8824 6.2148 1.8874 -0.2750325     2.665621  
1 1 1 19 8  2  o 5.8317 1.2996 40.945   17.612  54.530    24.808  27.140    25.008  6.6757 1.8118 4.9877 1.8637 1.688007       2.599234  
1 1 1 19 8  3  o 4.0544 1.1940 9.6553   16.439  17.913    22.188  -0.3933   24.476  4.3879 1.7255 3.7209 1.6507 0.6669834      2.387948  
1 1 1 19 8  4  o 5.2817 1.2603 30.519   17.653  53.199    24.896  7.5890    25.034  6.5277 1.8321 4.0356 1.7311 2.492038       2.520585  
1 1 1 19 8  5  o 3.5406 1.1219 -3.6509  16.529  3.2537    23.616  -10.2815  23.143  3.7870 1.6527 3.2942 1.5177 0.4927800      2.243833  
1 1 1 19 8  6  o 5.1488 1.2610 29.529   16.556  16.086    22.962  44.085    23.893  4.3228 1.7370 5.9748 1.8285 -1.652020      2.522033  
1 1 1 19 8  7  o 10.239 1.2702 115.196  23.741  97.156    28.206  159.033   43.969  9.2369 1.5268 11.241 2.0305 -2.004101      2.540494  
1 1 1 19 8  8  o 6.5285 1.3028 52.964   18.101  41.918    26.406  62.755    24.860  5.8405 1.9376 7.2164 1.7422 -1.375877      2.605688  
1 1 1 19 8  9  o 3.5144 1.1157 -4.3838  16.307  -3.2978   23.355  -5.4171   22.780  3.5716 1.5967 3.4572 1.5586 0.1143963      2.231311  
1 1 1 19 8  10 o 4.3731 1.1704 2.1285   17.271  43.245    25.735  -31.5671  23.297  5.9476 1.9089 2.7986 1.3548 3.149051       2.340759  
1 1 1 19 8  11 f 9.2197 1.1326 98.559   20.343  94.750    29.647  101.949   27.965  8.9130 1.7255 9.5265 1.4678 -0.6134853     2.265297  
1 1 1 19 8  12 o 16.371 0.7478 285.960  24.363  255.545   34.528  316.115   34.381  15.444 1.1178 17.298 0.9937 -1.854324      1.495698  
1 1 1 19 8  13 o 11.965 0.9399 155.498  22.413  171.988   32.091  139.795   31.316  12.625 1.2709 11.305 1.3850 1.320145       1.879726  
1 1 1 19 8  14 o 3.7021 1.1811 -5.8445  18.494  -0.0678   27.405  -10.6756  25.062  3.9461 1.7489 3.4580 1.5880 0.4880970      2.362298  
1 1 1 19 8  15 o 4.1508 1.2553 5.8863   19.043  -6.9758   27.852  17.176    26.095  3.7537 1.7048 4.5478 1.8431 -0.7941384     2.510652  
1 1 1 19 8  16 o 3.0664 1.0410 -31.3408 18.003  -14.6551  27.972  -43.1407  23.523  3.5370 1.6431 2.5958 1.2785 0.9412372      2.081926  
1 1 1 19 8  17 o 4.2979 1.2194 4.0557   18.879  -30.5006  27.056  36.845    26.356  3.0896 1.4867 5.5062 1.9332 -2.416592      2.438807  
1 1 1 19 8  18 o 15.728 1.1125 312.952  25.501  239.127   56.553  331.794   28.570  13.621 2.0759 17.836 0.8009 -4.214720      2.225079  
1 1 1 19 8  19 f 3.7676 1.2167 0.6330   17.517  -28.3238  43.149  6.3466    19.167  3.9553 1.8966 3.5798 1.5246 0.3755226      2.433390  
1 1 1 19 8  20 o 4.6582 1.2804 26.632   18.266  -9.5798   40.127  36.096    20.514  4.0527 1.9099 5.2636 1.7059 -1.210916      2.560807  
1 1 1 19 8  21 o 4.3734 1.3465 20.062   18.520  19.097    47.076  20.239    20.144  4.6047 2.1366 4.1421 1.6393 0.4626098      2.692978  
1 1 1 19 8  22 o 6.1182 1.1061 66.312   20.484  -28.6684  44.082  92.470    23.134  3.5845 1.7625 8.6519 1.3369 -5.067352      2.212176  
1 1 1 19 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 8  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 9  0  o 5.6454 1.7418 49.080   24.979  85.693    36.158  15.657    34.547  7.6451 2.6290 3.6457 2.2854 -0.000000      0.000000  
1 1 1 19 9  1  o 4.0958 1.2199 9.6645   17.094  5.2795    23.844  14.302    24.521  3.8873 1.6787 4.3043 1.7705 -0.4169314     2.439769  
1 1 1 19 9  2  o 6.5728 1.3049 53.688   17.843  51.950    24.629  55.607    25.884  6.4742 1.8241 6.6714 1.8666 -0.1972046     2.609850  
1 1 1 19 9  3  o 7.2076 1.2645 64.205   18.452  49.641    26.227  78.481    25.967  6.2819 1.9144 8.1334 1.6527 -1.851516      2.529087  
1 1 1 19 9  4  o 7.3390 1.2704 66.187   18.519  70.706    26.275  61.727    26.107  7.6237 1.7590 7.0544 1.8335 0.5692906      2.540859  
1 1 1 19 9  5  o 4.5858 1.2565 19.432   17.009  31.236    24.158  7.8285    23.951  5.1730 1.8473 3.9987 1.7037 1.174294       2.512992  
1 1 1 19 9  6  o 3.4718 1.1051 -4.8297  16.097  -2.5758   23.463  -6.8339   22.126  3.5931 1.6037 3.3505 1.5208 0.2426131      2.210183  
1 1 1 19 9  7  o 9.2977 1.1178 100.465  19.811  79.094    28.676  119.981   27.403  8.1027 1.8146 10.493 1.3058 -2.390022      2.235607  
1 1 1 19 9  8  o 5.4449 1.2315 29.905   18.320  -3.3822   26.262  61.463    25.570  3.7623 1.6867 7.1275 1.7949 -3.365159      2.463028  
1 1 1 19 9  9  o 5.2664 1.3684 31.551   19.034  26.607    27.445  36.132    26.420  5.0227 1.9348 5.5100 1.9355 -0.4872541     2.736735  
1 1 1 19 9  10 f 2.8194 0.9660 -35.7567 16.899  -16.9588  24.543  -52.7022  23.302  3.2189 1.5096 2.4199 1.2057 0.7990289      1.932008  
1 1 1 19 9  11 o 4.9639 1.1949 13.806   17.730  58.364    26.913  -20.3571  23.566  6.8566 1.8980 3.0712 1.4523 3.785435       2.389890  
1 1 1 19 9  12 o 5.8608 1.3695 40.183   18.714  50.183    28.096  32.208    25.090  6.3927 1.9873 5.3289 1.8848 1.063876       2.738914  
1 1 1 19 9  13 o 6.0228 1.3922 44.764   19.379  39.850    29.750  48.387    25.542  5.7600 2.0508 6.2855 1.8834 -0.5254183     2.784388  
1 1 1 19 9  14 o 6.9142 1.4077 59.722   20.424  62.904    30.710  57.199    27.350  7.0372 2.0542 6.7911 1.9253 0.2461185      2.815385  
1 1 1 19 9  15 o 8.4570 1.2302 92.890   21.523  36.090    31.827  140.756   29.217  5.5580 2.0973 11.356 1.2864 -5.798086      2.460391  
1 1 1 19 9  16 o 15.190 0.8538 249.594  25.834  254.946   38.417  245.176   34.906  15.290 1.2563 15.090 1.1566 0.2000742      1.707610  
1 1 1 19 9  17 o 7.0408 1.4005 67.156   21.763  43.934    32.887  85.247    29.027  5.7994 2.1431 8.2822 1.8035 -2.482780      2.800980  
1 1 1 19 9  18 o 3.3114 1.1005 -19.6434 19.243  -40.5856  29.148  -3.4636   25.620  3.0028 1.4674 3.6200 1.6405 -0.6171725     2.201046  
1 1 1 19 9  19 o 5.8846 1.4877 50.111   22.233  46.600    33.756  52.800    29.546  5.6852 2.1564 6.0839 2.0500 -0.3986530     2.975324  
1 1 1 19 9  20 o 6.6291 1.3496 74.066   20.177  47.210    43.742  81.325    22.741  5.2226 2.2644 8.0356 1.4692 -2.812922      2.699296  
1 1 1 19 9  21 o 4.6775 1.3456 32.678   19.513  16.948    44.043  36.520    21.765  4.3642 2.0389 4.9908 1.7565 -0.6265736     2.691161  
1 1 1 19 9  22 o 4.8584 1.2440 42.206   19.634  -17.7685  46.632  55.129    21.646  3.6681 1.8053 6.0488 1.7121 -2.380743      2.488048  
1 1 1 19 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 9  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 10 0  o 2.9643 1.3977 -11.8571 23.970  -42.3634  35.271  14.325    32.676  2.3721 1.6901 3.5565 2.2266 -0.000000      0.000000  
1 1 1 19 10 1  o 4.3443 1.2520 14.760   17.134  11.325    23.429  18.709    25.122  4.1355 1.7185 4.5531 1.8213 -0.4176559     2.504096  
1 1 1 19 10 2  o 8.6229 1.1532 86.473   19.360  71.247    27.086  102.375   27.681  7.6644 1.7980 9.5813 1.4445 -1.916854      2.306402  
1 1 1 19 10 3  o 6.6267 1.3334 54.381   18.630  59.951    25.814  48.326    26.915  7.0117 1.8236 6.2417 1.9458 0.7699995      2.666767  
1 1 1 19 10 4  o 11.335 0.9113 139.930  20.603  150.495   29.091  129.298   29.183  11.804 1.2323 10.866 1.3429 0.9381723      1.822588  
1 1 1 19 10 5  o 7.1279 1.2918 61.967   19.033  44.034    26.712  80.459    27.126  5.9949 1.9469 8.2609 1.6985 -2.265988      2.583658  
1 1 1 19 10 6  o 5.7253 1.3457 39.526   18.025  37.311    25.380  41.780    25.605  5.5902 1.8999 5.8604 1.9062 -0.2701116     2.691346  
1 1 1 19 10 7  o 10.708 0.9868 128.572  20.694  104.660   29.923  150.493   28.649  9.6137 1.5563 11.801 1.2138 -2.187802      1.973655  
1 1 1 19 10 8  o 3.7587 1.1675 -1.1663  17.359  12.101    24.916  -13.6813  24.199  4.2331 1.7667 3.2843 1.5266 0.9487906      2.334920  
1 1 1 19 10 9  o 5.0692 1.3436 27.557   18.701  38.233    27.219  18.012    25.736  5.6030 1.9648 4.5355 1.8331 1.067471       2.687137  
1 1 1 19 10 10 o 3.6622 1.1588 -4.1254  17.572  -10.6140  25.315  1.9082    24.412  3.4852 1.5989 3.8392 1.6777 -0.3539944     2.317584  
1 1 1 19 10 11 o 4.1505 1.2326 7.3484   17.993  -6.7738   26.324  19.732    24.651  3.6721 1.6636 4.6290 1.8192 -0.9568686     2.465227  
1 1 1 19 10 12 o 9.7893 1.1444 110.306  21.679  96.483    30.996  123.542   30.332  9.0115 1.7829 10.567 1.4352 -1.555443      2.288827  
1 1 1 19 10 13 f 9.7423 1.1568 111.111  21.538  92.114    31.506  127.779   29.511  8.7102 1.8648 10.774 1.3695 -2.064274      2.313655  
1 1 1 19 10 14 o 9.3941 1.2089 102.747  22.109  121.085   32.434  86.829    30.217  10.330 1.5699 8.4586 1.8386 1.871034       2.417703  
1 1 1 19 10 15 o 7.4212 1.4126 69.462   21.361  78.310    32.072  62.407    28.636  7.8247 2.0315 7.0176 1.9633 0.8071427      2.825111  
1 1 1 19 10 16 o 3.9193 1.2413 -0.3859  20.061  4.9683    29.221  -5.1592   27.591  4.1216 1.8173 3.7170 1.6914 0.4046075      2.482642  
1 1 1 19 10 17 o 5.0268 1.3199 11.910   21.435  65.847    32.904  -27.8564  28.252  6.8729 2.1529 3.1808 1.5277 3.692161       2.639822  
1 1 1 19 10 18 o 6.2530 1.4929 57.697   22.876  44.649    35.434  67.022    29.956  5.6022 2.1871 6.9038 2.0327 -1.301580      2.985860  
1 1 1 19 10 19 o 10.630 1.1281 145.122  23.897  151.138   35.501  140.137   32.314  10.745 1.6520 10.515 1.5365 0.2295208      2.256132  
1 1 1 19 10 20 o 3.9144 1.2514 9.4274   20.885  5.2728    32.321  12.406    27.366  3.8873 1.7919 3.9414 1.7472 -0.5415201E-01 2.502706  
1 1 1 19 10 21 o 5.4725 1.3559 53.143   22.178  15.184    34.707  79.339    28.833  4.0121 1.8520 6.9328 1.9807 -2.920661      2.711707  
1 1 1 19 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 0  o 18.139 1.0533 355.889  37.391  330.118   54.155  379.366   51.688  17.412 1.5853 18.865 1.3872 -0.000000      0.000000  
1 1 1 19 11 1  f 7.0712 1.2774 61.882   18.793  79.555    25.908  42.257    27.301  8.2610 1.6260 5.8815 1.9706 2.379446       2.554849  
1 1 1 19 11 2  o 4.5091 1.1465 -1.5887  18.007  -49.7573  24.963  50.670    26.001  2.6070 1.2901 6.4113 1.8955 -3.804276      2.292908  
1 1 1 19 11 3  o 11.879 0.9177 154.213  21.652  134.220   30.464  174.622   30.779  11.034 1.3804 12.724 1.2095 -1.689653      1.835337  
1 1 1 19 11 4  o 5.7306 1.3620 39.856   18.562  44.817    25.980  34.683    26.529  6.0296 1.9161 5.4317 1.9363 0.5979352      2.724090  
1 1 1 19 11 5  o 5.6897 1.3605 39.379   18.502  44.909    26.346  33.998    25.990  6.0099 1.9317 5.3694 1.9162 0.6405134      2.720914  
1 1 1 19 11 6  o 4.3160 1.2685 13.445   18.055  12.463    25.361  14.454    25.710  4.2653 1.7815 4.3667 1.8062 -0.1014862     2.536958  
1 1 1 19 11 7  o 6.7416 1.3504 56.945   19.180  48.930    26.943  65.180    27.310  6.2378 1.9472 7.2454 1.8715 -1.007566      2.700752  
1 1 1 19 11 8  o 4.4879 1.2918 14.629   18.608  25.063    26.436  4.3837    26.196  4.9429 1.9003 4.0329 1.7505 0.9100246      2.583632  
1 1 1 19 11 9  o 9.1993 1.1749 97.459   21.050  89.035    30.239  105.379   29.319  8.6603 1.8044 9.7383 1.5054 -1.077968      2.349893  
1 1 1 19 11 10 o 8.8435 1.1919 101.054  20.983  35.783    30.767  157.809   28.690  5.5623 2.0694 12.125 1.1831 -6.562457      2.383734  
1 1 1 19 11 11 f 10.207 1.0821 117.832  21.329  137.929   30.538  98.691    29.803  11.219 1.3609 9.1944 1.6828 2.024951       2.164209  
1 1 1 19 11 12 o 6.5317 1.4203 53.860   20.272  54.389    30.663  53.449    27.020  6.5199 2.0827 6.5436 1.9316 -0.2365446E-01 2.840559  
1 1 1 19 11 13 o 4.1621 1.2781 5.0907   19.707  8.9806    29.177  1.8269    26.725  4.3568 1.8689 3.9675 1.7440 0.3893657      2.556243  
1 1 1 19 11 14 o 11.958 0.9978 159.636  23.445  197.876   34.116  125.418   32.272  13.435 1.2697 10.481 1.5395 2.953188       1.995544  
1 1 1 19 11 15 o 7.5999 1.4156 76.713   22.247  61.191    32.360  90.625    30.634  6.7011 2.1395 8.4987 1.8544 -1.797555      2.831273  
1 1 1 19 11 16 o 4.7893 1.3836 21.577   22.014  3.3316    32.961  36.270    29.578  4.2093 1.8882 5.3694 2.0228 -1.160078      2.767151  
1 1 1 19 11 17 o 4.1609 1.3028 7.1661   21.966  -8.0969   34.123  17.966    28.704  3.8803 1.8067 4.4415 1.8775 -0.5611739     2.605587  
1 1 1 19 11 18 o 6.5253 1.5193 70.334   23.278  63.374    34.979  75.867    31.186  6.0781 2.2159 6.9726 2.0793 -0.8944521     3.038681  
1 1 1 19 11 19 o 4.0155 1.2677 10.018   21.684  -10.2722  33.610  24.485    28.380  3.6051 1.7134 4.4260 1.8687 -0.8208475     2.535302  
1 1 1 19 11 20 o 3.6190 1.1974 1.5593   21.481  -5.8596   34.851  6.1043    27.278  3.6047 1.7220 3.6332 1.6642 -0.2854538E-01 2.394729  
1 1 1 19 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 11 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 0  o 2.9937 1.4171 -4.4769  23.276  -0.6843   35.370  -7.3742   30.914  3.1741 2.1055 2.8133 1.8973 -0.000000      0.000000  
1 1 1 19 12 1  o 8.5163 1.1620 89.879   19.307  44.020    27.527  134.283   27.087  5.9201 1.9788 11.113 1.2188 -5.192410      2.324023  
1 1 1 19 12 2  o 8.6849 1.1773 89.399   19.703  88.608    27.597  90.220    28.141  8.6529 1.6549 8.7168 1.6750 -0.6391048E-01 2.354686  
1 1 1 19 12 3  o 3.6452 1.1528 -2.7012  17.314  -7.6426   24.732  2.0480    24.246  3.4979 1.5955 3.7925 1.6643 -0.2945912     2.305510  
1 1 1 19 12 4  f 5.2473 1.3579 31.074   18.700  39.258    27.511  24.046    25.494  5.6696 1.9760 4.8249 1.8630 0.8446574      2.715801  
1 1 1 19 12 5  o 4.2347 1.2156 6.3809   17.065  31.074    26.352  -11.4536  22.395  5.2402 1.9213 3.2292 1.4896 2.011057       2.431128  
1 1 1 19 12 6  o 4.0056 1.2179 4.9309   17.750  -2.0425   26.466  10.631    23.929  3.8381 1.7089 4.1732 1.7357 -0.3350830     2.435762  
1 1 1 19 12 7  o 4.2623 1.2574 11.038   17.831  10.970    25.713  11.102    24.747  4.2846 1.7920 4.2400 1.7644 0.4457808E-01  2.514884  
1 1 1 19 12 8  o 11.522 0.9583 146.734  21.746  120.902   30.963  171.876   30.547  10.408 1.4874 12.635 1.2088 -2.226707      1.916691  
1 1 1 19 12 9  o 6.0446 1.3935 44.554   19.609  35.980    27.854  52.980    27.612  5.5482 1.9834 6.5411 1.9579 -0.9928107     2.786921  
1 1 1 19 12 10 o 4.3461 1.2216 4.3137   18.977  -31.9429  27.556  37.020    26.172  3.1185 1.5006 5.5737 1.9282 -2.455204      2.443289  
1 1 1 19 12 11 o 9.1638 1.2406 99.767   22.200  93.600    32.240  105.327   30.613  8.7236 1.9015 9.6040 1.5938 -0.8804560     2.481132  
1 1 1 19 12 12 o 9.1373 1.1911 96.985   21.195  94.388    31.283  99.188    28.816  8.8735 1.8237 9.4011 1.5326 -0.5275650     2.382151  
1 1 1 19 12 13 o 5.4779 1.3937 33.238   20.891  57.523    30.541  11.883    28.639  6.5943 2.0755 4.3615 1.8607 2.232781       2.787483  
1 1 1 19 12 14 o 4.5831 1.3631 12.047   21.998  35.000    32.794  -6.7273   29.660  5.3801 2.1030 3.7862 1.7346 1.593891       2.726119  
1 1 1 19 12 15 f 7.6266 1.4058 74.864   24.876  131.589   37.139  28.705    33.502  10.174 1.8949 5.0790 2.0770 5.095208       2.811518  
1 1 1 19 12 16 o 4.3126 1.3304 10.264   22.354  -6.5586   32.311  25.708    30.959  3.8291 1.7744 4.7960 1.9828 -0.9669065     2.660792  
1 1 1 19 12 17 o 5.9177 1.5191 54.828   23.442  80.791    36.678  36.898    30.480  6.8394 2.2842 4.9961 2.0035 1.843247       3.038290  
1 1 1 19 12 18 o 8.4761 1.4713 107.313  24.933  141.346   38.430  82.574    32.766  9.7830 2.0306 7.1692 2.1298 2.613885       2.942683  
1 1 1 19 12 19 o 4.1831 1.2813 17.063   21.744  -12.8717  32.348  41.737    29.369  3.3979 1.6327 4.9683 1.9752 -1.570449      2.562605  
1 1 1 19 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 12 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 0  f 8.7418 1.9817 110.029  30.968  96.745    45.457  121.535   42.305  7.8313 3.0455 9.6523 2.5364 -0.000000      0.000000  
1 1 1 19 13 1  o 3.5984 1.1409 -8.7761  17.940  7.8238    24.012  -29.7522  26.992  4.0588 1.7165 3.1380 1.5034 0.9207823      2.281852  
1 1 1 19 13 2  o 3.5848 1.1287 -11.6709 17.879  12.232    24.378  -39.4939  26.301  4.2738 1.7625 2.8957 1.4104 1.378052       2.257365  
1 1 1 19 13 3  o 10.444 1.0009 120.067  20.708  139.008   29.511  101.698   29.063  11.330 1.3024 9.5588 1.5202 1.770812       2.001842  
1 1 1 19 13 4  o 5.9934 1.3675 43.446   18.674  46.975    26.860  40.145    25.980  6.1978 1.9458 5.7891 1.9219 0.4086375      2.734918  
1 1 1 19 13 5  o 3.7683 1.1824 -2.5705  17.866  6.6970    26.263  -10.5530  24.374  4.1235 1.7711 3.4130 1.5669 0.7105508      2.364718  
1 1 1 19 13 6  o 5.3416 1.2761 21.637   19.768  64.671    29.342  -14.1267  26.749  7.2009 1.9771 3.4823 1.6139 3.718594       2.552213  
1 1 1 19 13 7  o 4.1042 1.2631 3.1716   19.465  11.820    28.662  -4.2317   26.518  4.4490 1.8781 3.7594 1.6895 0.6896412      2.526216  
1 1 1 19 13 8  o 4.6125 1.3584 15.357   20.734  19.129    30.400  12.076    28.353  4.7956 1.9718 4.4294 1.8688 0.3662071      2.716724  
1 1 1 19 13 9  o 4.4749 1.2418 4.0739   20.108  -40.1409  29.516  42.362    27.467  3.0934 1.5039 5.8564 1.9765 -2.763002      2.483619  
1 1 1 19 13 10 f 10.786 1.0477 129.795  22.571  137.074   31.948  122.541   31.893  11.122 1.4362 10.451 1.5259 0.6715288      2.095495  
1 1 1 19 13 11 o 6.0703 1.4526 46.744   20.982  45.724    30.407  47.672    28.991  6.0104 2.0784 6.1302 2.0300 -0.1198654     2.905288  
1 1 1 19 13 12 o 7.0603 1.4436 67.363   23.226  39.902    33.969  91.470    31.828  5.6307 2.1566 8.4899 1.9195 -2.859240      2.887103  
1 1 1 19 13 13 o 11.588 1.1144 156.946  25.726  158.660   38.086  155.507   34.887  11.570 1.6459 11.606 1.5030 -0.3610134E-01 2.228873  
1 1 1 19 13 14 o 3.8077 1.2475 -9.4835  22.596  -3.2883   32.470  -15.3006  31.464  3.9817 1.8208 3.6337 1.7058 0.3479714      2.494992  
1 1 1 19 13 15 o 5.1213 1.4546 33.521   22.904  27.944    33.990  38.160    31.000  4.9241 2.0600 5.3184 2.0542 -0.3943090     2.909174  
1 1 1 19 13 16 o 3.7905 1.2384 -1.3775  22.787  -22.2679  34.618  14.594    30.269  3.4407 1.6622 4.1403 1.8363 -0.6995881     2.476860  
1 1 1 19 13 17 o 4.2697 1.3344 17.679   22.839  4.5339    36.447  26.178    29.307  4.0284 1.8728 4.5110 1.9015 -0.4826727     2.668890  
1 1 1 19 13 18 o 4.5033 1.3511 30.070   21.909  16.131    34.147  39.823    28.563  4.1007 1.8721 4.9060 1.9487 -0.8053908     2.702238  
1 1 1 19 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 0  o 15.054 1.2480 254.214  35.676  223.409   51.107  283.489   49.823  13.985 1.9325 16.124 1.5798 -0.000000      0.000000  
1 1 1 19 14 1  f 6.7955 1.4382 58.095   21.086  55.896    29.972  60.250    29.671  6.6629 2.0495 6.9282 2.0182 -0.2652850     2.876363  
1 1 1 19 14 2  o 6.8832 1.3660 58.364   21.110  31.879    29.879  84.762    29.829  5.3678 2.0305 8.3987 1.8277 -3.030985      2.731961  
1 1 1 19 14 3  o 9.1729 1.2304 100.153  21.748  136.727   31.087  65.095    30.436  11.148 1.3943 7.1976 2.0277 3.950545       2.460781  
1 1 1 19 14 4  o 8.2456 1.3190 81.815   21.417  104.255   31.581  62.710    29.141  9.4030 1.7435 7.0883 1.9796 2.314705       2.637927  
1 1 1 19 14 5  o 6.8330 1.3599 58.256   20.428  78.754    28.589  36.875    29.199  8.0773 1.8141 5.5887 2.0265 2.488622       2.719846  
1 1 1 19 14 6  o 9.6583 1.1275 106.658  21.114  125.823   30.921  89.916    28.900  10.614 1.4566 8.7028 1.7214 1.911046       2.254978  
1 1 1 19 14 7  o 5.1751 1.3674 28.037   20.139  10.457    29.086  44.226    27.911  4.3855 1.8732 5.9646 1.9926 -1.579102      2.734785  
1 1 1 19 14 8  o 10.234 1.1275 118.426  23.060  122.969   33.425  114.300   31.855  10.413 1.6050 10.055 1.5841 0.3583584      2.255066  
1 1 1 19 14 9  o 7.5569 1.4280 73.398   22.106  65.702    32.993  79.667    29.779  7.0802 2.1449 8.0336 1.8857 -0.9533582     2.855959  
1 1 1 19 14 10 o 5.0751 1.2744 3.2124   20.717  71.947    33.171  -40.7456  26.527  7.3071 2.1355 2.8431 1.3916 4.464049       2.548857  
1 1 1 19 14 11 o 8.1161 1.4074 86.609   22.893  72.730    33.054  99.405    31.737  7.3118 2.1302 8.9203 1.8400 -1.608510      2.814883  
1 1 1 19 14 12 o 11.374 1.2104 157.533  25.940  198.961   36.962  117.328   36.412  13.227 1.3972 9.5211 1.9769 3.706429       2.420773  
1 1 1 19 14 13 o 7.5401 1.5649 82.801   25.424  94.089    35.849  71.379    36.062  8.1583 2.1623 6.9218 2.2628 1.236444       3.129770  
1 1 1 19 14 14 o 5.1065 1.4749 33.351   23.774  41.579    35.543  26.689    31.981  5.4100 2.1656 4.8030 2.0028 0.6070900      2.949764  
1 1 1 19 14 15 o 4.8506 1.4039 28.277   23.405  60.772    34.376  0.1993    31.955  5.9198 2.1904 3.7815 1.7566 2.138216       2.807731  
1 1 1 19 14 16 o 5.3802 1.3982 43.824   23.074  7.9743    34.136  73.982    31.309  4.0193 1.8486 6.7411 2.0982 -2.721862      2.796358  
1 1 1 19 14 17 o 3.4634 1.1684 -10.3779 22.105  7.6396    33.971  -23.6084  29.110  3.8734 1.8032 3.0533 1.4864 0.8201315      2.336894  
1 1 1 19 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 14 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 0  o 3.5917 1.6236 -0.2837  27.890  34.549    40.374  -32.0754  38.572  4.5065 2.6480 2.6769 1.8796 -0.000000      0.000000  
1 1 1 19 15 1  o 4.4124 1.3048 8.0841   20.661  29.268    28.793  -14.4032  29.666  5.1751 1.9847 3.6498 1.6944 1.525316       2.609582  
1 1 1 19 15 2  o 4.3012 1.3028 4.9924   20.780  23.800    29.996  -12.3647  28.816  4.9546 1.9872 3.6478 1.6851 1.306799       2.605537  
1 1 1 19 15 3  o 6.2024 1.3595 44.031   21.759  80.160    30.891  8.4526    30.655  8.0176 1.9461 4.3872 1.8989 3.630337       2.719055  
1 1 1 19 15 4  o 8.1558 1.3753 83.693   22.484  63.990    32.314  102.186   31.305  7.0362 2.1207 9.2754 1.7517 -2.239188      2.750627  
1 1 1 19 15 5  o 4.6176 1.3499 13.908   21.060  -1.6902   30.673  27.820    28.967  4.0877 1.8284 5.1475 1.9864 -1.059793      2.699775  
1 1 1 19 15 6  o 8.7648 1.2932 90.418   21.814  114.019   33.696  73.392    28.620  9.7854 1.7876 7.7442 1.8692 2.041147       2.586409  
1 1 1 19 15 7  o 4.5516 1.2927 5.2042   20.610  44.218    30.539  -27.4262  27.929  5.8932 2.0799 3.2100 1.5357 2.683255       2.585417  
1 1 1 19 15 8  o 4.2824 1.3118 9.2054   20.754  5.7243    30.190  12.325    28.579  4.2028 1.8504 4.3620 1.8598 -0.1591535     2.623509  
1 1 1 19 15 9  f 3.9037 1.2183 -12.1212 21.251  -53.7744  31.006  24.781    29.184  2.9372 1.4506 4.8703 1.9578 -1.933192      2.436648  
1 1 1 19 15 10 o 7.2066 1.4936 70.759   23.554  90.187    33.992  52.817    32.668  8.2131 2.0701 6.2001 2.1537 2.012952       2.987250  
1 1 1 19 15 11 o 9.8928 1.3246 124.704  25.183  128.624   37.158  121.373   34.249  9.9693 1.9334 9.8163 1.8112 0.1529646      2.649249  
1 1 1 19 15 12 o 11.884 1.1724 173.458  27.708  174.999   41.295  172.195   37.369  11.808 1.7486 11.961 1.5621 -0.1530991     2.344764  
1 1 1 19 15 13 o 6.4325 1.5702 68.881   25.501  52.062    37.178  83.823    35.044  5.6265 2.2269 7.2385 2.2143 -1.612094      3.140427  
1 1 1 19 15 14 o 6.0189 1.5549 62.292   24.639  56.362    37.226  66.915    32.869  5.6842 2.2351 6.3536 2.1621 -0.6694002     3.109729  
1 1 1 19 15 15 o 6.5864 1.4759 73.665   24.180  42.562    34.217  104.693   34.175  5.0418 2.0844 8.1309 2.0900 -3.089040      2.951816  
1 1 1 19 15 16 o 3.5408 1.1836 -10.7365 22.287  23.139    33.538  -37.5273  29.825  4.2284 1.9002 2.8532 1.4117 1.375247       2.367151  
1 1 1 19 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 15 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 0  o 3.7416 1.6830 13.176   28.172  -0.4503   42.714  23.667    37.480  3.4547 2.2989 4.0285 2.4586 -0.000000      0.000000  
1 1 1 19 16 1  o 7.9610 1.3472 79.576   21.575  99.550    30.402  59.312    30.622  9.1450 1.7255 6.7771 2.0693 2.367820       2.694333  
1 1 1 19 16 2  o 3.4443 1.1278 -18.2379 19.067  1.9890    27.068  -38.1574  26.862  3.9577 1.7468 2.9309 1.4271 1.026883       2.255651  
1 1 1 19 16 3  o 3.6059 1.1864 -15.0422 20.916  -6.8336   28.854  -24.1305  30.361  3.7725 1.7217 3.4394 1.6329 0.3330810      2.372890  
1 1 1 19 16 4  o 8.9957 1.3338 101.110  23.220  100.936   32.312  101.295   33.389  9.0195 1.8532 8.9719 1.9188 0.4763985E-01  2.667637  
1 1 1 19 16 5  o 5.9650 1.4865 46.677   22.060  49.848    31.766  43.722    30.657  6.1194 2.1239 5.8107 2.0804 0.3087487      2.973028  
1 1 1 19 16 6  o 4.6814 1.3784 18.242   21.519  28.351    31.493  9.3898    29.471  5.0815 2.0369 4.2814 1.8575 0.8000879      2.756699  
1 1 1 19 16 7  o 5.4076 1.3368 24.344   21.012  71.237    32.280  -10.1326  27.679  7.2443 2.1036 3.5709 1.6503 3.673413       2.673693  
1 1 1 19 16 8  o 6.0111 1.4896 49.072   22.277  43.552    32.621  53.896    30.496  5.7296 2.1310 6.2927 2.0820 -0.5631471     2.979227  
1 1 1 19 16 9  o 4.2923 1.3459 7.8050   23.044  3.2755    33.519  11.865    31.733  4.1975 1.8917 4.3871 1.9151 -0.1895299     2.691864  
1 1 1 19 16 10 o 3.4677 1.1734 -23.6222 22.991  -29.6308  35.155  -19.1322  30.390  3.4950 1.6851 3.4403 1.6334 0.5468822E-01  2.346790  
1 1 1 19 16 11 o 6.8482 1.4421 64.734   24.046  113.872   36.482  26.990    31.974  8.9283 2.0814 4.7681 1.9967 4.160294       2.884257  
1 1 1 19 16 12 o 4.6898 1.4114 23.058   24.329  56.800    36.714  -3.3586   32.485  5.6621 2.2218 3.7176 1.7413 1.944515       2.822888  
1 1 1 19 16 13 o 5.3915 1.4549 45.153   23.858  18.420    34.430  69.844    33.089  4.3383 1.9391 6.4446 2.1695 -2.106301      2.909738  
1 1 1 19 16 14 o 4.5171 1.3824 29.101   23.138  22.930    33.960  34.448    31.609  4.3320 1.9318 4.7022 1.9780 -0.3702407     2.764832  
1 1 1 19 16 15 o 4.7789 1.4402 39.145   24.507  64.739    37.330  19.757    32.490  5.4870 2.2112 4.0708 1.8459 1.416207       2.880425  
1 1 1 19 16 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 16 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 0  o 2.3547 1.2018 -62.8173 28.820  -76.7743  41.074  -49.2818  40.449  2.2234 1.6175 2.4860 1.7779 -0.000000      0.000000  
1 1 1 19 17 1  o 4.2167 1.2785 -5.3048  21.945  35.122    31.500  -43.4291  30.590  5.3677 2.0714 3.0657 1.4992 2.301928       2.557003  
1 1 1 19 17 2  o 7.7710 1.4719 81.043   23.366  77.411    33.353  84.545    32.745  7.5493 2.1212 7.9926 2.0412 -0.4433193     2.943784  
1 1 1 19 17 3  o 5.2804 1.4449 33.400   21.591  36.892    32.611  30.674    28.810  5.4449 2.1058 5.1159 1.9790 0.3290353      2.889800  
1 1 1 19 17 4  f 4.3984 1.4193 1.1517   27.184  9.1253    33.123  -15.2975  47.575  4.4003 1.9378 4.3966 2.0743 0.3646374E-02  2.838613  
1 1 1 19 17 5  o 8.7681 1.3507 102.902  23.795  67.814    35.360  131.940   32.167  6.8819 2.2402 10.654 1.5096 -3.772381      2.701356  
1 1 1 19 17 6  o 10.186 1.2623 128.998  25.063  129.678   36.979  128.421   34.086  10.040 1.9113 10.333 1.6495 -0.2921791     2.524667  
1 1 1 19 17 7  o 3.5944 1.2025 -19.9376 22.430  -2.4988   34.799  -32.3329  29.338  4.0615 1.8674 3.1272 1.5154 0.9342976      2.404962  
1 1 1 19 17 8  o 4.2754 1.3431 9.3226   23.219  -0.4483   35.086  16.936    30.971  4.0933 1.8795 4.4575 1.9190 -0.3641968     2.686112  
1 1 1 19 17 9  o 8.7990 1.4635 110.818  25.129  117.488   38.434  105.838   33.210  8.8701 2.1816 8.7279 1.9515 0.1422262      2.927059  
1 1 1 19 17 10 o 4.6376 1.3481 22.952   22.880  -12.5738  33.520  53.940    31.307  3.5620 1.6980 5.7132 2.0943 -2.151134      2.696162  
1 1 1 19 17 11 o 3.4478 1.1524 -15.7149 21.898  -43.5664  33.097  5.9696    29.204  3.0422 1.5018 3.8534 1.7484 -0.8111079     2.304825  
1 1 1 19 17 12 o 5.3964 1.4286 47.578   23.332  17.845    34.195  73.476    31.914  4.2263 1.9071 6.5666 2.1276 -2.340360      2.857245  
1 1 1 19 17 13 o 3.8374 1.2568 7.2489   22.707  20.198    34.248  -2.9074   30.331  4.1706 1.8927 3.5042 1.6542 0.6663976      2.513696  
1 1 1 19 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 17 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 0  o 8.3071 2.0822 108.302  32.475  147.453   50.481  80.658    42.418  10.017 2.9035 6.5967 2.9852 -0.000000      0.000000  
1 1 1 19 18 1  o 4.2610 1.2602 1.7712   20.958  -36.9016  29.876  39.239    29.407  3.0871 1.5035 5.4350 2.0229 -2.347932      2.520482  
1 1 1 19 18 2  o 8.5736 1.3312 98.736   23.079  128.568   32.019  66.481    33.294  10.394 1.5403 6.7533 2.1716 3.640739       2.662390  
1 1 1 19 18 3  o 4.8797 1.4018 26.832   21.704  37.194    31.010  16.882    30.389  5.2997 2.0524 4.4596 1.9100 0.8401332      2.803617  
1 1 1 19 18 4  o 4.2783 1.3254 11.353   21.808  4.6199    31.253  17.743    30.445  4.0785 1.8334 4.4781 1.9147 -0.3996248     2.650887  
1 1 1 19 18 5  o 5.1728 1.4434 34.983   22.532  23.417    32.765  45.359    31.035  4.7130 1.9998 5.6326 2.0818 -0.9196010     2.886733  
1 1 1 19 18 6  o 3.3340 1.1198 -20.7801 21.058  -48.1054  32.840  -1.6992   27.442  3.0230 1.4930 3.6451 1.6694 -0.6220453     2.239661  
1 1 1 19 18 7  o 6.2098 1.3935 54.374   23.570  106.465   34.881  10.605    31.974  8.3473 2.0932 4.0723 1.8402 4.275001       2.787097  
1 1 1 19 18 8  o 5.4095 1.3212 32.780   23.559  -27.9843  34.360  86.693    32.365  3.3388 1.6230 7.4803 2.0852 -4.141430      2.642411  
1 1 1 19 18 9  o 4.3295 1.3377 16.277   23.335  -8.5491   34.290  37.691    31.846  3.6792 1.7434 4.9798 2.0294 -1.300580      2.675435  
1 1 1 19 18 10 o 3.6962 1.2213 -5.3337  22.406  20.210    33.894  -25.1623  29.862  4.2843 1.9188 3.1081 1.5114 1.176160       2.442548  
1 1 1 19 18 11 o 4.3797 1.3638 26.137   23.755  12.355    34.650  38.360    32.631  3.9984 1.8474 4.7610 2.0066 -0.7625592     2.727504  
1 1 1 19 18 12 o 3.1652 1.1010 -34.3949 23.838  2.3629    35.359  -65.0221  32.276  3.7061 1.7602 2.6242 1.3229 1.081857       2.201918  
1 1 1 19 18 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 18 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 0  o 6.0283 2.0630 79.790   34.605  38.724    50.938  114.989   47.159  4.2355 2.7038 7.8211 3.1167 -0.000000      0.000000  
1 1 1 19 19 1  o 4.4517 1.3751 21.973   23.291  16.364    33.954  26.956    32.008  4.2991 1.9233 4.6044 1.9658 -0.3052959     2.750156  
1 1 1 19 19 2  o 5.2256 1.4700 43.297   23.214  35.137    32.652  51.637    33.011  4.8843 2.0291 5.5670 2.1274 -0.6827717     2.939964  
1 1 1 19 19 3  o 8.9323 1.4237 117.620  24.729  126.459   36.982  110.473   33.257  9.1606 2.0676 8.7039 1.9579 0.4566965      2.847491  
1 1 1 19 19 4  o 7.4885 1.4954 87.710   23.293  93.654    34.758  82.864    31.384  7.6415 2.1718 7.3356 2.0563 0.3059187      2.990898  
1 1 1 19 19 5  o 5.3462 1.4667 45.053   23.220  30.491    33.801  58.066    31.952  4.7452 2.0229 5.9472 2.1244 -1.201957      2.933466  
1 1 1 19 19 6  o 5.3210 1.4774 45.827   23.589  32.655    33.901  58.191    32.844  4.7800 2.0315 5.8621 2.1456 -1.082160      2.954764  
1 1 1 19 19 7  f 4.7719 1.4225 34.454   23.448  25.999    33.643  42.440    32.697  4.4778 1.9628 5.0659 2.0595 -0.5881891     2.845063  
1 1 1 19 19 8  o 5.3095 1.4236 42.155   23.657  82.887    34.704  6.7977    32.334  6.7633 2.2202 3.8557 1.7825 2.907649       2.847223  
1 1 1 19 19 9  o 4.3852 1.3674 25.813   24.975  -0.6275   37.710  46.473    33.334  3.7640 1.7962 5.0064 2.0624 -1.242375      2.734886  
1 1 1 19 19 10 o 4.5350 1.4005 29.505   24.949  64.204    37.547  2.0711    33.386  5.4235 2.2062 3.6466 1.7257 1.776989       2.800930  
1 1 1 19 19 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 19 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 0  o 3.1375 1.5099 -4.1879  30.869  -46.9293  50.676  21.029    38.925  2.7075 1.9449 3.5674 2.3102 -0.000000      0.000000  
1 1 1 19 20 1  o 4.4869 1.3408 21.089   22.264  50.603    32.296  -5.6383   30.734  5.4242 2.0962 3.5496 1.6724 1.874573       2.681600  
1 1 1 19 20 2  o 4.0186 1.2931 11.563   22.837  7.2138    34.171  15.074    30.699  3.9566 1.8304 4.0806 1.8269 -0.1239567     2.586102  
1 1 1 19 20 3  o 4.8161 1.4254 32.764   24.335  60.497    35.360  7.8103    33.541  5.6955 2.1955 3.9366 1.8184 1.758966       2.850756  
1 1 1 19 20 4  o 5.3185 1.4836 50.023   25.157  24.707    36.980  71.831    34.323  4.4066 1.9863 6.2305 2.2044 -1.823841      2.967288  
1 1 1 19 20 5  o 3.8716 1.2666 -2.1845  23.998  36.886    35.701  -34.3882  32.412  4.6991 2.0416 3.0440 1.4995 1.655154       2.533124  
1 1 1 19 20 6  o 4.0183 1.2911 7.1105   22.978  46.131    35.883  -20.0148  29.917  4.9106 2.0886 3.1260 1.5184 1.784657       2.582171  
1 1 1 19 20 7  o 4.4294 1.3890 32.282   24.676  25.485    36.211  38.175    33.716  4.2425 1.9334 4.6164 1.9948 -0.3738685     2.777978  
1 1 1 19 20 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 20 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 0  o 7.9353 2.2078 130.520  33.896  128.627   51.134  132.003   45.273  7.4286 3.2772 8.4419 2.9592 -0.000000      0.000000  
1 1 1 19 21 1  o 3.4587 1.1683 -10.0218 23.036  -33.2675  32.170  14.442    33.002  2.9940 1.4785 3.9233 1.8093 -0.9293263     2.336536  
1 1 1 19 21 2  o 5.5047 1.5054 60.280   24.668  38.884    34.209  83.459    35.605  4.6274 2.0045 6.3820 2.2466 -1.754548      3.010792  
1 1 1 19 21 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 21 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 22 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 23 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 24 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 25 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 26 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 26 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 26 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 26 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 26 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 19 26 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 1  0  o 2.4352 1.5717 1.0449   17.816  0.0000    0.0000  1.0449    17.816  2.4352 1.5717 2.4352 1.5717 -0.000000      0.000000  
1 1 1 20 1  1  o 10.840 0.7468 122.965  16.066  105.804   22.672  140.275   22.770  10.046 1.1284 11.634 0.9786 -1.588123      1.493688  
1 1 1 20 1  2  o 9.0192 0.8079 85.453   14.550  91.890    20.783  79.266    20.376  9.3647 1.1096 8.6738 1.1746 0.6908779      1.615830  
1 1 1 20 1  3  o 5.4229 1.0316 32.814   11.525  38.491    16.481  27.381    16.124  5.8732 1.4189 4.9726 1.4979 0.9006433      2.063234  
1 1 1 20 1  4  o 8.3375 1.2119 83.285   16.025  68.931    35.601  86.932    17.945  7.5122 2.2172 9.1628 0.9792 -1.650607      2.423775  
1 1 1 20 1  5  f 6.9094 1.2398 57.347   15.240  44.841    34.620  60.353    16.973  6.2314 2.2129 7.5873 1.1185 -1.355855      2.479553  
1 1 1 20 1  6  o 10.418 1.1318 122.703  17.689  119.599   39.848  123.464   19.740  9.9193 2.0753 10.917 0.9041 -0.9972277     2.263676  
1 1 1 20 1  7  o 8.7059 1.2174 85.360   17.132  89.349    37.176  84.285    19.305  8.4563 2.1831 8.9555 1.0778 -0.4992218     2.434705  
1 1 1 20 1  8  o 6.4035 1.2374 53.074   16.119  23.366    36.712  60.169    17.940  5.2825 2.1688 7.5245 1.1921 -2.242038      2.474875  
1 1 1 20 1  9  o 3.5636 1.1307 0.1390   14.274  -26.7531  35.186  5.4362    15.616  3.7481 1.7731 3.3790 1.4035 0.3690674      2.261351  
1 1 1 20 1  10 o 4.4303 1.2448 18.330   14.994  -3.2316   36.731  22.641    16.424  4.3373 1.9651 4.5232 1.5284 -0.1858253     2.489502  
1 1 1 20 1  11 o 7.7973 1.2921 82.754   17.477  52.468    39.869  89.957    19.444  6.3785 2.3591 9.2162 1.0549 -2.837642      2.584251  
1 1 1 20 1  12 f 6.6366 1.2871 60.609   17.430  30.321    40.920  67.322    19.266  5.4193 2.2632 7.8538 1.2265 -2.434503      2.574157  
1 1 1 20 1  13 o 9.6428 1.2789 111.051  18.594  112.376   42.966  110.746   20.626  9.0636 2.3505 10.222 1.0089 -1.158312      2.557851  
1 1 1 20 1  14 o 7.5222 1.3376 79.329   18.253  43.898    45.130  86.258    19.958  6.0534 2.4342 8.9910 1.1099 -2.937605      2.675247  
1 1 1 20 1  15 o 6.3935 1.2358 49.297   16.203  50.446    21.574  47.811    24.540  6.5267 1.6514 6.2604 1.8388 0.2662935      2.471536  
1 1 1 20 1  16 o 5.4074 1.1387 35.881   15.314  53.054    19.462  7.9669    24.814  6.7611 1.4803 4.0536 1.7307 2.707537       2.277444  
1 1 1 20 1  17 f 3.3543 1.0815 -9.1217  15.791  -13.6859  20.607  -2.6293   24.577  3.0236 1.4065 3.6849 1.6433 -0.6613302     2.163051  
1 1 1 20 1  18 o 4.6512 1.2379 20.597   16.540  32.745    22.465  6.2170    24.442  5.3032 1.7875 3.9992 1.7129 1.304037       2.475730  
1 1 1 20 1  19 o 4.1004 1.2379 6.4352   18.110  15.285    26.351  -1.4869   24.932  4.4670 1.8361 3.7339 1.6608 0.7330995      2.475832  
1 1 1 20 1  20 f 11.084 0.9243 134.458  20.266  139.991   27.188  127.538   30.403  11.419 1.1905 10.749 1.4143 0.6702156      1.848601  
1 1 1 20 1  21 o 4.8230 1.2469 23.422   17.662  43.396    23.876  -0.7197   26.249  5.8675 1.8332 3.7784 1.6907 2.089111       2.493818  
1 1 1 20 1  22 o 5.0330 1.1992 18.265   18.150  -18.8739  24.580  62.794    26.914  3.1231 1.4788 6.9428 1.8883 -3.819637      2.398451  
1 1 1 20 1  23 o 11.443 0.9905 154.381  22.509  161.581   30.745  146.064   33.043  11.854 1.2969 11.033 1.4975 0.8207312      1.980975  
1 1 1 20 1  24 o 4.6387 1.3474 28.746   20.387  34.799    26.590  20.114    31.754  4.9146 1.9013 4.3629 1.9098 0.5517263      2.694870  
1 1 1 20 1  25 o 3.3077 1.1152 -8.6360  19.865  -10.2255  25.290  -6.0753   32.099  3.1182 1.4832 3.4971 1.6656 -0.3789382     2.230307  
1 1 1 20 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 1  31 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 2  0  o 3.2559 1.4554 -0.5669  22.165  -27.4333  32.165  23.726    30.586  2.5011 1.7475 4.0107 2.3279 -0.000000      0.000000  
1 1 1 20 2  1  o 6.5813 1.0749 51.986   13.272  36.246    24.763  58.329    15.720  5.6765 1.8760 7.4860 1.0500 -1.809422      2.149868  
1 1 1 20 2  2  o 6.8593 1.2570 52.715   15.175  56.159    33.032  51.793    17.085  6.8286 2.1596 6.8901 1.2872 -0.6146717E-01 2.514090  
1 1 1 20 2  3  o 14.958 0.8599 240.076  20.983  230.995   44.638  242.652   23.773  14.523 1.5368 15.393 0.7722 -0.8704453     1.719897  
1 1 1 20 2  4  o 5.9525 1.1890 46.831   16.206  -1.3795   38.256  57.375    17.891  4.5648 2.0419 7.3401 1.2187 -2.775223      2.377929  
1 1 1 20 2  5  o 5.2080 1.1402 34.065   15.644  -23.6294  35.740  47.739    17.399  3.8784 1.8198 6.5377 1.3743 -2.659281      2.280433  
1 1 1 20 2  6  o 8.0303 1.2453 62.426   16.233  101.830   37.420  53.292    18.016  9.1248 2.0948 6.9358 1.3473 2.189006       2.490645  
1 1 1 20 2  7  o 7.3186 1.2730 64.863   16.149  55.615    36.614  67.097    17.993  6.6707 2.2819 7.9665 1.1293 -1.295819      2.546048  
1 1 1 20 2  8  o 4.1872 1.2764 6.6261   14.511  17.736    37.302  4.6449    15.752  5.0309 2.1342 3.3435 1.4009 1.687357       2.552890  
1 1 1 20 2  9  o 4.3473 1.3253 1.9901   15.650  35.755    39.421  -4.3273   17.052  5.6700 2.2768 3.0246 1.3573 2.645415       2.650660  
1 1 1 20 2  10 o 5.2765 1.3210 32.194   15.970  20.574    37.101  34.837    17.692  5.0840 2.1410 5.4689 1.5478 -0.3848929     2.641901  
1 1 1 20 2  11 f 10.545 1.2468 135.519  19.138  125.484   44.058  137.853   21.248  9.6385 2.3147 11.452 0.9277 -1.813478      2.493651  
1 1 1 20 2  12 o 4.5051 1.2750 19.570   15.927  -15.7030  43.162  25.130    17.136  4.3137 2.0163 4.6965 1.5610 -0.3827944     2.549929  
1 1 1 20 2  13 o 5.0118 1.2581 30.077   17.057  -12.4863  39.264  39.979    18.938  4.2140 1.9538 5.8096 1.5856 -1.595660      2.516258  
1 1 1 20 2  14 o 6.4298 1.3397 54.993   17.851  29.767    41.122  60.850    19.815  5.5202 2.2839 7.3393 1.4010 -1.819091      2.679394  
1 1 1 20 2  15 o 7.3472 1.3778 66.192   18.101  65.857    41.867  66.269    20.075  6.9065 2.4356 7.7879 1.2888 -0.8814678     2.755572  
1 1 1 20 2  16 o 7.9080 1.3641 84.279   18.911  61.580    43.879  89.457    20.957  6.6903 2.4748 9.1256 1.1483 -2.435306      2.728257  
1 1 1 20 2  17 o 4.6203 1.3669 15.016   19.664  10.742    37.827  16.599    23.019  4.8307 2.1001 4.4099 1.7501 0.4207768      2.733752  
1 1 1 20 2  18 o 4.4341 1.3155 13.886   18.197  -8.4587   40.584  19.508    20.358  4.4216 2.0270 4.4466 1.6775 -0.2506924E-01 2.631076  
1 1 1 20 2  19 o 4.7734 1.4096 15.833   18.721  29.929    41.592  12.251    20.965  5.4923 2.2866 4.0546 1.6488 1.437678       2.819105  
1 1 1 20 2  20 o 5.4717 1.4539 33.618   19.188  39.148    41.017  32.068    21.709  5.7447 2.3169 5.1988 1.7572 0.5458150      2.907861  
1 1 1 20 2  21 o 5.7435 1.4841 40.029   19.520  48.482    43.411  37.887    21.854  5.9683 2.3918 5.5186 1.7578 0.4497590      2.968248  
1 1 1 20 2  22 o 5.2236 1.3320 37.055   20.644  -23.5640  48.148  50.710    22.851  4.1824 2.0049 6.2648 1.7542 -2.082336      2.663997  
1 1 1 20 2  23 o 6.2898 1.5568 60.123   21.304  87.080    47.123  53.198    23.884  6.4928 2.5257 6.0868 1.8207 0.4060869      3.113508  
1 1 1 20 2  24 o 6.6993 1.4019 81.825   22.420  51.037    50.033  89.560    25.078  5.1520 2.3175 8.2465 1.5780 -3.094532      2.803734  
1 1 1 20 2  25 o 3.6991 1.2584 1.2420   21.224  18.016    51.040  -2.2649   23.337  4.2117 2.0305 3.1865 1.4871 1.025134       2.516883  
1 1 1 20 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 3  0  o 7.4174 1.7807 81.072   25.785  54.362    37.329  105.448   35.660  5.6278 2.7732 9.2070 2.2346 -0.000000      0.000000  
1 1 1 20 3  1  o 6.7704 1.2415 53.941   17.294  68.066    24.720  40.400    24.203  7.6771 1.6584 5.8637 1.8480 1.813408       2.483000  
1 1 1 20 3  2  o 4.9670 1.2355 22.851   16.907  43.899    23.933  1.8862    23.886  6.0955 1.8224 3.8385 1.6688 2.256964       2.471054  
1 1 1 20 3  3  o 8.1754 1.1303 76.316   17.768  78.809    24.300  73.451    26.048  8.3771 1.5057 7.9738 1.6860 0.4032769      2.260506  
1 1 1 20 3  4  o 5.4356 1.1308 23.133   16.410  -9.3257   21.664  66.830    25.136  3.2771 1.4942 7.5940 1.6976 -4.316833      2.261533  
1 1 1 20 3  5  o 12.865 0.9845 187.603  19.839  164.751   43.060  193.761   22.353  12.010 1.7926 13.720 0.8146 -1.709480      1.969025  
1 1 1 20 3  6  o 8.5924 1.2319 72.197   17.778  119.395   38.423  59.341    20.054  9.9218 2.0053 7.2631 1.4314 2.658665       2.463761  
1 1 1 20 3  7  o 8.6360 1.2631 113.398  18.270  44.942    40.816  130.551   20.431  6.0868 2.3553 11.185 0.9133 -5.098584      2.526201  
1 1 1 20 3  8  o 9.2667 1.2851 115.197  18.293  80.926    40.639  123.906   20.486  7.6649 2.3912 10.868 0.9425 -3.203423      2.570238  
1 1 1 20 3  9  o 8.3004 1.3184 89.875   17.631  69.938    41.408  94.291    19.485  7.1536 2.4268 9.4471 1.0313 -2.293430      2.636819  
1 1 1 20 3  10 o 4.5015 1.1156 21.860   15.394  -49.7273  37.232  36.622    16.907  3.4093 1.6644 5.5937 1.4861 -2.184488      2.231274  
1 1 1 20 3  11 o 4.8516 1.3716 12.513   16.085  52.171    38.560  4.1588    17.698  6.2667 2.3196 3.4365 1.4643 2.830234       2.743156  
1 1 1 20 3  12 o 4.6732 1.1459 23.165   16.894  -53.8513  38.478  41.557    18.804  3.4219 1.6751 5.9245 1.5640 -2.502526      2.291739  
1 1 1 20 3  13 o 11.130 1.2776 162.134  20.578  116.924   44.883  174.167   23.155  9.3333 2.3931 12.927 0.8956 -3.594035      2.555186  
1 1 1 20 3  14 o 8.5073 1.3719 93.650   19.267  78.595    44.059  97.210    21.423  7.4755 2.5034 9.5390 1.1229 -2.063495      2.743756  
1 1 1 20 3  15 o 4.3135 1.2631 14.790   17.008  -30.8171  43.981  22.809    18.443  4.0720 1.9422 4.5551 1.6154 -0.4831147     2.526212  
1 1 1 20 3  16 o 4.7200 1.2958 21.878   17.350  -10.3947  39.438  29.623    19.320  4.3432 1.9936 5.0967 1.6557 -0.7535415     2.591532  
1 1 1 20 3  17 o 5.2425 1.3769 30.863   18.147  17.456    39.127  34.538    20.483  5.0616 2.1675 5.4234 1.6986 -0.3617849     2.753772  
1 1 1 20 3  18 o 5.7185 1.5212 37.163   22.074  44.396    41.241  34.258    26.132  6.0306 2.3581 5.4064 1.9223 0.6242166      3.042343  
1 1 1 20 3  19 o 5.5946 1.4347 36.263   18.749  27.112    43.239  38.382    20.807  5.4952 2.3126 5.6940 1.6985 -0.1987395     2.869330  
1 1 1 20 3  20 o 4.1070 1.2181 10.437   17.709  -43.8992  41.188  22.760    19.615  3.6751 1.7843 4.5390 1.6586 -0.8638825     2.436143  
1 1 1 20 3  21 o 8.2161 1.4391 91.940   21.044  84.626    46.842  93.789    23.556  7.2720 2.5750 9.1601 1.2858 -1.888120      2.878135  
1 1 1 20 3  22 o 6.0363 1.5529 33.235   20.994  109.132   47.297  14.612    23.428  7.9698 2.5907 4.1028 1.7128 3.867013       3.105715  
1 1 1 20 3  23 o 3.3314 1.1569 -23.7071 19.695  -7.3092   43.420  -27.9550  22.099  4.0309 1.9246 2.6318 1.2843 1.399122       2.313779  
1 1 1 20 3  24 o 4.7393 1.3960 37.040   22.665  11.961    51.165  43.162    25.281  4.2913 2.0597 5.1873 1.8849 -0.8960032     2.792008  
1 1 1 20 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 3  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 4  0  o 3.0452 1.4244 -3.1749  22.687  4.0893    32.650  -9.9563   31.546  3.2667 2.1155 2.8236 1.9080 -0.000000      0.000000  
1 1 1 20 4  1  o 7.3805 1.2087 63.195   18.546  89.294    26.476  38.052    25.987  9.0328 1.4655 5.7283 1.9226 3.304455       2.417479  
1 1 1 20 4  2  o 13.791 0.7896 200.684  21.776  204.276   31.094  197.227   30.507  13.911 1.1176 13.670 1.1158 0.2410049      1.579248  
1 1 1 20 4  3  o 7.2643 1.2468 62.381   17.942  65.816    24.743  58.572    26.056  7.5236 1.6861 7.0051 1.8371 0.5185022      2.493581  
1 1 1 20 4  4  o 11.400 0.9043 140.229  20.387  115.660   28.332  166.611   29.359  10.298 1.3756 12.502 1.1742 -2.203591      1.808536  
1 1 1 20 4  5  o 6.4289 1.2994 50.345   17.677  43.830    25.364  56.497    24.649  6.0074 1.8915 6.8505 1.7821 -0.8431249     2.598804  
1 1 1 20 4  6  o 4.6840 1.2739 21.786   16.902  17.455    24.104  25.976    23.707  4.4673 1.7851 4.9007 1.8179 -0.4333696     2.547773  
1 1 1 20 4  7  o 11.495 0.8907 143.580  20.471  138.817   28.732  148.491   29.174  11.292 1.2722 11.698 1.2470 -0.4055853     1.781463  
1 1 1 20 4  8  o 6.7259 1.2948 58.126   16.657  40.388    38.705  62.158    18.453  5.8612 2.2865 7.5906 1.2155 -1.729376      2.589502  
1 1 1 20 4  9  o 5.4177 1.3952 29.016   15.867  51.168    38.078  24.362    17.455  6.2006 2.3031 4.6348 1.5756 1.565765       2.790483  
1 1 1 20 4  10 o 7.1708 1.3326 68.143   17.935  50.242    40.942  72.394    19.951  6.1853 2.3679 8.1563 1.2231 -1.970973      2.665138  
1 1 1 20 4  11 o 4.7670 1.1177 26.443   16.108  -51.4215  38.197  43.284    17.764  3.4403 1.6809 6.0937 1.4737 -2.653445      2.235468  
1 1 1 20 4  12 o 12.091 1.2479 187.299  21.425  140.501   47.241  199.417   24.039  10.334 2.3401 13.849 0.8679 -3.515211      2.495886  
1 1 1 20 4  13 o 10.734 1.1387 131.792  19.815  131.584   40.455  131.857   22.728  10.290 2.0378 11.177 1.0167 -0.8867779     2.277303  
1 1 1 20 4  14 o 10.040 1.3380 134.639  20.171  102.197   45.046  142.776   22.559  8.4487 2.4941 11.632 0.9697 -3.182998      2.675967  
1 1 1 20 4  15 o 4.0439 1.2097 7.2973   17.423  -46.8441  40.362  19.696    19.315  3.6705 1.7784 4.4173 1.6404 -0.7467639     2.419413  
1 1 1 20 4  16 o 7.8031 1.4539 66.894   19.916  99.698    43.001  57.936    22.471  8.5802 2.4077 7.0259 1.6306 1.554259       2.907878  
1 1 1 20 4  17 o 8.4894 1.4222 85.141   20.606  96.221    45.284  82.248    23.140  8.3056 2.5121 8.6731 1.3340 -0.3675566     2.844346  
1 1 1 20 4  18 o 11.402 1.2184 150.780  21.731  152.210   46.411  150.378   24.593  10.884 2.2076 11.921 1.0315 -1.037412      2.436733  
1 1 1 20 4  19 o 8.3323 1.5100 87.653   23.346  103.002   44.711  81.900    27.374  8.4318 2.4836 8.2328 1.7181 0.1990156      3.019925  
1 1 1 20 4  20 o 4.3869 1.6886 19.921   20.892  0.0000    0.0000  19.921    20.892  ?      ?      4.3869 1.6886 ?              ?         
1 1 1 20 4  21 o 8.5804 1.4310 108.119  21.250  85.681    49.004  113.315   23.583  7.0484 2.6138 10.112 1.1660 -3.064021      2.862073  
1 1 1 20 4  22 o 3.9959 1.1604 8.6307   19.421  -86.9310  41.927  34.735    21.913  2.9968 1.5103 4.9950 1.7620 -1.998177      2.320705  
1 1 1 20 4  23 o 5.2877 1.5154 40.301   21.469  74.396    46.062  30.839    24.266  5.9164 2.4293 4.6589 1.8124 1.257478       3.030863  
1 1 1 20 4  24 o 4.5436 1.3988 32.307   21.212  47.501    46.285  28.267    23.866  4.7571 2.1748 4.3300 1.7598 0.4271607      2.797661  
1 1 1 20 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 4  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 5  0  o 3.7872 1.6290 13.230   24.377  37.008    35.774  -7.3807   33.306  4.6289 2.5860 2.9456 1.9815 -0.000000      0.000000  
1 1 1 20 5  1  o 5.4383 1.2075 25.970   18.072  -8.3767   24.699  65.547    26.512  3.5059 1.5973 7.3706 1.8114 -3.864722      2.415061  
1 1 1 20 5  2  o 11.544 0.9037 144.922  20.442  111.538   28.286  181.420   29.576  10.052 1.4070 13.036 1.1344 -2.984382      1.807331  
1 1 1 20 5  3  f 10.835 0.9243 127.991  19.917  111.458   27.616  145.911   28.751  10.060 1.3726 11.610 1.2382 -1.550209      1.848596  
1 1 1 20 5  4  o 7.0807 1.2911 61.515   18.449  65.903    25.638  56.802    26.568  7.3929 1.7594 6.7686 1.8901 0.6242127      2.582253  
1 1 1 20 5  5  o 3.6797 1.1088 -6.3885  16.435  21.415    22.970  -35.5571  23.527  4.6256 1.7730 2.7339 1.3321 1.891678       2.217637  
1 1 1 20 5  6  o 3.7987 1.1604 1.6339   16.660  -10.8307  24.101  13.041    23.056  3.3807 1.5543 4.2168 1.7236 -0.8361199     2.320870  
1 1 1 20 5  7  o 4.7507 1.2827 22.405   17.451  11.865    25.110  32.251    24.270  4.2455 1.7729 5.2559 1.8543 -1.010375      2.565477  
1 1 1 20 5  8  o 3.7451 1.1583 2.6221   16.513  0.0951    23.491  5.0904    23.217  3.6587 1.6205 3.8316 1.6555 -0.1728749     2.316603  
1 1 1 20 5  9  o 4.4333 1.2538 16.846   17.168  8.2149    24.730  24.875    23.851  4.0576 1.7300 4.8091 1.8154 -0.7515659     2.507683  
1 1 1 20 5  10 o 6.5062 1.4119 42.479   15.826  78.115    40.218  35.950    17.215  7.4753 2.3849 5.5372 1.5119 1.938136       2.823810  
1 1 1 20 5  11 o 13.078 0.9779 192.191  21.278  179.069   43.280  196.374   24.435  12.426 1.7415 13.730 0.8899 -1.304062      1.955714  
1 1 1 20 5  12 o 5.2090 1.3972 28.610   17.304  26.322    40.932  29.108    19.094  5.3869 2.2577 5.0311 1.6466 0.3558159      2.794334  
1 1 1 20 5  13 o 7.6780 1.2515 87.221   18.522  34.502    39.367  102.209   20.990  5.5696 2.2615 9.7865 1.0724 -4.216838      2.502916  
1 1 1 20 5  14 o 5.9789 1.4621 41.205   18.436  47.995    42.284  39.611    20.486  6.1861 2.3963 5.7716 1.6758 0.4145751      2.924131  
1 1 1 20 5  15 o 9.6939 1.2744 109.362  20.578  112.545   41.746  108.340   23.651  9.3253 2.2616 10.062 1.1752 -0.7371330     2.548706  
1 1 1 20 5  16 o 8.5783 1.4039 73.983   19.329  125.937   45.999  62.842    21.301  9.7393 2.3814 7.4172 1.4877 2.322108       2.807870  
1 1 1 20 5  17 o 5.4798 1.3999 35.817   18.241  20.583    42.814  39.195    20.163  5.2262 2.2531 5.7333 1.6619 -0.5071483     2.799713  
1 1 1 20 5  18 o 8.4466 1.4323 92.062   20.255  82.745    47.635  94.119    22.379  7.5537 2.6020 9.3395 1.1981 -1.785775      2.864581  
1 1 1 20 5  19 o 9.4686 1.3345 106.198  20.706  122.858   44.409  101.570   23.406  9.3196 2.3755 9.6176 1.2168 -0.2980127     2.669018  
1 1 1 20 5  20 o 5.0348 1.4302 29.031   22.628  2.6834    43.929  38.546    26.399  4.5971 2.1080 5.4724 1.9336 -0.8752832     2.860459  
1 1 1 20 5  21 o 6.7917 1.5053 63.521   20.293  79.937    44.271  59.155    22.832  6.8084 2.4912 6.7749 1.6905 0.3349066E-01  3.010671  
1 1 1 20 5  22 o 5.4940 1.3048 49.650   21.175  -9.6819   46.332  65.315    23.807  4.0737 1.9565 6.9142 1.7268 -2.840447      2.609545  
1 1 1 20 5  23 o 3.7484 1.2617 -2.0337  21.220  20.635    44.904  -8.5518   24.079  4.3720 2.0477 3.1247 1.4747 1.247343       2.523446  
1 1 1 20 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 6  0  o 5.8391 1.9409 58.224   25.914  70.566    37.828  47.312    35.570  6.5259 2.8171 5.1523 2.6706 -0.000000      0.000000  
1 1 1 20 6  1  o 4.3838 1.2396 14.137   17.234  27.632    24.135  0.0963    24.618  5.0015 1.8380 3.7661 1.6639 1.235411       2.479263  
1 1 1 20 6  2  o 5.4729 1.3061 34.549   17.638  21.267    24.804  48.137    25.087  4.6852 1.8297 6.2607 1.8645 -1.575502      2.612250  
1 1 1 20 6  3  o 7.2857 1.2484 63.314   18.117  51.409    24.708  77.156    26.642  6.4941 1.8261 8.0773 1.7029 -1.583144      2.496855  
1 1 1 20 6  4  o 4.1361 1.1388 1.0055   16.633  35.883    23.715  -32.7644  23.336  5.4957 1.8367 2.7765 1.3469 2.719220       2.277611  
1 1 1 20 6  5  o 3.1964 1.0432 -15.8222 16.036  -31.4453  22.269  1.0064    23.112  2.7058 1.3133 3.6871 1.6213 -0.9812074     2.086478  
1 1 1 20 6  6  o 3.6247 1.1316 0.5001   16.079  -0.6389   22.802  1.6266    22.676  3.5867 1.5922 3.6627 1.6084 -0.7595110E-01 2.263141  
1 1 1 20 6  7  o 5.4880 1.3136 35.505   18.150  19.354    25.985  50.892    25.363  4.5957 1.8474 6.3803 1.8681 -1.784614      2.627265  
1 1 1 20 6  8  o 6.0713 1.2539 44.993   18.231  17.569    26.515  69.581    25.107  4.5324 1.8500 7.6102 1.6932 -3.077755      2.507863  
1 1 1 20 6  9  o 5.9540 1.3237 42.532   18.732  61.528    26.522  23.623    26.461  7.0654 1.8537 4.8427 1.8902 2.222753       2.647445  
1 1 1 20 6  10 o 3.7228 1.1568 -5.7621  17.602  14.739    25.241  -25.1701  24.558  4.4036 1.8020 3.0419 1.4510 1.361663       2.313628  
1 1 1 20 6  11 o 14.589 0.8061 227.840  23.490  224.648   33.900  230.788   32.580  14.464 1.1719 14.715 1.1071 -0.2508497     1.612130  
1 1 1 20 6  12 o 7.1095 1.2338 62.556   20.342  22.103    29.434  99.548    28.146  4.8402 1.9589 9.3789 1.5005 -4.538748      2.467579  
1 1 1 20 6  13 o 8.2412 1.3050 91.450   18.672  62.557    39.548  99.738    21.182  6.8075 2.3694 9.6748 1.0947 -2.867307      2.610026  
1 1 1 20 6  14 o 6.6576 1.4723 33.231   19.005  108.353   44.404  16.384    21.028  9.0057 2.4155 4.3095 1.6842 4.696164       2.944648  
1 1 1 20 6  15 o 5.8256 1.4012 41.258   18.563  31.997    38.334  44.095    21.217  5.5535 2.2398 6.0978 1.6841 -0.5442438     2.802311  
1 1 1 20 6  16 f 10.664 1.2304 114.240  20.805  172.066   48.314  101.077   23.051  11.645 2.1539 9.6832 1.1903 1.961311       2.460868  
1 1 1 20 6  17 o 7.1940 1.3568 66.484   18.884  50.873    40.377  70.855    21.365  6.3305 2.3676 8.0575 1.3258 -1.726957      2.713554  
1 1 1 20 6  18 o 5.1815 1.4666 25.923   18.514  41.628    45.545  22.814    20.264  5.8020 2.4023 4.5611 1.6829 1.240849       2.933118  
1 1 1 20 6  19 o 4.9862 1.1936 30.267   18.384  -45.5645  40.926  49.436    20.577  3.6098 1.7585 6.3626 1.6144 -2.752859      2.387143  
1 1 1 20 6  20 o 5.2351 1.4975 23.465   19.974  70.644    45.307  12.083    22.253  6.5091 2.4912 3.9611 1.6626 2.547985       2.995035  
1 1 1 20 6  21 o 8.7121 1.5615 123.372  26.616  121.878   47.064  124.074   32.272  7.8575 2.5858 9.5668 1.7512 -1.709325      3.122974  
1 1 1 20 6  22 o 3.2438 1.0939 -11.3083 18.902  -71.4137  44.938  1.6112    20.834  3.2000 1.6061 3.2875 1.4856 -0.8749866E-01 2.187813  
1 1 1 20 6  23 f 5.2701 1.4123 52.236   20.773  47.211    45.711  53.544    23.321  4.7469 2.1667 5.7933 1.8121 -1.046422      2.824569  
1 1 1 20 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 6  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 7  0  o 4.1920 1.7430 27.322   26.014  10.437    38.831  41.070    35.038  3.6047 2.3243 4.7794 2.5981 -0.000000      0.000000  
1 1 1 20 7  1  o 6.4870 1.2697 51.948   18.667  77.490    26.243  25.791    26.557  8.0528 1.6836 4.9211 1.9011 3.131686       2.539428  
1 1 1 20 7  2  o 6.4599 1.3207 52.674   18.157  58.047    24.924  46.598    26.505  6.8508 1.7968 6.0690 1.9361 0.7817574      2.641405  
1 1 1 20 7  3  o 4.3311 1.2682 14.359   17.949  13.326    26.019  15.296    24.792  4.3150 1.8035 4.3473 1.7833 -0.3230667E-01 2.536315  
1 1 1 20 7  4  f 4.3020 1.2602 13.693   17.719  11.153    24.344  16.556    25.839  4.1500 1.7403 4.4540 1.8230 -0.3040380     2.520326  
1 1 1 20 7  5  f 4.6078 1.2797 20.364   17.413  14.294    24.883  26.189    24.377  4.3229 1.7815 4.8928 1.8377 -0.5698495     2.559452  
1 1 1 20 7  6  o 8.1251 1.2344 79.568   19.446  85.582    28.376  74.243    26.700  8.4256 1.7415 7.8246 1.7500 0.6009955      2.468892  
1 1 1 20 7  7  o 5.1434 1.4536 27.492   22.923  36.664    26.933  3.3803    43.668  5.5155 1.9526 4.7713 2.1539 0.7442317      2.907181  
1 1 1 20 7  8  o 10.068 0.9992 111.959  20.090  104.063   27.924  120.429   28.924  9.6804 1.4423 10.456 1.3832 -0.7752552     1.998368  
1 1 1 20 7  9  o 4.7638 1.3226 21.199   18.661  13.489    26.551  28.726    26.233  4.4074 1.8303 5.1203 1.9097 -0.7129459     2.645168  
1 1 1 20 7  10 o 5.9158 1.4112 43.043   19.765  45.759    28.973  40.678    27.031  6.0567 2.0301 5.7749 1.9608 0.2818422      2.822366  
1 1 1 20 7  11 o 11.934 0.9569 157.699  22.709  137.988   31.648  178.615   32.603  11.101 1.4254 12.766 1.2770 -1.664387      1.913759  
1 1 1 20 7  12 o 13.986 0.8854 215.362  24.163  168.418   34.692  259.596   33.675  12.340 1.4057 15.633 1.0771 -3.292928      1.770897  
1 1 1 20 7  13 o 4.9464 1.3020 20.909   18.988  -1.8742   26.713  44.177    26.996  3.8595 1.7178 6.0332 1.9570 -2.173730      2.603975  
1 1 1 20 7  14 o 5.1141 1.3920 27.122   20.055  30.762    29.448  23.972    27.388  5.3046 2.0136 4.9236 1.9226 0.3810139      2.784079  
1 1 1 20 7  15 o 5.2905 1.4507 26.911   17.645  39.102    43.784  24.548    19.280  5.8669 2.3840 4.7141 1.6536 1.152824       2.901322  
1 1 1 20 7  16 o 5.1302 1.4588 12.819   18.833  58.648    43.450  2.2173    20.899  6.6515 2.4623 3.6089 1.5650 3.042627       2.917513  
1 1 1 20 7  17 o 10.714 1.1866 109.593  21.218  191.099   49.138  90.912    23.525  12.365 1.9870 9.0638 1.2977 3.300856       2.373245  
1 1 1 20 7  18 o 6.1127 1.2928 55.390   19.611  -3.3255   46.225  68.277    21.656  4.5917 2.1258 7.6338 1.4718 -3.042035      2.585584  
1 1 1 20 7  19 f 6.2186 1.5659 41.516   19.924  93.799    47.173  30.164    21.981  7.4936 2.5889 4.9436 1.7625 2.549980       3.131875  
1 1 1 20 7  20 o 5.3282 1.4452 40.014   19.754  44.027    43.134  38.949    22.221  5.3297 2.2789 5.3266 1.7779 0.3120899E-02  2.890372  
1 1 1 20 7  21 o 5.9196 1.4892 54.268   20.003  66.850    47.450  51.549    22.059  5.7623 2.4237 6.0768 1.7312 -0.3145642     2.978474  
1 1 1 20 7  22 o 3.4311 1.1417 -3.7080  20.256  -45.1761  42.108  8.7770    23.105  3.2870 1.6350 3.5751 1.5939 -0.2881746     2.283345  
1 1 1 20 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  0  o 3.8197 1.6490 16.644   24.777  35.781    36.023  -0.5380   34.133  4.5097 2.5648 3.1297 2.0735 -0.000000      0.000000  
1 1 1 20 8  1  o 8.5788 1.2091 88.884   20.229  112.759   28.410  64.333    28.810  10.044 1.4142 7.1131 1.9616 2.931209       2.418245  
1 1 1 20 8  2  o 3.7630 1.1583 -5.3269  17.842  19.196    25.106  -30.3465  25.359  4.5570 1.8215 2.9689 1.4314 1.588114       2.316604  
1 1 1 20 8  3  o 7.2106 1.3344 65.236   19.487  62.050    27.813  68.308    27.311  7.0027 1.9258 7.4185 1.8477 -0.4158397     2.668843  
1 1 1 20 8  4  o 4.6651 1.3173 19.226   18.854  9.4420    25.992  30.091    27.390  4.1722 1.7761 5.1581 1.9458 -0.9859147     2.634522  
1 1 1 20 8  5  o 5.2676 1.3430 32.016   18.105  29.927    25.158  34.260    26.076  5.1406 1.8784 5.3947 1.9200 -0.2540703     2.686072  
1 1 1 20 8  6  o 7.6940 1.1829 70.312   19.148  112.167   27.648  31.733    26.544  10.102 1.3685 5.2864 1.9298 4.815278       2.365811  
1 1 1 20 8  7  o 6.6826 1.3321 55.487   19.536  35.652    28.267  73.623    27.029  5.5212 1.9952 7.8439 1.7655 -2.322663      2.664166  
1 1 1 20 8  8  o 3.5088 1.1244 -6.5585  17.020  -7.4822   23.843  -5.5988   24.304  3.4621 1.5743 3.5556 1.6058 -0.9346819E-01 2.248755  
1 1 1 20 8  9  o 6.8800 1.3701 59.259   19.679  66.268    28.728  53.063    27.012  7.2612 1.9409 6.4988 1.9345 0.7623987      2.740295  
1 1 1 20 8  10 o 6.6230 1.4013 55.763   20.028  60.942    28.962  51.018    27.725  6.9069 1.9888 6.3391 1.9747 0.5678921      2.802613  
1 1 1 20 8  11 o 4.1726 1.1781 -3.3311  18.237  36.423    25.947  -42.1435  25.638  5.5561 1.9200 2.7891 1.3658 2.767035       2.356234  
1 1 1 20 8  12 f 5.9614 1.3827 41.521   20.038  60.910    28.912  23.601    27.796  6.9994 1.9778 4.9235 1.9328 2.075840       2.765442  
1 1 1 20 8  13 o 10.162 1.1518 119.031  22.629  105.565   32.662  131.462   31.382  9.4256 1.7982 10.899 1.4397 -1.472992      2.303578  
1 1 1 20 8  14 o 7.9076 1.3661 76.535   21.698  99.189    32.269  57.840    29.313  9.0564 1.8442 6.7588 2.0160 2.297633       2.732278  
1 1 1 20 8  15 o 5.6683 1.3135 27.745   21.031  73.232    31.052  -10.8027  28.586  7.6429 2.0061 3.6937 1.6962 3.949266       2.627029  
1 1 1 20 8  16 f 6.2982 1.2555 45.243   21.103  -3.0917   30.297  90.788    29.410  3.9566 1.7894 8.6398 1.7618 -4.683181      2.511090  
1 1 1 20 8  17 o 7.5283 1.5183 61.007   20.077  115.985   46.046  48.102    22.309  8.8429 2.4950 6.2136 1.7309 2.629324       3.036639  
1 1 1 20 8  18 o 4.3123 1.2869 14.839   19.089  -34.2811  46.095  25.008    20.972  3.9800 1.9216 4.6447 1.7124 -0.6647184     2.573830  
1 1 1 20 8  19 o 4.0488 1.3271 -2.7995  19.155  27.056    45.391  -9.2680   21.128  5.0224 2.2370 3.0753 1.4284 1.947068       2.654136  
1 1 1 20 8  20 o 6.7812 1.4925 73.720   21.101  78.248    49.168  72.698    23.361  6.1156 2.5103 7.4469 1.6150 -1.331240      2.984966  
1 1 1 20 8  21 o 4.4621 1.2028 27.683   19.043  -46.9372  43.934  44.945    21.131  3.3780 1.6786 5.5462 1.7233 -2.168179      2.405676  
1 1 1 20 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 8  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 9  0  o 3.4665 1.5655 10.124   23.687  9.7777    38.119  10.342    30.233  3.5885 2.3098 3.3446 2.1138 -0.000000      0.000000  
1 1 1 20 9  1  o 4.1538 1.2526 7.3652   18.476  0.4506    25.721  14.736    26.556  3.8534 1.7017 4.4542 1.8385 -0.6007648     2.505176  
1 1 1 20 9  2  o 7.2534 1.2884 64.488   19.418  42.262    27.366  87.025    27.557  5.8811 1.9730 8.6257 1.6576 -2.744606      2.576849  
1 1 1 20 9  3  o 5.0751 1.3494 27.602   18.663  23.417    26.202  31.913    26.590  4.8503 1.8843 5.2998 1.9320 -0.4494677     2.698720  
1 1 1 20 9  4  o 5.4598 1.2932 30.605   18.893  4.0720    26.376  58.565    27.075  4.0286 1.7526 6.8911 1.9022 -2.862470      2.586437  
1 1 1 20 9  5  o 7.8165 1.2074 73.588   19.421  39.751    27.345  108.028   27.588  5.7374 1.9717 9.8957 1.3940 -4.158305      2.414713  
1 1 1 20 9  6  o 4.7835 1.3167 21.390   18.659  9.7505    26.677  32.538    26.108  4.2526 1.8045 5.3143 1.9179 -1.061706      2.633334  
1 1 1 20 9  7  o 11.428 0.9427 143.561  21.503  155.519   30.859  132.277   29.979  11.920 1.2945 10.936 1.3707 0.9838409      1.885313  
1 1 1 20 9  8  o 4.9296 1.3313 25.648   18.573  17.215    26.456  33.842    26.079  4.5191 1.8466 5.3401 1.9181 -0.8210497     2.662513  
1 1 1 20 9  9  o 3.8591 1.2099 -2.3427  18.586  10.046    28.193  -11.8657  24.718  4.3315 1.8470 3.3868 1.5632 0.9447787      2.419718  
1 1 1 20 9  10 o 9.4300 1.1721 101.140  21.470  120.402   31.649  84.719    29.222  10.400 1.5215 8.4597 1.7833 1.940607       2.344209  
1 1 1 20 9  11 o 5.4650 1.3905 33.579   19.505  44.253    29.162  24.939    26.237  5.9995 2.0366 4.9305 1.8937 1.068966       2.780945  
1 1 1 20 9  12 o 7.0045 1.3577 59.140   20.279  82.901    30.100  39.393    27.441  8.2753 1.8635 5.7336 1.9749 2.541674       2.715310  
1 1 1 20 9  13 o 9.4746 1.2531 107.441  22.953  95.184    33.983  117.723   31.127  8.7315 1.9903 10.218 1.5232 -1.486150      2.506243  
1 1 1 20 9  14 o 6.1465 1.4677 46.878   21.319  48.258    32.135  45.794    28.491  6.2039 2.1371 6.0891 2.0123 0.1147656      2.935396  
1 1 1 20 9  15 o 4.7884 1.3823 21.395   21.042  15.680    31.627  25.934    28.185  4.6319 1.9651 4.9450 1.9447 -0.3131013     2.764663  
1 1 1 20 9  16 o 4.3575 1.2805 3.8201   21.640  -39.0197  32.778  36.916    28.811  3.2774 1.5914 5.4376 2.0066 -2.160165      2.561016  
1 1 1 20 9  17 o 4.1952 1.2944 6.4778   21.204  -10.0277  31.057  20.890    29.021  3.7425 1.7361 4.6478 1.9204 -0.9052329     2.588872  
1 1 1 20 9  18 o 5.0276 1.3608 19.094   22.143  65.878    33.634  -16.6942  29.417  6.6285 2.1862 3.4268 1.6211 3.201716       2.721653  
1 1 1 20 9  19 o 8.8733 1.4297 120.562  22.154  113.634   46.889  122.553   25.136  7.5179 2.5820 10.229 1.2287 -2.710845      2.859458  
1 1 1 20 9  20 o 4.1147 1.3183 14.794   19.633  16.371    47.640  14.472    21.547  4.4108 2.0794 3.8187 1.6211 0.5921147      2.636657  
1 1 1 20 9  21 o 4.4581 1.2766 32.507   20.176  -15.2638  47.377  43.089    22.299  3.7223 1.8296 5.1940 1.7808 -1.471661      2.553174  
1 1 1 20 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 0  o 14.395 1.2377 232.022  34.154  230.125   49.548  233.739   47.144  14.283 1.8143 14.508 1.6839 -0.000000      0.000000  
1 1 1 20 10 1  o 4.7019 1.2979 19.228   18.105  32.978    26.663  7.4640    24.663  5.3488 1.9369 4.0550 1.7282 1.293822       2.595880  
1 1 1 20 10 2  o 11.140 0.9674 136.576  21.548  133.639   30.140  139.648   30.820  11.017 1.3678 11.262 1.3683 -0.2446060     1.934751  
1 1 1 20 10 3  o 8.1300 1.2748 80.713   21.025  52.947    29.812  108.190   29.656  6.4549 2.0527 9.8051 1.5123 -3.350253      2.549640  
1 1 1 20 10 4  o 8.4177 1.2422 85.175   20.239  78.824    28.730  91.430    28.515  8.0385 1.8283 8.7969 1.6820 -0.7584352     2.484341  
1 1 1 20 10 5  o 7.4753 1.3145 69.295   19.572  69.507    27.586  69.079    27.772  7.4931 1.8515 7.4575 1.8664 0.3562689E-01  2.629012  
1 1 1 20 10 6  o 7.8991 1.3073 77.060   20.442  91.854    29.298  63.025    28.537  8.7511 1.7352 7.0470 1.9557 1.704083       2.614560  
1 1 1 20 10 7  o 4.3265 1.1354 -14.2589 18.305  49.710    26.901  -69.4203  24.980  6.3131 1.9416 2.3399 1.1775 3.973158       2.270747  
1 1 1 20 10 8  f 7.0587 1.3933 62.182   20.628  53.059    30.662  69.724    27.880  6.5167 2.0828 7.6008 1.8512 -1.084126      2.786562  
1 1 1 20 10 9  o 4.7529 1.3122 19.929   18.828  5.5677    27.437  32.712    25.884  4.1556 1.7976 5.3501 1.9120 -1.194532      2.624348  
1 1 1 20 10 10 o 5.8564 1.3946 39.013   20.567  61.478    29.960  18.992    28.284  6.9894 2.0257 4.7233 1.9173 2.266072       2.789178  
1 1 1 20 10 11 f 6.1460 1.3195 43.079   21.264  3.4094    31.002  78.324    29.222  4.2606 1.8755 8.0314 1.8564 -3.770780      2.638910  
1 1 1 20 10 12 o 4.0008 1.2634 -0.9204  20.568  1.3400    30.148  -2.8886   28.133  4.1245 1.8308 3.8772 1.7415 0.2472522      2.526766  
1 1 1 20 10 13 o 4.9054 1.2398 12.729   20.369  -39.6588  30.662  54.108    27.250  3.1967 1.5491 6.6142 1.9363 -3.417583      2.479679  
1 1 1 20 10 14 o 4.7661 1.3987 19.580   21.845  25.838    32.514  14.430    29.495  5.0382 2.0516 4.4940 1.9016 0.5442371      2.797362  
1 1 1 20 10 15 o 5.6079 1.3771 34.752   22.470  -3.4593   32.731  68.809    30.901  4.0365 1.8389 7.1792 2.0503 -3.142772      2.754200  
1 1 1 20 10 16 o 6.8783 1.5583 66.403   24.498  82.788    36.373  52.799    33.143  7.6089 2.2398 6.1476 2.1671 1.461330       3.116551  
1 1 1 20 10 17 o 6.2193 1.4600 56.450   24.010  23.829    36.540  81.238    31.852  4.8287 2.0816 7.6098 2.0478 -2.781167      2.920044  
1 1 1 20 10 18 o 5.2769 1.4640 42.567   23.015  63.326    34.542  25.993    30.864  6.0318 2.2015 4.5221 1.9305 1.509769       2.928041  
1 1 1 20 10 19 o 5.6675 1.5390 56.954   24.417  61.106    36.447  53.574    32.888  5.7677 2.2274 5.5673 2.1244 0.2004814      3.078096  
1 1 1 20 10 20 o 4.3910 1.3646 29.248   22.934  31.412    35.586  27.712    29.993  4.4525 1.9821 4.3294 1.8761 0.1231346      2.729200  
1 1 1 20 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 10 27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 0  o 15.471 1.1872 266.853  35.424  260.176   52.327  272.503   48.129  15.187 1.7878 15.756 1.5626 -0.000000      0.000000  
1 1 1 20 11 1  f 4.6585 1.1322 2.4794   17.862  55.817    25.726  -47.1714  24.821  6.6934 1.8566 2.6236 1.2961 4.069852       2.264315  
1 1 1 20 11 2  o 5.0267 1.3567 27.598   18.977  26.178    27.489  28.891    26.230  4.9726 1.9305 5.0808 1.9067 -0.1082010     2.713368  
1 1 1 20 11 3  o 5.7414 1.4122 40.558   19.866  41.173    28.114  39.945    28.075  5.7756 1.9984 5.7073 1.9958 0.6831074E-01  2.824325  
1 1 1 20 11 4  o 3.3713 1.1047 -15.7642 18.052  -28.7038  25.746  -3.2513   25.318  3.0469 1.4621 3.6957 1.6565 -0.6487529     2.209477  
1 1 1 20 11 5  o 4.9768 1.2683 21.079   18.961  -10.1941  27.766  48.403    25.954  3.6641 1.6786 6.2895 1.9017 -2.625387      2.536554  
1 1 1 20 11 6  o 4.1562 1.2556 7.0699   18.508  8.9960    25.787  5.0238    26.578  4.2115 1.7799 4.1010 1.7716 0.1104898      2.511284  
1 1 1 20 11 7  o 6.3804 1.4410 50.763   20.750  50.977    29.902  50.565    28.817  6.3850 2.0585 6.3758 2.0172 0.9239674E-02  2.882084  
1 1 1 20 11 8  o 8.9669 1.2963 96.233   22.455  108.326   32.673  85.408    30.912  9.5611 1.7739 8.3728 1.8907 1.188371       2.592606  
1 1 1 20 11 9  o 12.946 0.9084 181.766  23.509  188.553   33.833  175.431   32.690  13.181 1.2835 12.712 1.2858 0.4687614      1.816749  
1 1 1 20 11 10 o 8.4267 1.3148 86.556   21.582  93.442    30.634  79.770    30.411  8.8196 1.7977 8.0338 1.9190 0.7858477      2.629503  
1 1 1 20 11 11 o 7.1455 1.4178 65.916   22.149  43.802    32.505  85.084    30.262  5.9405 2.1406 8.3504 1.8597 -2.409942      2.835569  
1 1 1 20 11 12 o 11.473 1.0550 147.045  24.157  154.234   35.610  140.917   32.878  11.708 1.5207 11.238 1.4628 0.4700909      2.110071  
1 1 1 20 11 13 o 5.3622 1.3824 27.690   21.838  61.970    31.825  -2.8119   30.020  6.7904 2.1157 3.9341 1.7800 2.856307       2.764875  
1 1 1 20 11 14 o 5.9796 1.4786 45.024   23.537  71.230    33.697  20.056    32.891  7.1836 2.1657 4.7755 2.0137 2.408093       2.957273  
1 1 1 20 11 15 o 4.7725 1.3902 18.672   23.498  -11.3358  35.709  41.591    31.207  3.9439 1.8403 5.6012 2.0841 -1.657359      2.780303  
1 1 1 20 11 16 o 4.9028 1.3782 23.177   23.691  -18.9561  36.883  52.769    30.911  3.7658 1.7913 6.0398 2.0951 -2.274088      2.756496  
1 1 1 20 11 17 o 5.0003 1.4260 34.086   22.906  60.420    34.274  12.831    30.792  5.9120 2.1872 4.0886 1.8302 1.823373       2.851901  
1 1 1 20 11 18 o 5.4630 1.3977 46.577   24.060  1.3396    37.647  77.810    31.282  3.9661 1.8631 6.9599 2.0841 -2.993794      2.795454  
1 1 1 20 11 19 o 3.7718 1.2369 4.9105   23.010  -14.9227  35.136  19.805    30.449  3.4402 1.6650 4.1035 1.8296 -0.6633618     2.473763  
1 1 1 20 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 11 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 0  f 2.8190 1.3703 -18.6407 25.366  -38.2445  41.396  -6.8547   32.097  2.7262 1.9209 2.9118 1.9547 -0.000000      0.000000  
1 1 1 20 12 1  o 5.5187 1.3099 29.517   19.231  60.684    28.483  3.4058    26.071  7.0267 1.9552 4.0106 1.7436 3.016099       2.619715  
1 1 1 20 12 2  o 6.7189 1.3741 54.793   19.844  68.921    28.873  42.144    27.318  7.5183 1.9149 5.9196 1.9711 1.598718       2.748104  
1 1 1 20 12 3  o 7.3299 1.2562 65.633   20.117  32.679    29.273  95.125    27.692  5.4117 2.0175 9.2480 1.4972 -3.836259      2.512379  
1 1 1 20 12 4  o 5.6550 1.3287 35.332   19.628  9.6752    28.061  59.910    27.465  4.3360 1.8456 6.9739 1.9120 -2.637992      2.657449  
1 1 1 20 12 5  o 11.515 1.0036 146.736  23.085  142.989   33.139  150.269   32.177  11.339 1.4613 11.691 1.3761 -0.3519192     2.007252  
1 1 1 20 12 6  o 5.4410 1.3675 32.637   19.708  15.900    28.017  49.031    27.729  4.5848 1.8900 6.2973 1.9770 -1.712438      2.735021  
1 1 1 20 12 7  f 6.4717 1.4095 52.284   20.075  49.325    28.909  55.039    27.898  6.2910 2.0236 6.6524 1.9625 -0.3614473     2.818923  
1 1 1 20 12 8  o 6.2072 1.4116 47.754   21.465  24.739    31.455  67.812    29.365  5.0535 2.0322 7.3608 1.9599 -2.307289      2.823242  
1 1 1 20 12 9  o 4.5031 1.3011 7.7979   20.309  36.579    29.722  -17.4083  27.815  5.5528 2.0398 3.4534 1.6156 2.099423       2.602116  
1 1 1 20 12 10 o 7.0247 1.4848 62.698   22.393  65.761    33.312  60.173    30.246  7.1440 2.1532 6.9054 2.0451 0.2386365      2.969643  
1 1 1 20 12 11 o 16.648 0.8343 300.581  27.766  310.276   39.292  290.910   39.241  16.938 1.1599 16.358 1.1995 0.5797901      1.668549  
1 1 1 20 12 12 o 7.4422 1.4766 73.639   22.778  79.391    34.110  69.009    30.601  7.6578 2.1428 7.2265 2.0322 0.4312348      2.953207  
1 1 1 20 12 13 o 5.2247 1.4721 28.090   23.777  50.752    35.730  10.080    31.853  6.0650 2.2352 4.3843 1.9162 1.680686       2.944146  
1 1 1 20 12 14 o 6.9578 1.4948 63.039   24.993  110.801   38.427  28.021    32.903  8.9204 2.1738 4.9952 2.0523 3.925214       2.989546  
1 1 1 20 12 15 o 5.9706 1.4783 48.826   24.324  81.321    34.708  17.463    34.098  7.3933 2.1910 4.5479 1.9853 2.845362       2.956652  
1 1 1 20 12 16 f 4.2616 1.3231 14.814   23.451  -14.8551  36.746  35.201    30.460  3.6472 1.7492 4.8760 1.9857 -1.228816      2.646242  
1 1 1 20 12 17 o 5.0851 1.3697 10.795   24.504  95.121    38.382  -47.2226  31.837  7.2696 2.3310 2.9005 1.4392 4.369088       2.739480  
1 1 1 20 12 18 o 6.6500 1.4673 75.947   24.231  121.113   36.314  39.699    32.532  8.5064 2.1372 4.7935 2.0110 3.712862       2.934608  
1 1 1 20 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 12 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 0  o 7.3700 1.8724 88.569   29.710  49.331    46.512  115.613   38.614  5.1888 2.9289 9.5512 2.3335 -0.000000      0.000000  
1 1 1 20 13 1  o 9.1966 1.1888 99.301   20.982  126.122   29.709  72.611    29.637  10.713 1.3866 7.6806 1.9313 3.031969       2.377533  
1 1 1 20 13 2  o 12.634 0.9207 173.534  23.259  168.317   32.674  178.893   33.116  12.433 1.3140 12.836 1.2899 -0.4037037     1.841366  
1 1 1 20 13 3  o 12.886 0.8958 179.951  23.076  176.262   32.907  183.520   32.367  12.737 1.2918 13.036 1.2415 -0.2993250     1.791680  
1 1 1 20 13 4  o 5.1008 1.3815 26.655   19.693  35.319    29.676  19.837    26.324  5.5207 2.0366 4.6810 1.8671 0.8396602      2.762982  
1 1 1 20 13 5  o 14.455 0.8707 228.736  24.793  200.316   36.578  252.890   33.721  13.499 1.3548 15.411 1.0940 -1.912434      1.741396  
1 1 1 20 13 6  o 4.4903 1.2636 7.3165   20.258  -31.6111  30.163  39.304    27.343  3.2972 1.5823 5.6835 1.9706 -2.386298      2.527193  
1 1 1 20 13 7  o 6.4856 1.4499 53.744   21.162  48.479    31.879  57.892    28.296  6.1846 2.1287 6.7866 1.9692 -0.6020508     2.899820  
1 1 1 20 13 8  o 14.666 0.8799 232.402  25.689  260.952   36.830  205.348   35.851  15.598 1.1806 13.734 1.3051 1.864058       1.759865  
1 1 1 20 13 9  o 6.0153 1.4342 45.380   21.593  26.716    31.281  62.369    29.844  5.0813 2.0325 6.9493 2.0240 -1.867973      2.868382  
1 1 1 20 13 10 o 3.8514 1.2364 -9.1325  21.165  11.494    31.113  -26.9010  28.877  4.4364 1.9167 3.2663 1.5623 1.170105       2.472733  
1 1 1 20 13 11 o 6.9902 1.5086 68.063   23.770  52.273    35.659  80.689    31.887  6.1582 2.2385 7.8221 2.0231 -1.663933      3.017244  
1 1 1 20 13 12 o 18.156 0.8742 365.660  31.653  363.459   46.370  367.581   43.314  18.032 1.2858 18.280 1.1847 -0.2479630     1.748374  
1 1 1 20 13 13 o 5.9902 1.5350 49.577   24.816  74.049    36.305  28.113    34.000  7.0114 2.2690 4.9689 2.0680 2.042480       3.070018  
1 1 1 20 13 14 o 4.5199 1.3882 18.102   23.529  28.259    33.671  8.4086    32.893  4.8509 2.0411 4.1890 1.8822 0.6618357      2.776422  
1 1 1 20 13 15 o 4.4708 1.3963 20.907   24.261  33.688    37.215  11.459    31.995  4.8473 2.0952 4.0944 1.8464 0.7528853      2.792661  
1 1 1 20 13 16 o 6.5423 1.6161 78.634   25.946  81.577    39.346  76.369    34.513  6.5027 2.3532 6.5819 2.2156 -0.7929373E-01 3.232153  
1 1 1 20 13 17 o 3.7317 1.2350 3.3610   22.538  14.694    35.207  -4.5077   29.336  4.0377 1.8644 3.4256 1.6201 0.6120710      2.469913  
1 1 1 20 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 13 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 0  o 5.3728 2.0258 51.153   30.852  73.029    45.114  31.933    42.286  6.3237 3.0599 4.4219 2.6556 -0.000000      0.000000  
1 1 1 20 14 1  o 6.4851 1.4806 54.149   22.257  64.141    30.924  43.410    32.058  7.0632 2.0612 5.9070 2.1261 1.156181       2.961204  
1 1 1 20 14 2  o 9.5862 1.2430 109.081  23.203  96.491    32.936  121.487   32.695  8.8490 1.9165 10.323 1.5835 -1.474389      2.486032  
1 1 1 20 14 3  o 3.8897 1.2357 -3.3071  20.112  -8.0452   29.127  1.0104    27.804  3.7903 1.7299 3.9891 1.7651 -0.1987441     2.471415  
1 1 1 20 14 4  o 8.4241 1.3154 86.868   22.552  54.668    31.719  119.785   32.070  6.5446 2.1212 10.304 1.5563 -3.758948      2.630859  
1 1 1 20 14 5  o 4.6190 1.3353 15.969   19.659  25.322    29.163  8.1778    26.616  5.0362 1.9789 4.2018 1.7932 0.8344288      2.670522  
1 1 1 20 14 6  o 2.9574 1.0218 -45.9078 19.639  -23.7255  29.194  -64.2414  26.541  3.3972 1.6094 2.5176 1.2594 0.8795869      2.043620  
1 1 1 20 14 7  o 6.8976 1.3139 53.484   22.565  111.617   33.916  7.3135    30.226  9.5185 1.8482 4.2766 1.8679 5.241884       2.627756  
1 1 1 20 14 8  o 4.4439 1.3357 8.9463   22.239  -16.2040  32.879  30.154    30.192  3.7418 1.7524 5.1460 2.0161 -1.404238      2.671303  
1 1 1 20 14 9  o 4.9493 1.4504 23.892   23.439  29.800    34.812  18.993    31.702  5.1939 2.1198 4.7048 1.9801 0.4890747      2.900773  
1 1 1 20 14 10 o 14.319 1.0093 236.745  28.442  207.111   41.824  262.241   38.794  13.282 1.5745 15.357 1.2631 -2.074810      2.018536  
1 1 1 20 14 11 o 6.3657 1.5513 57.891   24.112  68.940    35.119  48.037    33.165  6.8676 2.2324 5.8638 2.1546 1.003808       3.102573  
1 1 1 20 14 12 o 5.9470 1.5353 49.838   25.198  75.564    36.385  26.129    34.930  7.0209 2.2715 4.8732 2.0662 2.147631       3.070612  
1 1 1 20 14 13 o 5.4110 1.4369 32.549   24.780  88.356    37.577  -10.3947  32.963  7.1985 2.3062 3.6234 1.7148 3.575053       2.873878  
1 1 1 20 14 14 o 5.4053 1.5139 43.261   24.710  73.345    38.681  22.520    32.118  6.3562 2.3282 4.4545 1.9359 1.901721       3.027888  
1 1 1 20 14 15 o 3.9651 1.2868 9.0043   23.144  15.249    34.096  3.6686    31.518  4.1485 1.8849 3.7817 1.7524 0.3668008      2.573677  
1 1 1 20 14 16 o 5.4325 1.4524 49.611   24.895  95.811    36.592  9.8006    33.967  6.9977 2.2789 3.8672 1.8012 3.130555       2.904809  
1 1 1 20 14 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 14 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 0  o 5.9019 2.1406 65.209   32.437  77.875    47.228  53.900    44.627  6.4764 3.1312 5.3273 2.9198 -0.000000      0.000000  
1 1 1 20 15 1  o 5.9872 1.4765 44.507   22.618  27.622    31.996  61.373    31.978  5.1428 2.0561 6.8317 2.1195 -1.688894      2.952918  
1 1 1 20 15 2  o 8.3888 1.3252 88.730   22.406  63.905    32.485  111.257   30.945  6.9374 2.1336 9.8401 1.5724 -2.902632      2.650411  
1 1 1 20 15 3  o 8.9007 1.3727 100.147  23.770  108.679   33.458  91.452    33.777  9.3873 1.8479 8.4141 2.0305 0.9731874      2.745420  
1 1 1 20 15 4  o 6.1661 1.5169 50.745   23.169  42.993    33.822  57.600    31.804  5.7834 2.1661 6.5489 2.1242 -0.7654839     3.033863  
1 1 1 20 15 5  o 6.2344 1.4741 52.044   21.723  46.665    33.372  55.999    28.615  5.9398 2.1645 6.5290 2.0016 -0.5892496     2.948118  
1 1 1 20 15 6  o 5.3182 1.3831 33.035   20.992  10.476    31.433  51.197    28.203  4.3982 1.9133 6.2382 1.9979 -1.839931      2.766298  
1 1 1 20 15 7  o 4.3699 1.3269 7.8202   22.138  -15.3808  32.402  28.134    30.319  3.7143 1.7396 5.0255 2.0040 -1.311260      2.653718  
1 1 1 20 15 8  o 7.7880 1.4176 80.800   24.287  123.519   35.325  42.501    33.448  9.9059 1.8511 5.6700 2.1475 4.235868       2.835184  
1 1 1 20 15 9  o 5.4758 1.5131 39.594   24.105  34.863    34.846  43.936    33.380  5.2848 2.1340 5.6669 2.1456 -0.3821311     3.026168  
1 1 1 20 15 10 f 5.3630 1.5009 38.731   24.192  29.700    35.045  46.952    33.436  5.0108 2.0936 5.7152 2.1512 -0.7044182     3.001821  
1 1 1 20 15 11 o 4.8646 1.4575 28.490   24.542  41.156    36.792  18.336    32.942  5.2802 2.1699 4.4491 1.9465 0.8310618      2.915020  
1 1 1 20 15 12 o 3.8169 1.2658 -2.5997  24.299  -0.7783   36.049  -4.1162   32.894  3.9097 1.8323 3.7241 1.7469 0.1856055      2.531583  
1 1 1 20 15 13 o 4.1553 1.3260 13.051   23.394  21.778    34.129  5.3175    32.129  4.4089 1.9530 3.9016 1.7941 0.5073216      2.651932  
1 1 1 20 15 14 o 5.7136 1.5162 60.552   24.352  45.402    35.564  73.926    33.414  5.0404 2.1078 6.3868 2.1799 -1.346330      3.032324  
1 1 1 20 15 15 o 3.9400 1.2800 13.029   23.786  -5.7781   35.179  28.868    32.283  3.5514 1.7054 4.3286 1.9093 -0.7771831     2.560043  
1 1 1 20 15 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 15 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 0  o 6.3719 2.1144 76.409   31.367  63.835    48.014  85.771    41.430  5.6123 3.0444 7.1315 2.9350 -0.000000      0.000000  
1 1 1 20 16 1  o 11.910 1.0304 161.227  24.463  177.487   36.370  147.792   33.060  12.452 1.4604 11.369 1.4539 1.082918       2.060778  
1 1 1 20 16 2  o 3.8707 1.2430 -3.4179  20.957  -6.4448   30.421  -0.6836   28.913  3.8291 1.7552 3.9122 1.7606 -0.8303404E-01 2.486027  
1 1 1 20 16 3  o 9.9125 1.2569 120.179  24.385  112.107   33.772  128.973   35.248  9.4526 1.8526 10.372 1.6991 -0.9196119     2.513798  
1 1 1 20 16 4  o 6.3993 1.3553 55.322   27.973  100.834   32.842  -64.9359  53.386  8.8835 1.9056 3.9151 1.9278 4.968398       2.710692  
1 1 1 20 16 5  o 7.8274 1.5002 84.071   24.188  93.846    34.576  74.703    33.848  8.3447 2.0793 7.3100 2.1631 1.034692       3.000416  
1 1 1 20 16 6  o 8.8219 1.4332 104.700  24.910  88.739    35.318  120.497   35.137  7.9491 2.1636 9.6947 1.8800 -1.745644      2.866305  
1 1 1 20 16 7  o 6.4369 1.4746 56.509   22.899  85.879    34.370  33.065    30.707  7.7539 2.1443 5.1200 2.0246 2.633864       2.949104  
1 1 1 20 16 8  o 5.0530 1.4883 31.222   24.800  32.956    37.417  29.863    33.120  5.1351 2.1557 4.9710 2.0526 0.1641574      2.976573  
1 1 1 20 16 9  o 4.0554 1.3048 2.2308   24.245  -21.8478  36.210  21.796    32.641  3.5843 1.7236 4.5264 1.9593 -0.9421544     2.609545  
1 1 1 20 16 10 o 3.8808 1.2772 -3.2352  24.093  20.591    36.332  -21.9351  32.188  4.4336 1.9861 3.3280 1.6065 1.105645       2.554479  
1 1 1 20 16 11 o 4.3312 1.3284 8.1441   23.145  49.562    34.594  -25.4199  31.142  5.4417 2.1499 3.2208 1.5609 2.220905       2.656753  
1 1 1 20 16 12 o 3.8675 1.2717 4.6761   23.772  4.1668    34.415  5.1408    32.876  3.8786 1.8087 3.8565 1.7880 0.2211380E-01  2.543315  
1 1 1 20 16 13 o 4.1390 1.3326 19.327   24.173  23.099    35.648  16.117    32.891  4.2494 1.9295 4.0286 1.8385 0.2207928      2.665112  
1 1 1 20 16 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 16 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 0  o 9.3521 2.1459 136.149  35.879  158.186   52.507  116.846   49.142  10.418 2.9122 8.2860 3.1525 -0.000000      0.000000  
1 1 1 20 17 1  o 13.643 1.0095 216.419  27.515  208.427   39.183  224.195   38.646  13.339 1.4687 13.947 1.3854 -0.6082287     2.019024  
1 1 1 20 17 2  o 5.5753 1.4320 36.125   24.400  -4.4964   35.137  73.957    33.910  4.0252 1.8600 7.1255 2.1780 -3.100298      2.864076  
1 1 1 20 17 3  o 3.6798 1.2152 -10.5254 21.871  -9.1143   33.356  -11.5896  28.968  3.8233 1.7822 3.5363 1.6526 0.2869573      2.430454  
1 1 1 20 17 4  o 8.0815 1.3643 85.147   24.814  147.641   37.861  38.089    32.854  10.844 1.7458 5.3193 2.0972 5.524411       2.728685  
1 1 1 20 17 5  o 5.7531 1.4745 41.919   24.208  80.447    36.147  10.585    32.598  7.2310 2.2551 4.2752 1.9005 2.955782       2.949095  
1 1 1 20 17 6  o 5.0547 1.4256 21.128   25.194  73.139    37.419  -22.0026  34.075  6.6132 2.3046 3.4962 1.6788 3.117041       2.851207  
1 1 1 20 17 7  o 3.9673 1.2935 -8.2223  24.719  35.255    37.306  -42.2504  33.004  4.8865 2.1050 3.0480 1.5037 1.838499       2.586905  
1 1 1 20 17 8  o 4.9642 1.4612 36.167   24.410  25.079    35.035  46.627    34.028  4.5758 2.0045 5.3527 2.1267 -0.7769933     2.922443  
1 1 1 20 17 9  o 8.9486 1.4044 124.410  26.264  76.383    37.915  168.713   36.416  6.4641 2.3137 11.433 1.5926 -4.968916      2.808806  
1 1 1 20 17 10 o 5.2223 1.5119 47.795   25.390  61.779    36.947  35.283    34.949  5.6943 2.2305 4.7504 2.0418 0.9438653      3.023877  
1 1 1 20 17 11 o 4.5689 1.3978 31.447   24.489  11.508    35.512  49.525    33.815  3.9874 1.8521 5.1505 2.0942 -1.163030      2.795690  
1 1 1 20 17 12 o 4.2872 1.3617 27.287   24.924  13.752    39.106  36.547    32.345  4.0038 1.8864 4.5706 1.9644 -0.5667973     2.723485  
1 1 1 20 17 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 17 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 0  o 3.8810 1.7129 -11.3707 30.929  76.142    48.058  -73.2470  40.410  5.6116 3.0452 2.1505 1.5692 -0.000000      0.000000  
1 1 1 20 18 1  o 7.0311 1.5087 80.723   24.529  105.610   34.636  55.684    34.743  8.3410 2.0826 5.7213 2.1834 2.619740       3.017410  
1 1 1 20 18 2  o 7.6139 1.5239 93.539   24.976  116.310   36.000  72.407    34.680  8.7434 2.0875 6.4843 2.2208 2.259108       3.047894  
1 1 1 20 18 3  o 9.1592 1.4543 126.002  26.003  132.059   36.768  119.940   36.780  9.4834 2.0014 8.8351 2.1104 0.6483088      2.908517  
1 1 1 20 18 4  o 5.1611 1.4779 41.916   23.881  35.388    34.335  48.035    33.239  4.9055 2.0624 5.4167 2.1173 -0.5112104     2.955738  
1 1 1 20 18 5  o 3.2266 1.1080 -28.3661 22.514  -18.7584  32.135  -37.6279  31.551  3.4023 1.6328 3.0509 1.4983 0.3514233      2.216042  
1 1 1 20 18 6  f 8.8960 1.3910 121.576  25.021  86.365    37.561  149.666   33.549  6.9619 2.3109 10.830 1.5489 -3.868159      2.781996  
1 1 1 20 18 7  o 11.248 1.1969 171.306  26.841  167.770   38.950  174.504   37.040  10.998 1.7707 11.497 1.6109 -0.4984579     2.393824  
1 1 1 20 18 8  o 5.5659 1.5518 59.164   25.418  61.110    36.821  57.393    35.132  5.6099 2.2175 5.5220 2.1713 0.8792448E-01  3.103516  
1 1 1 20 18 9  o 4.6885 1.3887 31.511   24.895  -7.5514   36.435  65.717    34.096  3.5986 1.7301 5.7784 2.1728 -2.179859      2.777454  
1 1 1 20 18 10 o 3.6729 1.2386 0.5879   24.987  -0.4011   39.301  1.2589    32.372  3.7446 1.7994 3.6012 1.7027 0.1434042      2.477292  
1 1 1 20 18 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 18 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 0  o 3.0294 1.4879 -10.9281 31.593  4.3448    45.530  -25.1092  43.873  3.2921 2.2436 2.7667 1.9550 -0.000000      0.000000  
1 1 1 20 19 1  o 3.2680 1.1196 -22.2931 22.392  -18.6587  33.687  -25.1699  29.972  3.4117 1.6461 3.1244 1.5181 0.2873311      2.239247  
1 1 1 20 19 2  o 4.1381 1.3329 13.546   24.516  3.8149    35.162  22.751    34.199  3.9050 1.8235 4.3713 1.9447 -0.4663424     2.665873  
1 1 1 20 19 3  o 4.0746 1.3133 13.049   23.825  4.6494    36.018  19.583    31.768  3.9294 1.8384 4.2199 1.8760 -0.2904031     2.626554  
1 1 1 20 19 4  o 3.9656 1.2894 10.215   23.497  4.3170    36.177  14.518    30.903  3.9034 1.8313 4.0278 1.8157 -0.1244445     2.578840  
1 1 1 20 19 5  o 4.2527 1.3503 17.182   24.293  44.358    36.533  -4.3602   32.526  4.9339 2.1031 3.5715 1.6940 1.362327       2.700510  
1 1 1 20 19 6  o 3.8569 1.2658 4.7469   24.750  -25.9845  37.006  29.618    33.291  3.3160 1.6273 4.3978 1.9394 -1.081833      2.531637  
1 1 1 20 19 7  o 5.2815 1.4975 57.136   25.602  36.303    38.163  74.183    34.523  4.5263 2.0310 6.0366 2.2013 -1.510265      2.995079  
1 1 1 20 19 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 19 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 0  o 5.0123 2.0247 57.122   33.639  121.588   55.199  19.034    42.428  6.6189 3.3506 3.4056 2.2740 -0.000000      0.000000  
1 1 1 20 20 1  o 5.1853 1.4730 53.034   23.308  54.930    34.196  51.388    31.853  5.2126 2.1108 5.1579 2.0550 0.5476046E-01  2.945933  
1 1 1 20 20 2  o 3.8611 1.2674 11.778   23.198  14.439    35.995  9.8882    30.340  3.9709 1.8511 3.7514 1.7316 0.2194812      2.534787  
1 1 1 20 20 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 20 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 21 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 22 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 23 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 24 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 20 25 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 1  0  o 14.624 0.9294 220.386  26.930  0.0000    0.0000  220.386   26.930  14.624 0.9294 14.624 0.9294 -0.000000      0.000000  
1 1 1 21 1  1  o 7.9378 0.9837 70.076   15.050  78.832    20.639  60.132    21.994  8.6110 1.1984 7.2646 1.5603 1.346450       1.967450  
1 1 1 21 1  2  o 4.7984 1.1235 24.536   13.456  10.783    19.868  36.191    18.290  3.9776 1.6096 5.6193 1.5679 -1.641725      2.247024  
1 1 1 21 1  3  o 4.9042 1.1086 26.623   12.707  34.667    17.482  17.611    18.503  5.5114 1.5312 4.2971 1.6036 1.214351       2.217212  
1 1 1 21 1  4  o 3.5934 1.1097 1.9480   14.192  -32.2825  32.912  9.7666    15.729  3.5267 1.6816 3.6601 1.4485 -0.1334398     2.219429  
1 1 1 21 1  5  o 6.7880 1.2678 59.531   16.913  32.721    37.264  66.487    18.981  5.6667 2.2337 7.9093 1.1999 -2.242625      2.535573  
1 1 1 21 1  6  f 15.243 0.8967 245.502  21.878  255.316   48.572  243.003   24.505  15.118 1.6064 15.368 0.7973 -0.2507124     1.793394  
1 1 1 21 1  7  o 4.3663 1.2923 12.042   15.944  15.251    35.592  11.236    17.833  4.8810 2.0781 3.8517 1.5366 1.029230       2.584533  
1 1 1 21 1  8  o 4.8227 1.1739 27.358   15.927  -31.7755  38.360  39.675    17.507  3.7991 1.8126 5.8464 1.4922 -2.047341      2.347794  
1 1 1 21 1  9  o 5.4704 1.3992 32.009   16.453  38.987    39.681  30.561    18.080  5.8085 2.3001 5.1324 1.5939 0.6760240      2.798378  
1 1 1 21 1  10 o 4.0814 1.2431 9.5474   15.932  -23.1362  42.162  14.992    17.208  4.1460 1.9551 4.0167 1.5358 0.1292801      2.486133  
1 1 1 21 1  11 o 15.784 0.9145 262.531  23.306  294.318   51.879  254.494   26.087  15.937 1.6276 15.630 0.8345 0.3071575      1.829089  
1 1 1 21 1  12 o 4.5930 1.2960 20.533   17.333  -10.5423  40.927  27.324    19.133  4.3170 1.9992 4.8690 1.6496 -0.5520072     2.591923  
1 1 1 21 1  13 o 8.4804 1.3961 94.881   18.798  75.826    47.038  98.503    20.507  7.3204 2.5816 9.6403 1.0636 -2.319856      2.792120  
1 1 1 21 1  14 f 8.3197 1.2631 110.358  19.758  26.359    44.329  131.183   22.072  5.4746 2.3247 11.165 0.9885 -5.690167      2.526162  
1 1 1 21 1  15 o 3.4477 1.1241 -7.9421  16.939  -66.3251  41.193  3.9393    18.583  3.4042 1.6796 3.4911 1.4943 -0.8693027E-01 2.248102  
1 1 1 21 1  16 o 7.8041 1.4194 73.827   19.729  75.308    43.916  73.453    22.083  7.4060 2.4993 8.2021 1.3462 -0.7960749     2.838755  
1 1 1 21 1  17 o 7.4104 1.1926 64.713   17.139  63.257    22.641  66.668    26.230  7.3776 1.5819 7.4432 1.7851 -0.6555319E-01 2.385128  
1 1 1 21 1  18 o 5.2975 1.2745 32.926   16.148  35.560    20.943  29.063    25.361  5.4816 1.7176 5.1134 1.8833 0.3681421      2.548979  
1 1 1 21 1  19 o 10.883 0.9611 128.776  20.828  114.859   28.129  145.666   30.989  10.225 1.3755 11.540 1.3427 -1.314322      1.922176  
1 1 1 21 1  20 f 9.8086 1.0768 109.928  20.419  90.475    27.427  134.115   30.583  8.7081 1.6349 10.909 1.4017 -2.200867      2.153512  
1 1 1 21 1  21 f 6.7058 1.3503 59.004   19.154  65.896    26.522  51.490    27.693  7.1814 1.8387 6.2303 1.9781 0.9510903      2.700670  
1 1 1 21 1  22 o 5.4394 1.5537 40.102   23.966  42.611    26.153  26.949    59.880  5.5943 1.9279 5.2845 2.4370 0.3098130      3.107403  
1 1 1 21 1  23 o 3.3927 1.1295 -8.8572  19.279  -10.2547  24.747  -6.6990   30.752  3.1988 1.5052 3.5866 1.6845 -0.3878543     2.259021  
1 1 1 21 1  24 f 5.0116 1.3852 34.648   21.321  9.9147    27.762  70.211    33.290  3.8072 1.7181 6.2160 2.1733 -2.408796      2.770382  
1 1 1 21 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 2  0  o 14.580 1.1590 234.221  31.907  194.718   45.538  272.320   44.721  13.179 1.8281 15.982 1.4252 -0.000000      0.000000  
1 1 1 21 2  1  o 15.297 0.9099 268.351  22.227  218.123   46.146  283.524   25.363  13.964 1.6523 16.629 0.7626 -2.665600      1.819837  
1 1 1 21 2  2  o 5.6330 1.2114 40.567   15.847  4.5770    34.615  50.111    17.825  4.5586 1.9948 6.7074 1.3749 -2.148869      2.422757  
1 1 1 21 2  3  o 7.9088 1.2648 84.754   17.178  48.172    38.309  93.961    19.219  6.3364 2.3176 9.4813 1.0135 -3.144879      2.529507  
1 1 1 21 2  4  o 7.1667 1.2962 59.418   16.465  60.162    36.471  59.228    18.452  6.8924 2.2766 7.4410 1.2399 -0.5486073     2.592375  
1 1 1 21 2  5  o 7.9939 1.1882 102.221  17.682  16.820    40.240  122.658   19.685  5.1269 2.1969 10.861 0.9062 -5.734016      2.376445  
1 1 1 21 2  6  o 6.2010 1.2095 53.924   16.851  -0.7582   42.014  64.406    18.395  4.6593 2.1072 7.7427 1.1879 -3.083356      2.418935  
1 1 1 21 2  7  o 6.3536 1.2196 56.318   16.658  12.362    39.666  65.731    18.355  4.8914 2.1381 7.8159 1.1742 -2.924528      2.439283  
1 1 1 21 2  8  o 4.0877 1.2671 -0.8740  14.953  26.684    36.708  -6.3572   16.374  5.2896 2.1699 2.8859 1.3093 2.403718       2.534284  
1 1 1 21 2  9  o 5.1956 1.3540 30.564   16.797  21.026    38.856  32.755    18.627  5.1142 2.1742 5.2770 1.6144 -0.1628170     2.708045  
1 1 1 21 2  10 o 9.6116 1.2938 106.537  19.127  121.474   44.117  103.080   21.225  9.4113 2.3507 9.8119 1.0816 -0.4005451     2.587647  
1 1 1 21 2  11 o 8.1465 1.3718 85.992   18.986  75.770    43.344  88.419    21.119  7.2492 2.4828 9.0437 1.1676 -1.794554      2.743613  
1 1 1 21 2  12 o 9.2206 1.3591 113.289  19.349  85.908    44.946  119.518   21.437  7.7957 2.5248 10.646 1.0069 -2.849802      2.718202  
1 1 1 21 2  13 o 5.2697 1.3737 31.337   17.244  17.517    41.570  34.210    18.951  5.1344 2.2168 5.4050 1.6230 -0.2706804     2.747427  
1 1 1 21 2  14 o 9.0875 1.3708 101.277  19.942  102.134   45.004  101.067   22.244  8.4814 2.4899 9.6935 1.1474 -1.212150      2.741537  
1 1 1 21 2  15 o 10.110 1.3411 118.932  20.916  130.989   47.602  116.047   23.284  9.7998 2.4385 10.421 1.1172 -0.6210623     2.682281  
1 1 1 21 2  16 o 4.9146 1.3195 25.574   18.183  -13.3038  42.131  34.473    20.157  4.3963 2.0333 5.4329 1.6823 -1.036668      2.638992  
1 1 1 21 2  17 o 4.0646 1.2854 -18.1831 17.397  34.225    39.162  -31.0673  19.418  5.6526 2.2694 2.4767 1.2075 3.175904       2.570709  
1 1 1 21 2  18 o 7.2841 1.4615 73.033   21.328  50.876    47.661  78.581    23.850  6.2910 2.5114 8.2773 1.4957 -1.986311      2.923046  
1 1 1 21 2  19 o 6.0124 1.4149 48.111   20.181  20.244    44.601  55.286    22.630  5.2399 2.2792 6.7850 1.6772 -1.545190      2.829829  
1 1 1 21 2  20 o 4.8210 1.4495 9.0684   22.329  50.497    42.819  -6.4047   26.168  6.0550 2.3920 3.5870 1.6381 2.468039       2.899096  
1 1 1 21 2  21 f 4.3989 1.3969 5.4166   19.577  31.412    46.995  -0.0414   21.534  5.3389 2.3306 3.4590 1.5407 1.879925       2.793821  
1 1 1 21 2  22 o 4.1717 1.3739 -0.2310  26.204  19.508    44.926  -10.4087  32.260  4.7045 2.1476 3.6390 1.7142 1.065454       2.747843  
1 1 1 21 2  23 o 3.9622 1.3030 5.8646   22.013  -0.7660   48.017  7.6289    24.769  4.2115 2.0145 3.7130 1.6532 0.4984462      2.605979  
1 1 1 21 2  24 o 4.8704 1.4758 41.308   23.046  59.170    52.328  37.009    25.669  4.9868 2.2918 4.7539 1.8600 0.2328920      2.951587  
1 1 1 21 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 2  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 3  0  o 3.7600 1.6316 10.746   24.979  36.004    36.650  -11.1633  34.135  4.6146 2.6019 2.9053 1.9694 -0.000000      0.000000  
1 1 1 21 3  1  o 4.2152 1.2443 9.3280   17.713  1.4819    24.971  17.273    25.129  3.8783 1.6958 4.5521 1.8213 -0.6737266     2.488564  
1 1 1 21 3  2  o 9.2927 1.0770 97.147   19.521  104.220   27.504  89.968    27.711  9.7469 1.4109 8.8386 1.6276 0.9083080      2.154003  
1 1 1 21 3  3  o 7.4485 1.3217 67.837   19.704  73.069    26.990  61.865    28.834  7.8336 1.7650 7.0633 1.9679 0.7702761      2.643456  
1 1 1 21 3  4  o 9.6216 1.2718 119.092  18.293  92.792    41.174  125.560   20.419  8.2876 2.3667 10.956 0.9319 -2.667939      2.543557  
1 1 1 21 3  5  o 8.6297 1.3310 82.028   17.819  105.085   43.324  77.333    19.550  8.7691 2.4003 8.4903 1.1513 0.2788448      2.662082  
1 1 1 21 3  6  f 6.2591 1.2853 53.550   17.354  19.630    39.580  61.623    19.309  5.1158 2.1851 7.4024 1.3541 -2.286591      2.570655  
1 1 1 21 3  7  o 16.479 0.9715 328.663  24.339  244.902   51.899  352.279   27.557  14.459 1.7947 18.498 0.7449 -4.038662      1.943099  
1 1 1 21 3  8  f 3.9179 1.2405 1.9859   16.075  3.7563    37.368  1.5838    17.807  4.5115 2.0180 3.3242 1.4431 1.187246       2.480913  
1 1 1 21 3  9  o 8.1542 1.3244 93.057   18.177  60.687    42.556  100.280   20.103  6.5996 2.4380 9.7088 1.0353 -3.109153      2.648764  
1 1 1 21 3  10 o 14.234 1.0165 235.816  22.646  209.692   48.903  242.948   25.551  13.196 1.8530 15.272 0.8365 -2.076469      2.033073  
1 1 1 21 3  11 o 10.385 1.2906 127.239  20.211  128.870   45.953  126.847   22.505  9.8160 2.3680 10.954 1.0273 -1.137601      2.581251  
1 1 1 21 3  12 o 8.5754 1.3830 84.937   19.600  99.218    44.219  81.446    21.865  8.4836 2.4617 8.6671 1.2614 -0.1835337     2.766021  
1 1 1 21 3  13 o 8.4817 1.3806 99.106   20.128  68.785    45.096  106.649   22.492  6.9849 2.5206 9.9785 1.1270 -2.993624      2.761121  
1 1 1 21 3  14 o 4.1213 1.3190 2.4775   17.867  -2.5275   45.651  3.3829    19.416  4.7114 2.1561 3.5311 1.5198 1.180303       2.637966  
1 1 1 21 3  15 o 8.2778 1.4316 68.402   19.492  119.888   45.519  56.842    21.569  9.5411 2.3904 7.0144 1.5759 2.526699       2.863109  
1 1 1 21 3  16 o 4.3498 1.2669 13.703   17.875  -33.9560  42.383  24.014    19.714  3.9943 1.9056 4.7052 1.6700 -0.7108841     2.533811  
1 1 1 21 3  17 o 4.3518 1.3375 9.3334   18.335  5.0306    41.592  10.371    20.426  4.7665 2.1308 3.9371 1.6173 0.8294013      2.675049  
1 1 1 21 3  18 o 11.835 1.2889 162.735  23.236  167.081   51.479  161.624   26.040  11.308 2.3528 12.362 1.0532 -1.053856      2.577785  
1 1 1 21 3  19 o 4.6615 1.3120 21.798   19.044  -18.6861  42.378  32.042    21.317  4.1655 1.9630 5.1575 1.7413 -0.9919901     2.623992  
1 1 1 21 3  20 f 5.9819 1.7338 44.938   21.947  0.0000    0.0000  44.938    21.947  ?      ?      5.9819 1.7338 ?              ?         
1 1 1 21 3  21 o 5.0957 1.4011 33.861   20.256  12.775    44.647  39.326    22.730  4.7231 2.1502 5.4683 1.7969 -0.7451663     2.802175  
1 1 1 21 3  22 o 6.5835 1.5132 80.566   27.751  32.570    48.364  104.123   33.883  4.8660 2.2240 8.3011 2.0525 -3.435135      3.026358  
1 1 1 21 3  23 o 6.6907 1.6709 71.452   23.823  134.113   52.193  54.963    26.775  7.5356 2.7127 5.8458 1.9516 1.689752       3.341800  
1 1 1 21 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 4  0  f 4.3315 1.7890 29.457   26.201  42.523    38.332  17.999    35.896  4.8700 2.6926 3.7931 2.3564 -0.000000      0.000000  
1 1 1 21 4  1  o 16.143 0.7785 277.667  24.896  231.271   34.459  328.332   36.009  14.663 1.1750 17.623 1.0217 -2.959908      1.557080  
1 1 1 21 4  2  o 4.6231 1.2513 16.281   17.978  38.426    25.179  -6.7484   25.677  5.6396 1.8925 3.6065 1.6375 2.033184       2.502598  
1 1 1 21 4  3  o 7.8775 1.2771 74.616   19.696  64.574    26.700  86.603    29.172  7.2599 1.8373 8.4951 1.7742 -1.235144      2.554114  
1 1 1 21 4  4  o 8.6249 1.1718 87.343   19.440  89.905    26.768  84.484    28.280  8.8225 1.5748 8.4272 1.7357 0.3953199      2.343591  
1 1 1 21 4  5  o 6.3718 1.3542 50.277   19.077  61.076    26.531  38.718    27.449  7.0646 1.8543 5.6791 1.9741 1.385539       2.708425  
1 1 1 21 4  6  o 10.508 1.0628 126.658  20.922  90.294    29.282  164.582   29.903  8.6888 1.7456 12.328 1.2128 -3.639441      2.125587  
1 1 1 21 4  7  o 9.5080 1.2683 100.232  18.764  125.660   43.309  94.356    20.820  9.6506 2.2801 9.3654 1.1115 0.2852173      2.536599  
1 1 1 21 4  8  o 5.2591 1.2861 34.637   17.049  2.5355    38.615  42.410    19.002  4.5356 2.0385 5.9825 1.5688 -1.446866      2.572275  
1 1 1 21 4  9  o 6.3271 1.4055 50.644   17.849  45.823    41.735  51.723    19.746  6.0087 2.3654 6.6456 1.5188 -0.6368599     2.810994  
1 1 1 21 4  10 o 8.0327 1.1352 110.799  19.701  -14.5612  44.312  141.682   21.994  4.4386 2.0640 11.627 0.9458 -7.188339      2.270403  
1 1 1 21 4  11 o 10.150 1.3740 145.718  21.182  89.733    46.716  160.206   23.765  7.9406 2.5743 12.358 0.9615 -4.417853      2.748030  
1 1 1 21 4  12 o 4.7975 1.3955 19.071   18.362  22.358    41.193  18.256    20.512  5.2389 2.2332 4.3562 1.6741 0.8827648      2.791005  
1 1 1 21 4  13 o 6.0946 1.4638 42.319   18.056  57.451    41.809  38.849    20.020  6.4949 2.4131 5.6944 1.6575 0.8004990      2.927544  
1 1 1 21 4  14 o 9.2674 1.4052 116.110  20.938  82.618    47.382  124.237   23.340  7.6943 2.5960 10.841 1.0765 -3.146224      2.810379  
1 1 1 21 4  15 o 11.763 1.2070 155.724  21.995  167.322   48.399  152.706   24.691  11.496 2.1849 12.029 1.0263 -0.5331736     2.413920  
1 1 1 21 4  16 o 10.230 1.2527 101.897  22.169  174.860   47.476  81.551    25.071  12.037 1.9721 8.4229 1.5452 3.614326       2.505306  
1 1 1 21 4  17 o 6.5987 1.3367 62.392   20.714  8.1432    45.426  76.632    23.274  4.9967 2.2308 8.2007 1.4732 -3.203984      2.673319  
1 1 1 21 4  18 o 6.4777 1.4762 56.024   20.385  45.123    46.643  58.598    22.664  5.9776 2.4483 6.9778 1.6499 -1.000147      2.952391  
1 1 1 21 4  19 o 8.1874 1.4026 98.735   21.402  62.758    47.517  107.891   23.971  6.4691 2.5307 9.9056 1.2100 -3.436506      2.805107  
1 1 1 21 4  20 o 4.3479 1.2897 15.699   19.669  -37.7016  46.312  27.451    21.725  3.9151 1.8988 4.7806 1.7458 -0.8655088     2.579395  
1 1 1 21 4  21 o 4.7049 1.3678 28.368   19.744  11.230    45.561  32.330    21.908  4.5099 2.0958 4.8999 1.7582 -0.3899765     2.735579  
1 1 1 21 4  22 o 3.4542 1.1918 -28.3838 26.527  -55.6399  46.469  -15.2070  32.310  3.4523 1.7173 3.4561 1.6530 -0.3819227E-02 2.383528  
1 1 1 21 4  23 o 6.4845 1.6517 75.976   24.666  127.026   48.787  58.446    28.589  7.2061 2.6185 5.7628 2.0140 1.443312       3.303453  
1 1 1 21 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 4  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  0  o 5.6072 1.8465 49.902   27.895  85.213    39.217  13.740    39.687  7.4521 2.8103 3.7623 2.3958 -0.000000      0.000000  
1 1 1 21 5  1  o 4.1379 1.2481 7.7611   18.251  11.099    25.917  4.4772    25.706  4.2743 1.7942 4.0016 1.7355 0.2727451      2.496175  
1 1 1 21 5  2  o 5.4745 1.3638 35.178   18.709  40.857    26.289  29.349    26.631  5.7955 1.9338 5.1534 1.9237 0.6421394      2.727662  
1 1 1 21 5  3  o 3.7109 1.1653 -3.6204  17.749  9.0101    25.038  -16.3782  25.163  4.1280 1.7497 3.2938 1.5396 0.8342457      2.330603  
1 1 1 21 5  4  o 6.7148 1.3284 56.679   19.366  37.982    27.414  75.304    27.361  5.5731 1.9703 7.8566 1.7822 -2.283572      2.656731  
1 1 1 21 5  5  o 5.4805 1.3755 36.723   18.910  36.451    27.086  36.982    26.412  5.4669 1.9557 5.4941 1.9348 -0.2717781E-01 2.751013  
1 1 1 21 5  6  f 8.4748 1.2298 86.548   20.153  97.515    28.792  76.015    28.217  9.0927 1.6438 7.8568 1.8298 1.235852       2.459674  
1 1 1 21 5  7  o 19.172 0.7177 390.361  27.483  409.624   38.668  370.698   39.067  19.686 0.9821 18.659 1.0469 1.027111       1.435489  
1 1 1 21 5  8  o 3.6397 1.1186 -11.8534 17.104  21.222    24.888  -41.4591  23.547  4.6590 1.8290 2.6205 1.2884 2.038538       2.237206  
1 1 1 21 5  9  o 4.8662 1.3420 22.712   19.055  31.030    27.426  14.951    26.492  5.2652 1.9548 4.4673 1.8392 0.7978864      2.684050  
1 1 1 21 5  10 o 5.6477 1.4655 28.934   17.344  60.476    41.915  22.417    19.052  6.7190 2.4293 4.5764 1.6399 2.142542       2.930960  
1 1 1 21 5  11 o 6.4567 1.4087 54.393   19.027  40.524    41.766  58.025    21.374  5.8654 2.3476 7.0479 1.5578 -1.182500      2.817445  
1 1 1 21 5  12 o 15.964 0.9348 267.749  24.105  303.847   53.777  258.672   26.965  16.178 1.6620 15.751 0.8560 0.4273472      1.869522  
1 1 1 21 5  13 o 7.1675 1.4876 47.393   19.412  108.452   44.152  32.762    21.613  9.0153 2.4045 5.3198 1.7524 3.695527       2.975285  
1 1 1 21 5  14 o 6.6680 1.4280 40.930   18.173  94.081    39.688  26.829    20.441  8.4363 2.2924 4.8998 1.7036 3.536462       2.856089  
1 1 1 21 5  15 o 3.8216 1.2132 -0.4295  17.775  -49.1318  43.438  9.3656    19.481  3.8002 1.8421 3.8429 1.5791 -0.4267287E-01 2.426306  
1 1 1 21 5  16 o 5.7151 1.5131 23.159   19.260  79.015    45.292  10.829    21.280  7.4286 2.5380 4.0016 1.6481 3.426988       3.026115  
1 1 1 21 5  17 o 4.2985 1.3746 -5.2591  19.498  27.116    45.198  -12.6615  21.613  5.4764 2.3370 3.1207 1.4479 2.355657       2.749138  
1 1 1 21 5  18 o 4.4347 1.3922 5.5660   18.661  29.716    45.754  0.7470    20.439  5.4141 2.3317 3.4553 1.5219 1.958811       2.784384  
1 1 1 21 5  19 o 5.3012 1.5038 18.513   19.837  75.148    46.204  5.7136    21.965  6.8757 2.5403 3.7267 1.6102 3.149047       3.007671  
1 1 1 21 5  20 o 6.3390 1.2959 64.130   21.030  4.8796    45.239  80.463    23.752  4.5413 2.1027 8.1367 1.5153 -3.595328      2.591807  
1 1 1 21 5  21 o 5.9196 1.4299 58.411   21.053  41.249    47.495  62.608    23.486  5.0902 2.2761 6.7490 1.7315 -1.658777      2.859872  
1 1 1 21 5  22 o 5.8603 1.3547 53.470   27.364  -40.9122  45.042  108.678   34.449  3.4850 1.7261 8.2357 2.0884 -4.750779      2.709434  
1 1 1 21 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 5  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 6  0  o 5.7903 2.0479 61.671   28.800  66.780    43.410  57.653    38.492  5.9677 2.9821 5.6129 2.8075 -0.000000      0.000000  
1 1 1 21 6  1  o 6.9886 1.3365 62.053   19.716  78.638    27.773  45.201    27.995  8.0189 1.7783 5.9584 1.9955 2.060574       2.672902  
1 1 1 21 6  2  o 4.0442 1.2218 5.9889   18.037  18.036    25.267  -6.5291   25.756  4.4974 1.8168 3.5910 1.6342 0.9064293      2.443637  
1 1 1 21 6  3  o 5.2084 1.3531 30.063   19.186  16.492    26.998  43.911    27.272  4.5055 1.8560 5.9112 1.9695 -1.405686      2.706228  
1 1 1 21 6  4  o 8.4099 1.1829 87.495   20.325  34.659    28.441  142.648   29.058  5.4075 1.9940 11.412 1.2731 -6.004710      2.365762  
1 1 1 21 6  5  o 4.5639 1.2732 14.319   18.900  37.426    26.604  -9.2297   26.857  5.5387 1.9424 3.5890 1.6466 1.949663       2.546461  
1 1 1 21 6  6  o 4.8691 1.3170 23.467   18.460  36.651    26.566  11.158    25.669  5.5076 1.9404 4.2306 1.7812 1.277086       2.633931  
1 1 1 21 6  7  o 12.028 0.9149 157.818  21.984  164.393   30.905  151.084   31.279  12.312 1.2551 11.745 1.3315 0.5662088      1.829824  
1 1 1 21 6  8  o 8.5116 1.2336 85.888   20.272  87.549    29.484  84.397    27.918  8.5650 1.7793 8.4581 1.7092 0.1068468      2.467235  
1 1 1 21 6  9  f 5.1904 1.2223 19.150   18.921  62.272    27.419  -20.0497  26.142  7.1017 1.8952 3.2792 1.5442 3.822499       2.444687  
1 1 1 21 6  10 o 5.3027 1.3879 32.208   19.623  38.350    28.198  26.442    27.324  5.6165 1.9969 4.9889 1.9281 0.6275887      2.775778  
1 1 1 21 6  11 o 8.4991 1.3086 88.952   21.632  79.462    31.075  97.874    30.132  7.9402 1.9670 9.0579 1.7263 -1.117638      2.617107  
1 1 1 21 6  12 o 11.568 1.1693 155.752  21.009  145.762   44.444  158.626   23.841  10.825 2.1288 12.312 0.9682 -1.487174      2.338606  
1 1 1 21 6  13 o 4.5930 1.3918 11.941   17.931  18.959    44.283  10.565    19.611  5.2740 2.2826 3.9119 1.5932 1.362105       2.783592  
1 1 1 21 6  14 f 10.990 1.2490 143.494  21.493  135.360   45.261  145.862   24.422  10.228 2.2716 11.752 1.0390 -1.524021      2.497972  
1 1 1 21 6  15 o 3.0948 1.0790 -27.2616 16.693  -56.5479  42.728  -21.9862  18.135  3.6317 1.7751 2.5579 1.2273 1.073814       2.158100  
1 1 1 21 6  16 o 5.7903 1.5286 28.642   19.556  70.647    45.169  18.952    21.694  7.1242 2.5279 4.4565 1.7192 2.667733       3.057135  
1 1 1 21 6  17 o 6.2090 1.5052 50.690   20.754  47.079    46.570  51.585    23.184  5.9783 2.4473 6.4396 1.7530 -0.4613256     3.010352  
1 1 1 21 6  18 o 6.9493 1.5060 66.157   20.977  64.670    47.753  66.512    23.351  6.4950 2.5381 7.4037 1.6218 -0.9086652     3.011997  
1 1 1 21 6  19 o 5.0661 1.4480 3.4676   19.017  87.765    45.726  -14.1616  20.911  7.1940 2.5445 2.9382 1.3829 4.255829       2.895963  
1 1 1 21 6  20 f 4.0545 1.2788 13.454   19.479  -9.1738   45.707  18.476    21.532  4.0433 1.9422 4.0657 1.6642 -0.2245760E-01 2.557693  
1 1 1 21 6  21 o 7.5318 1.4973 96.596   23.010  93.283    49.236  97.521    26.028  6.4136 2.5550 8.6500 1.5620 -2.236396      2.994610  
1 1 1 21 6  22 o 4.6076 1.4644 37.039   27.126  46.453    47.765  32.557    32.956  4.7448 2.1839 4.4703 1.9516 0.2744460      2.928841  
1 1 1 21 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 6  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  0  o 6.4434 2.0563 72.787   28.783  67.392    43.621  76.948    38.306  6.0178 2.9923 6.8691 2.8213 -0.000000      0.000000  
1 1 1 21 7  1  o 7.8584 1.2996 76.740   20.393  57.266    28.627  96.805    29.058  6.6807 1.9921 9.0361 1.6694 -2.355356      2.599144  
1 1 1 21 7  2  o 6.2856 1.4003 50.375   19.707  47.149    28.435  53.356    27.338  6.0890 2.0102 6.4823 1.9499 -0.3932672     2.800525  
1 1 1 21 7  3  o 8.2325 1.2573 82.055   20.096  84.638    28.619  79.541    28.225  8.3752 1.7642 8.0898 1.7917 0.2853670      2.514511  
1 1 1 21 7  4  o 7.5551 1.3311 70.644   19.977  72.775    26.645  67.908    30.191  7.7838 1.7536 7.3265 2.0030 0.4573021      2.662187  
1 1 1 21 7  5  o 8.3245 1.2606 82.834   20.399  97.399    29.479  69.452    28.256  9.1233 1.6774 7.5258 1.8822 1.597458       2.521145  
1 1 1 21 7  6  o 7.4463 1.2644 68.234   19.980  40.210    29.141  93.093    27.446  5.7725 2.0324 9.1201 1.5047 -3.347517      2.528789  
1 1 1 21 7  7  o 9.1270 1.1540 96.430   20.501  105.001   28.648  87.432    29.351  9.6981 1.4770 8.5560 1.7735 1.142049       2.307980  
1 1 1 21 7  8  o 3.8289 1.1581 -9.3190  18.453  -46.8153  26.738  24.779    25.498  2.7831 1.3693 4.8748 1.8681 -2.091614      2.316178  
1 1 1 21 7  9  o 5.5940 1.4162 37.963   20.197  44.194    28.888  32.005    28.249  5.9191 2.0269 5.2689 1.9784 0.6501870      2.832406  
1 1 1 21 7  10 o 5.6839 1.1620 26.046   19.937  -32.1948  28.743  80.053    27.678  3.1903 1.5345 8.1776 1.7455 -4.987352      2.324060  
1 1 1 21 7  11 o 6.0394 1.4520 44.242   20.972  42.698    29.792  45.759    29.527  5.9550 2.0574 6.1238 2.0494 -0.1688757     2.903940  
1 1 1 21 7  12 f 5.0055 1.3557 24.059   19.661  38.822    28.236  10.165    27.391  5.6951 2.0009 4.3159 1.8298 1.379200       2.711417  
1 1 1 21 7  13 o 7.6021 1.3077 68.542   22.149  111.211   32.346  30.871    30.392  9.8794 1.6370 5.3248 2.0398 4.554608       2.615431  
1 1 1 21 7  14 o 4.4658 1.2736 -1.9586  20.824  43.987    30.735  -40.9512  28.314  5.9367 2.0875 2.9950 1.4598 2.941695       2.547263  
1 1 1 21 7  15 o 6.4781 1.3836 57.633   20.030  19.640    45.809  66.615    22.272  5.3368 2.3156 7.6193 1.5149 -2.282427      2.767171  
1 1 1 21 7  16 o 9.8869 1.4299 126.341  22.307  120.967   49.784  127.691   24.952  8.9275 2.6182 10.846 1.1503 -1.918924      2.859717  
1 1 1 21 7  17 o 10.631 1.3121 138.129  22.655  143.167   46.607  136.570   25.923  10.082 2.3542 11.180 1.1593 -1.098433      2.624140  
1 1 1 21 7  18 o 4.4579 1.3618 16.296   20.862  -6.8452   46.196  22.224    23.382  4.4076 2.0684 4.5082 1.7718 -0.1005540     2.723517  
1 1 1 21 7  19 o 8.0134 1.4102 101.777  21.838  78.782    47.038  108.095   24.657  6.3954 2.5132 9.6315 1.2800 -3.236092      2.820374  
1 1 1 21 7  20 o 3.0703 1.0570 -22.5084 19.093  -96.2699  47.141  -8.0337   20.883  3.1219 1.5768 3.0188 1.4082 0.1030827      2.114032  
1 1 1 21 7  21 o 4.6981 1.2872 35.716   20.658  -18.3865  46.060  49.339    23.113  3.7427 1.8323 5.6535 1.8084 -1.910846      2.574429  
1 1 1 21 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 7  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 8  0  o 6.5065 1.4933 53.222   27.814  -21.4630  39.675  125.401   39.004  2.9156 2.0143 10.097 2.2051 -0.000000      0.000000  
1 1 1 21 8  1  o 5.4754 1.3988 34.496   19.776  41.178    28.374  28.184    27.577  5.8248 2.0081 5.1259 1.9479 0.6988831      2.797632  
1 1 1 21 8  2  o 4.3981 1.2945 12.505   19.034  19.321    26.666  5.4256    27.177  4.6717 1.8737 4.1244 1.7866 0.5473166      2.588967  
1 1 1 21 8  3  f 7.3323 1.3785 66.669   20.560  62.776    28.410  70.949    29.792  7.1084 1.9429 7.5562 1.9561 -0.4477763     2.757002  
1 1 1 21 8  4  o 8.4299 1.3008 86.337   21.375  98.994    30.129  73.512    30.329  9.1768 1.7043 7.6831 1.9657 1.493715       2.601693  
1 1 1 21 8  5  o 9.8453 1.1478 111.877  21.990  103.046   31.491  120.281   30.719  9.3185 1.7540 10.372 1.4809 -1.053560      2.295572  
1 1 1 21 8  6  f 4.5257 1.2822 12.999   19.001  34.357    27.166  -7.4588   26.587  5.4092 1.9557 3.6422 1.6586 1.766953       2.564310  
1 1 1 21 8  7  o 8.5204 1.2994 88.703   21.477  82.650    29.516  95.513    31.310  8.1967 1.8450 8.8442 1.8304 -0.6475086     2.598888  
1 1 1 21 8  8  o 4.7990 1.3708 21.320   20.363  18.605    28.634  24.098    28.965  4.6744 1.9168 4.9236 1.9602 -0.2492437     2.741686  
1 1 1 21 8  9  o 5.9677 1.4001 42.070   20.855  21.395    29.798  61.921    29.199  4.8884 1.9736 7.0471 1.9863 -2.158689      2.800101  
1 1 1 21 8  10 o 8.0977 1.3174 79.752   21.850  104.365   30.608  54.173    31.203  9.6274 1.5896 6.5680 2.1013 3.059409       2.634820  
1 1 1 21 8  11 o 13.115 0.9557 189.674  24.735  157.927   35.111  220.951   34.850  11.909 1.4741 14.321 1.2167 -2.411765      1.911380  
1 1 1 21 8  12 o 4.6097 1.3550 14.939   20.866  6.3986    30.326  22.617    28.754  4.3247 1.8803 4.8947 1.9517 -0.5700083     2.710097  
1 1 1 21 8  13 o 7.9561 1.4322 81.380   23.225  64.994    33.632  96.317    32.110  7.0297 2.1724 8.8825 1.8668 -1.852788      2.864317  
1 1 1 21 8  14 o 7.2634 1.4725 66.999   22.569  75.212    32.641  59.477    31.240  7.6957 2.0739 6.8311 2.0909 0.8645968      2.944950  
1 1 1 21 8  15 o 7.1162 1.4712 67.807   23.453  44.757    33.350  90.359    32.987  5.8639 2.1597 8.3684 1.9985 -2.504510      2.942477  
1 1 1 21 8  16 o 10.901 1.2581 145.028  25.978  189.499   37.828  105.337   35.737  12.845 1.4725 8.9578 2.0404 3.887302       2.516199  
1 1 1 21 8  17 f 10.473 1.4602 148.040  23.550  140.931   52.932  149.794   26.295  9.2604 2.6951 11.686 1.1251 -2.425650      2.920489  
1 1 1 21 8  18 f 6.3570 1.5807 56.202   21.586  82.503    48.694  49.770    24.081  6.6769 2.5757 6.0371 1.8332 0.6397524      3.161494  
1 1 1 21 8  19 o 3.7404 1.2534 -2.6489  20.778  -11.4367  48.423  -0.6657   23.004  4.1020 1.9777 3.3789 1.5402 0.7230716      2.506720  
1 1 1 21 8  20 o 4.7895 1.4311 33.048   20.683  51.098    44.902  28.187    23.302  5.1134 2.2538 4.4657 1.7644 0.6476283      2.862258  
1 1 1 21 8  21 o 5.3920 1.4023 57.171   21.539  39.895    50.562  61.002    23.808  4.5547 2.1457 6.2293 1.8059 -1.674615      2.804518  
1 1 1 21 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 8  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  0  o 7.7933 1.9541 95.325   30.078  67.597    44.500  118.647   40.812  6.0622 3.0210 9.5244 2.4793 -0.000000      0.000000  
1 1 1 21 9  1  o 8.0870 1.3296 80.051   21.119  72.091    29.164  88.828    30.624  7.6240 1.9151 8.5500 1.8450 -0.9260583     2.659292  
1 1 1 21 9  2  o 7.2341 1.2366 63.633   20.390  102.195   28.652  24.063    29.024  9.5277 1.5036 4.9404 1.9637 4.587362       2.473259  
1 1 1 21 9  3  o 5.5442 1.3642 33.567   19.938  12.715    27.293  57.426    29.195  4.3810 1.8402 6.7075 2.0145 -2.326560      2.728427  
1 1 1 21 9  4  o 5.4322 1.3659 33.841   19.407  49.221    27.840  19.303    27.067  6.2267 1.9840 4.6377 1.8780 1.589066       2.731900  
1 1 1 21 9  5  o 4.2852 1.2482 3.1515   19.364  34.314    28.091  -25.0659  26.730  5.3865 1.9824 3.1839 1.5174 2.202586       2.496460  
1 1 1 21 9  6  o 4.9510 1.3774 24.867   20.009  23.947    28.378  25.777    28.217  4.9110 1.9450 4.9911 1.9508 -0.8012152E-01 2.754747  
1 1 1 21 9  7  o 7.1919 1.3793 64.776   20.892  80.041    29.007  48.323    30.116  8.1558 1.8240 6.2279 2.0694 1.927880       2.758499  
1 1 1 21 9  8  o 3.5368 1.1607 -16.0655 19.803  -24.6777  29.188  -8.7193   26.957  3.4080 1.6130 3.6656 1.6695 -0.2575679     2.321466  
1 1 1 21 9  9  o 12.447 0.9920 170.080  24.288  211.854   35.601  133.706   33.220  13.974 1.2739 10.921 1.5210 3.053042       1.983984  
1 1 1 21 9  10 o 7.6010 1.3924 71.849   21.452  63.494    30.528  79.999    30.151  7.1000 2.0411 8.1020 1.8946 -1.001987      2.784866  
1 1 1 21 9  11 o 3.9086 1.2283 -11.1179 20.322  18.964    30.396  -35.4340  27.328  4.7854 1.9701 3.0319 1.4676 1.753500       2.456662  
1 1 1 21 9  12 o 9.3120 1.3336 105.588  23.979  115.611   34.602  96.328    33.259  9.7940 1.8339 8.8301 1.9366 0.9638891      2.667130  
1 1 1 21 9  13 o 8.8042 1.3214 95.237   23.136  66.371    32.851  123.643   32.589  7.1563 2.1341 10.452 1.5590 -3.295834      2.642855  
1 1 1 21 9  14 f 4.2639 1.3367 4.1276   22.638  12.204    33.396  -2.7384   30.793  4.5529 1.9763 3.9749 1.8002 0.5780697      2.673323  
1 1 1 21 9  15 o 4.9340 1.4425 20.481   23.769  42.345    35.602  2.8992    31.926  5.6999 2.2014 4.1681 1.8648 1.531788       2.885082  
1 1 1 21 9  16 o 7.1181 1.5839 73.940   25.182  70.889    35.734  76.951    35.494  6.9517 2.2513 7.2845 2.2285 -0.3328009     3.167733  
1 1 1 21 9  17 o 4.5991 1.3918 18.807   23.917  -2.3434   36.306  35.023    31.790  4.0646 1.8826 5.1336 2.0505 -1.068978      2.783614  
1 1 1 21 9  18 o 5.5656 1.4498 39.280   24.375  91.978    37.472  0.6285    32.092  7.3165 2.2984 3.8147 1.7679 3.501806       2.899672  
1 1 1 21 9  19 o 6.3490 1.3426 74.612   21.819  30.280    49.923  85.079    24.258  4.6755 2.1797 8.0225 1.5681 -3.347029      2.685165  
1 1 1 21 9  20 o 5.4343 1.3063 58.205   22.152  -4.2108   51.232  72.558    24.568  3.9293 1.9255 6.9394 1.7658 -3.010181      2.612573  
1 1 1 21 9  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 9  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 0  o 11.843 1.7758 188.805  34.459  112.029   49.797  259.353   47.734  8.3396 3.1735 15.346 1.5947 -0.000000      0.000000  
1 1 1 21 10 1  o 4.7090 1.2558 11.569   19.515  -24.7583  27.647  47.644    27.551  3.2630 1.5517 6.1551 1.9750 -2.892076      2.511701  
1 1 1 21 10 2  o 7.2130 1.4107 65.866   21.152  57.675    29.543  74.482    30.299  6.7226 2.0281 7.7035 1.9614 -0.9808846     2.821409  
1 1 1 21 10 3  o 4.8440 1.3286 20.514   19.384  3.6651    27.031  38.350    27.812  4.0411 1.7657 5.6469 1.9857 -1.605770      2.657247  
1 1 1 21 10 4  o 4.8259 1.3625 21.398   19.843  22.169    28.413  20.664    27.724  4.8720 1.9409 4.7798 1.9129 0.9215832E-01  2.725079  
1 1 1 21 10 5  o 8.0682 1.3323 78.453   21.313  97.042    30.902  61.587    29.434  9.0839 1.7645 7.0525 1.9966 2.031426       2.664551  
1 1 1 21 10 6  o 4.9108 1.3745 20.740   20.661  34.753    29.388  7.0459    29.053  5.5190 2.0282 4.3027 1.8555 1.216244       2.748907  
1 1 1 21 10 7  o 9.1166 1.2801 104.269  22.988  53.629    33.078  151.575   31.971  6.4784 2.1691 11.755 1.3599 -5.276474      2.560176  
1 1 1 21 10 8  o 6.0696 1.4595 45.294   21.206  49.173    30.412  41.624    29.585  6.2753 2.0793 5.8639 2.0489 0.4114032      2.919095  
1 1 1 21 10 9  o 4.4655 1.3101 6.7891   20.802  32.637    29.845  -17.6320  29.009  5.3889 2.0316 3.5420 1.6547 1.846843       2.620190  
1 1 1 21 10 10 o 12.186 1.0421 167.402  25.182  149.426   36.303  184.072   34.961  11.448 1.5856 12.924 1.3526 -1.476353      2.084128  
1 1 1 21 10 11 o 7.4482 1.4001 70.141   22.134  47.251    31.705  91.903    30.914  6.1508 2.1226 8.7456 1.8263 -2.594775      2.800152  
1 1 1 21 10 12 o 11.599 1.1136 154.036  25.721  153.676   38.036  154.338   34.913  11.513 1.6518 11.685 1.4939 -0.1718798     2.227156  
1 1 1 21 10 13 o 5.2947 1.4586 32.330   23.036  17.289    34.678  44.208    30.818  4.7595 2.0394 5.8298 2.0860 -1.070304      2.917288  
1 1 1 21 10 14 o 6.3550 1.5798 54.868   25.589  76.026    37.718  36.824    34.831  7.2542 2.3091 5.4558 2.1567 1.798422       3.159648  
1 1 1 21 10 15 o 4.4894 1.3998 12.262   24.463  10.511    36.563  13.681    32.914  4.5033 2.0066 4.4755 1.9522 0.2778530E-01  2.799521  
1 1 1 21 10 16 o 6.2897 1.4283 55.269   25.960  -0.2017   38.944  99.630    34.826  4.2105 1.9500 8.3688 2.0876 -4.158264      2.856699  
1 1 1 21 10 17 o 6.6733 1.3783 63.248   25.019  127.832   36.797  7.7271    34.118  9.2930 2.0361 4.0536 1.8583 5.239383       2.756653  
1 1 1 21 10 18 o 6.9303 1.5977 87.398   25.881  78.671    38.714  94.450    34.800  6.3715 2.3299 7.4891 2.1869 -1.117562      3.195472  
1 1 1 21 10 19 o 4.1291 1.3413 19.548   25.112  25.055    37.968  15.265    33.480  4.2762 1.9604 3.9820 1.8312 0.2941895      2.682608  
1 1 1 21 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 10 26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 0  o 3.6565 1.6616 8.1008   28.220  -5.1113   40.156  20.993    39.667  3.2883 2.2009 4.0246 2.4900 -0.000000      0.000000  
1 1 1 21 11 1  o 5.9047 1.4372 41.899   20.790  34.114    29.831  49.251    28.988  5.4952 2.0390 6.3143 2.0259 -0.8190961     2.874344  
1 1 1 21 11 2  o 6.8973 1.4126 59.459   21.019  71.688    29.441  46.746    30.019  7.6422 1.9267 6.1524 2.0664 1.489742       2.825241  
1 1 1 21 11 3  o 6.6134 1.3183 51.761   20.533  19.647    28.694  85.462    29.394  4.7693 1.9328 8.4576 1.7934 -3.688283      2.636630  
1 1 1 21 11 4  o 4.2052 1.2798 7.0660   19.471  7.5487    27.134  6.5536    27.955  4.2018 1.8023 4.2087 1.8175 -0.6928444E-02 2.559646  
1 1 1 21 11 5  o 5.6397 1.4513 37.166   21.132  40.258    31.434  34.615    28.544  5.7990 2.1026 5.4804 2.0011 0.3186164      2.902701  
1 1 1 21 11 6  o 9.2106 1.2833 101.029  22.726  103.849   33.695  98.675    30.782  9.2765 1.8805 9.1448 1.7467 0.1317406      2.566605  
1 1 1 21 11 7  o 5.0060 1.4040 20.929   21.340  40.585    32.679  6.3155    28.177  5.8058 2.1379 4.2061 1.8206 1.599724       2.808066  
1 1 1 21 11 8  o 6.0627 1.4905 46.466   22.259  41.009    33.155  50.943    30.034  5.7994 2.1501 6.3259 2.0648 -0.5264373     2.981014  
1 1 1 21 11 9  o 10.659 1.1119 128.819  23.683  123.349   33.462  134.310   33.524  10.403 1.6083 10.914 1.5358 -0.5115604     2.223792  
1 1 1 21 11 10 o 5.2883 1.3924 26.566   22.370  -5.5182   33.311  52.923    30.192  4.1124 1.8664 6.4641 2.0668 -2.351692      2.784832  
1 1 1 21 11 11 o 7.3457 1.4808 73.570   24.180  48.291    35.685  95.030    32.879  6.0365 2.2321 8.6550 1.9466 -2.618522      2.961661  
1 1 1 21 11 12 o 5.3381 1.4361 29.219   23.566  -0.6049   33.519  58.370    33.139  4.1560 1.8806 6.5203 2.1710 -2.364261      2.872219  
1 1 1 21 11 13 o 4.9630 1.4255 19.414   24.065  49.802    34.614  -9.0178   33.481  6.0146 2.2025 3.9113 1.8102 2.103319       2.850972  
1 1 1 21 11 14 o 5.4724 1.5050 31.715   26.146  72.537    38.759  -2.3726   35.418  6.8486 2.3478 4.0962 1.8836 2.752392       3.009987  
1 1 1 21 11 15 o 4.9952 1.4566 30.733   24.558  12.563    36.589  45.629    33.129  4.4277 1.9876 5.5627 2.1299 -1.134957      2.913259  
1 1 1 21 11 16 o 4.0956 1.2993 6.6029   23.564  -21.8626  34.736  30.870    32.072  3.4567 1.6687 4.7346 1.9921 -1.277912      2.598631  
1 1 1 21 11 17 o 3.3794 1.1596 -23.3313 24.043  -9.9595   36.578  -33.5040  31.904  3.6766 1.7585 3.0822 1.5122 0.5943356      2.319294  
1 1 1 21 11 18 o 5.9194 1.5161 72.235   26.324  40.631    41.469  93.565    34.068  4.6757 2.1059 7.1632 2.1817 -2.487436      3.032256  
1 1 1 21 11 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 11 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 0  o 4.9189 1.9598 42.944   29.972  32.633    45.337  50.949    39.948  4.5255 2.7338 5.3124 2.8090 -0.000000      0.000000  
1 1 1 21 12 1  o 5.6764 1.2176 21.289   21.044  -35.1096  29.329  81.132    30.211  3.1896 1.5381 8.1631 1.8881 -4.973565      2.435292  
1 1 1 21 12 2  o 8.0653 1.5942 77.538   26.028  119.906   45.017  56.263    31.900  9.4870 2.3774 6.6437 2.1245 2.843333       3.188332  
1 1 1 21 12 3  o 8.0022 1.3767 78.718   22.086  98.604    32.286  61.227    30.280  9.0480 1.8466 6.9564 2.0424 2.091557       2.753417  
1 1 1 21 12 4  o 5.5277 1.4052 34.805   20.502  48.879    29.002  20.746    28.987  6.2450 2.0286 4.8104 1.9450 1.434595       2.810416  
1 1 1 21 12 5  o 4.3482 1.3069 9.4299   20.191  -0.8068   28.867  19.235    28.252  3.9907 1.7802 4.7057 1.9139 -0.7150226     2.613839  
1 1 1 21 12 6  o 6.4042 1.4770 52.577   21.756  50.372    31.062  54.700    30.481  6.2787 2.1020 6.5297 2.0755 -0.2509937     2.954022  
1 1 1 21 12 7  o 5.6568 1.4624 37.325   21.615  44.533    31.637  31.014    29.602  6.0057 2.1173 5.3080 2.0179 0.6976857      2.924846  
1 1 1 21 12 8  o 6.9003 1.4686 58.064   23.461  90.573    34.904  31.271    31.688  8.4483 2.0797 5.3523 2.0741 3.096014       2.937208  
1 1 1 21 12 9  o 7.1205 1.5354 67.794   23.769  76.363    35.666  60.947    31.881  7.4791 2.2221 6.7619 2.1193 0.7172775      3.070707  
1 1 1 21 12 10 o 7.1673 1.5391 70.213   24.063  78.264    34.885  62.905    33.234  7.5574 2.1846 6.7773 2.1686 0.7801013      3.078234  
1 1 1 21 12 11 o 8.4055 1.5034 95.238   25.360  105.298   36.436  85.786    35.319  8.9072 2.0826 7.9039 2.1687 1.003267       3.006747  
1 1 1 21 12 12 o 8.7977 1.5210 104.718  26.506  124.858   40.094  89.084    35.327  9.5852 2.1450 8.0101 2.1570 1.575096       3.042028  
1 1 1 21 12 13 o 8.2537 1.5822 100.964  26.961  91.778    39.790  108.761   36.659  7.6878 2.3608 8.8197 2.1071 -1.131888      3.164414  
1 1 1 21 12 14 o 5.0348 1.4322 31.996   24.553  0.3123    36.427  58.375    33.238  4.0350 1.8747 6.0347 2.1656 -1.999700      2.864317  
1 1 1 21 12 15 o 6.3764 1.5895 71.968   26.314  55.567    39.541  85.004    35.253  5.6003 2.2691 7.1524 2.2265 -1.552014      3.179006  
1 1 1 21 12 16 o 4.1983 1.3496 10.707   24.619  39.407    38.424  -9.2792   32.065  4.8839 2.1200 3.5127 1.6707 1.371236       2.699154  
1 1 1 21 12 17 o 4.4454 1.3988 31.140   24.875  37.609    37.489  26.052    33.248  4.6120 2.0447 4.2789 1.9095 0.3330593      2.797657  
1 1 1 21 12 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 0  o 2.5994 1.3035 -54.6183 27.453  -3.0898   39.474  -102.8921 38.207  3.2824 2.1923 1.9164 1.4108 -0.000000      0.000000  
1 1 1 21 13 1  o 3.8670 1.2415 -7.4521  21.054  -16.9877  29.541  2.3908    30.014  3.5795 1.6714 4.1545 1.8363 -0.5750041     2.483062  
1 1 1 21 13 2  o 5.5447 1.4309 34.779   21.400  50.416    30.499  19.615    30.034  6.2999 2.0820 4.7896 1.9635 1.510304       2.861817  
1 1 1 21 13 3  o 12.897 0.9904 184.108  25.444  201.021   35.927  167.088   36.039  13.557 1.3250 12.238 1.4725 1.319686       1.980871  
1 1 1 21 13 4  o 5.8912 1.4927 41.586   22.434  49.988    32.600  34.028    30.921  6.2973 2.1532 5.4851 2.0679 0.8121653      2.985330  
1 1 1 21 13 5  o 4.4462 1.3320 8.8086   21.441  -9.6818   31.732  24.342    29.084  3.9142 1.7936 4.9781 1.9698 -1.063933      2.664078  
1 1 1 21 13 6  o 5.9438 1.4307 41.372   21.976  68.102    32.031  17.598    30.208  7.2105 2.0959 4.6770 1.9481 2.533438       2.861476  
1 1 1 21 13 7  o 4.5867 1.3715 15.801   21.747  11.261    31.451  19.961    30.103  4.4507 1.9249 4.7227 1.9540 -0.2720156     2.742921  
1 1 1 21 13 8  o 4.0753 1.2712 -5.5000  21.761  24.749    31.325  -33.7128  30.253  4.9323 2.0117 3.2183 1.5545 1.713953       2.542343  
1 1 1 21 13 9  o 6.0873 1.5200 46.944   24.049  73.465    36.167  25.922    32.200  7.1970 2.2575 4.9775 2.0360 2.219503       3.040000  
1 1 1 21 13 10 o 11.549 1.2945 170.084  27.714  127.961   41.233  204.794   37.429  9.6888 2.1805 13.409 1.3957 -3.720033      2.588959  
1 1 1 21 13 11 o 5.0409 1.4463 20.032   24.212  59.864    37.721  -7.8765   31.574  6.2965 2.3002 3.7853 1.7540 2.511197       2.892694  
1 1 1 21 13 12 o 4.7935 1.4382 21.739   24.663  42.329    35.885  3.3068    33.952  5.4594 2.1792 4.1276 1.8775 1.331829       2.876496  
1 1 1 21 13 13 o 4.1536 1.3267 7.7670   24.043  31.993    35.244  -13.3206  32.882  4.7778 2.0519 3.5294 1.6823 1.248406       2.653368  
1 1 1 21 13 14 o 4.1667 1.3515 7.3936   25.369  24.909    38.607  -5.9157   33.654  4.6101 2.0575 3.7234 1.7530 0.8867142      2.703000  
1 1 1 21 13 15 o 3.7265 1.2528 -4.6704  24.975  1.8025    38.899  -9.2100   32.576  3.9360 1.8627 3.5170 1.6759 0.4190090      2.505631  
1 1 1 21 13 16 o 4.7314 1.4213 39.698   25.003  16.418    37.578  58.190    33.493  4.0589 1.8919 5.4039 2.1216 -1.344985      2.842602  
1 1 1 21 13 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 13 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 0  o 4.3048 1.7881 25.147   30.085  -16.7006  47.692  52.807    38.774  3.2705 2.2465 5.3391 2.7825 -0.000000      0.000000  
1 1 1 21 14 1  o 5.3824 1.4338 34.258   21.099  38.640    29.777  29.840    29.899  5.5955 2.0438 5.1693 2.0116 0.4261999      2.867649  
1 1 1 21 14 2  o 4.8041 1.2920 11.548   20.852  52.418    29.705  -28.1535  29.278  6.3298 2.0529 3.2784 1.5694 3.051417       2.584054  
1 1 1 21 14 3  o 6.3419 1.4900 53.536   22.113  50.705    31.535  56.274    31.016  6.1845 2.1177 6.4994 2.0966 -0.3149681     2.980007  
1 1 1 21 14 4  o 5.7369 1.4568 41.558   21.589  52.424    31.012  31.339    30.073  6.2710 2.1003 5.2029 2.0194 1.068122       2.913625  
1 1 1 21 14 5  o 3.9917 1.2636 -3.1185  21.791  -26.6052  33.308  14.456    28.813  3.5416 1.6895 4.4418 1.8795 -0.9001753     2.527268  
1 1 1 21 14 6  o 5.9719 1.4525 46.192   23.426  16.367    35.203  69.894    31.383  4.7262 2.0403 7.2176 2.0679 -2.491413      2.905021  
1 1 1 21 14 7  o 4.6125 1.4071 14.325   23.539  23.424    35.455  7.1528    31.477  4.9527 2.0897 4.2722 1.8848 0.6804948      2.814158  
1 1 1 21 14 8  o 3.9666 1.2941 -13.0785 24.027  13.440    36.611  -33.1408  31.844  4.6329 2.0388 3.3003 1.5943 1.332608       2.588163  
1 1 1 21 14 9  o 3.7468 1.2396 -12.1089 23.093  -9.6996   33.967  -14.1798  31.491  3.8613 1.7994 3.6323 1.7056 0.2289772      2.479274  
1 1 1 21 14 10 o 6.2400 1.5776 59.279   24.960  56.810    36.231  61.509    34.436  6.1016 2.2505 6.3783 2.2115 -0.2766232     3.155196  
1 1 1 21 14 11 o 3.5185 1.1853 -17.0520 23.050  -3.1094   33.503  -29.5825  31.761  3.8229 1.7834 3.2141 1.5619 0.6088669      2.370686  
1 1 1 21 14 12 o 4.2223 1.3199 4.0181   25.010  -43.5337  37.315  42.801    33.700  3.2468 1.6013 5.1978 2.0987 -1.951013      2.639834  
1 1 1 21 14 13 o 6.6764 1.6183 79.815   25.997  95.748    39.368  67.496    34.617  7.1982 2.3648 6.1545 2.2099 1.043630       3.236641  
1 1 1 21 14 14 o 7.2084 1.6118 97.252   26.584  115.015   38.105  80.409    37.106  8.0358 2.2706 6.3810 2.2883 1.654798       3.223654  
1 1 1 21 14 15 o 8.2561 1.5597 124.352  27.353  163.018   40.414  91.665    37.158  9.8753 2.1102 6.6369 2.2974 3.238409       3.119491  
1 1 1 21 14 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 14 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 0  o 6.1109 2.0659 63.829   34.086  113.269   50.492  22.433    46.202  8.1515 3.2198 4.0704 2.5893 -0.000000      0.000000  
1 1 1 21 15 1  o 6.7890 1.5672 64.451   24.726  75.549    35.401  53.880    34.550  7.3394 2.2214 6.2387 2.2112 1.100678       3.134334  
1 1 1 21 15 2  o 5.6738 1.5173 41.783   23.604  45.826    33.964  38.006    32.826  5.8537 2.1750 5.4939 2.1161 0.3598514      3.034508  
1 1 1 21 15 3  o 5.6426 1.5008 40.540   23.943  23.776    34.801  55.607    32.992  4.9465 2.0778 6.3387 2.1661 -1.392221      3.001566  
1 1 1 21 15 4  o 5.7656 1.4815 37.117   28.668  79.872    36.046  -36.4788  47.292  7.5030 2.2350 4.0281 1.9452 3.474923       2.962909  
1 1 1 21 15 5  o 10.122 1.2564 126.765  24.890  122.159   35.256  131.342   35.144  9.8123 1.8647 10.432 1.6844 -0.6196814     2.512826  
1 1 1 21 15 6  o 4.3020 1.3171 -1.1072  22.312  38.533    34.253  -30.3265  29.408  5.4226 2.1402 3.1814 1.5357 2.241215       2.634199  
1 1 1 21 15 7  o 5.6118 1.4841 39.483   24.171  70.133    35.564  13.171    32.952  6.8119 2.2481 4.4116 1.9380 2.400262       2.968116  
1 1 1 21 15 8  f 5.1185 1.4899 33.271   24.674  42.097    35.763  25.254    34.086  5.4412 2.1743 4.7959 2.0376 0.6452947      2.979836  
1 1 1 21 15 9  o 4.7504 1.3741 20.049   25.004  -31.4353  37.913  59.683    33.264  3.4708 1.6912 6.0300 2.1662 -2.559220      2.748161  
1 1 1 21 15 10 o 5.5757 1.5077 46.760   25.491  83.769    37.834  15.990    34.497  6.8651 2.3197 4.2862 1.9265 2.578849       3.015426  
1 1 1 21 15 11 o 4.6790 1.4275 24.421   24.953  53.381    37.782  2.0175    33.232  5.4919 2.2206 3.8662 1.7944 1.625609       2.854931  
1 1 1 21 15 12 o 3.8011 1.2593 -0.2896  24.228  15.615    34.897  -15.0905  33.664  4.1549 1.8952 3.4472 1.6587 0.7077100      2.518538  
1 1 1 21 15 13 o 3.5998 1.2123 -2.8414  23.933  1.1162    35.396  -6.1747   32.484  3.7160 1.7639 3.4835 1.6636 0.2325232      2.424646  
1 1 1 21 15 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 15 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 0  o 3.9487 1.8105 18.949   34.545  3.8045    51.569  31.278    46.528  3.6551 2.4608 4.2424 2.6564 -0.000000      0.000000  
1 1 1 21 16 1  o 6.7249 1.5648 66.737   24.612  55.863    34.149  78.490    35.503  6.1657 2.1969 7.2840 2.2289 -1.118301      3.129616  
1 1 1 21 16 2  o 9.8408 1.3345 125.966  25.695  135.818   36.198  115.959   36.481  10.441 1.7334 9.2402 2.0295 1.201178       2.669029  
1 1 1 21 16 3  o 8.0479 1.5241 92.276   24.937  102.711   37.368  83.898    33.483  8.4279 2.1951 7.6679 2.1148 0.7599673      3.048102  
1 1 1 21 16 4  o 3.6360 1.2206 -21.0801 23.879  -2.3741   35.607  -36.3694  32.191  4.0632 1.8757 3.2088 1.5624 0.8543859      2.441147  
1 1 1 21 16 5  o 4.9547 1.4313 22.041   24.424  59.496    36.398  -8.6363   32.941  6.1437 2.2572 3.7658 1.7606 2.377974       2.862651  
1 1 1 21 16 6  f 6.1686 1.5445 59.555   25.518  92.431    37.772  31.954    34.610  7.4658 2.3014 4.8713 2.0605 2.594504       3.089077  
1 1 1 21 16 7  o 6.0328 1.4170 59.773   24.638  13.429    38.368  92.296    32.141  4.2852 1.9668 7.7804 2.0404 -3.495163      2.833971  
1 1 1 21 16 8  o 5.3670 1.4697 43.374   25.545  7.8506    38.070  72.466    34.452  4.1831 1.9340 6.5508 2.2136 -2.367763      2.939484  
1 1 1 21 16 9  o 7.5610 1.6179 98.841   26.559  98.636    37.851  99.039    37.275  7.5227 2.3013 7.5992 2.2748 -0.7649136E-01 3.235898  
1 1 1 21 16 10 o 5.5368 1.5396 57.152   25.518  45.589    37.097  67.537    35.157  5.0644 2.1373 6.0091 2.2168 -0.9446959     3.079270  
1 1 1 21 16 11 o 3.8081 1.2245 2.0986   22.803  -40.3841  35.066  33.225    30.016  3.0600 1.5169 4.5563 1.9226 -1.496304      2.448994  
1 1 1 21 16 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 16 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 0  o 6.2659 1.9134 82.300   34.774  15.599    54.742  127.424   45.025  3.7241 2.5156 8.8077 2.8839 -0.000000      0.000000  
1 1 1 21 17 1  o 3.2018 1.1084 -34.7773 23.053  -16.0421  35.471  -48.4775  30.333  3.5841 1.7188 2.8196 1.4000 0.7645304      2.216851  
1 1 1 21 17 2  o 6.3773 1.5647 71.090   24.728  64.185    37.454  76.426    32.924  5.9480 2.2677 6.8066 2.1564 -0.8586650     3.129337  
1 1 1 21 17 3  o 3.3642 1.1373 -20.1205 22.431  -48.9561  35.074  -0.1630   29.179  3.0598 1.5169 3.6686 1.6951 -0.6087940     2.274699  
1 1 1 21 17 4  o 2.8314 0.9941 -49.9565 21.737  -63.7112  32.591  -38.9353  29.174  2.7653 1.3851 2.8975 1.4264 -0.1322048     1.988246  
1 1 1 21 17 5  o 4.1497 1.3074 1.5844   24.020  40.869    34.362  -35.9576  33.591  5.1200 2.0997 3.1794 1.5583 1.940567       2.614790  
1 1 1 21 17 6  o 5.8682 1.5573 60.822   25.300  74.891    35.893  46.928    35.668  6.4758 2.2571 5.2606 2.1463 1.215224       3.114589  
1 1 1 21 17 7  o 10.105 1.4129 152.979  27.537  161.848   39.204  144.341   38.687  10.508 1.9367 9.7006 2.0578 0.8079081      2.825840  
1 1 1 21 17 8  o 5.7140 1.4851 55.664   25.977  97.914    36.967  14.452    36.511  7.3031 2.2810 4.1248 1.9025 3.178299       2.970258  
1 1 1 21 17 9  o 3.9629 1.3052 9.6683   25.245  29.226    37.394  -6.7098   34.220  4.3932 1.9873 3.5326 1.6926 0.8606207      2.610382  
1 1 1 21 17 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 17 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 0  o 4.9504 2.1145 67.458   37.931  77.330    58.590  60.336    49.767  5.1269 3.1024 4.7740 2.8740 -0.000000      0.000000  
1 1 1 21 18 1  o 6.8628 1.5033 83.912   26.546  42.235    38.849  120.415   36.358  4.9826 2.1472 8.7429 2.1046 -3.760269      3.006633  
1 1 1 21 18 2  o 3.7990 1.2683 -1.6350  25.204  1.8149    36.348  -4.8301   34.979  3.8888 1.8281 3.7092 1.7585 0.1796288      2.536584  
1 1 1 21 18 3  o 4.2077 1.3431 16.697   24.233  29.648    34.758  4.4460    33.805  4.5566 1.9963 3.8589 1.7972 0.6976831      2.686120  
1 1 1 21 18 4  o 4.7487 1.4276 32.204   25.480  3.0990    36.243  60.651    35.830  3.8721 1.8219 5.6252 2.1984 -1.753103      2.855207  
1 1 1 21 18 5  o 3.4074 1.1680 -17.8358 24.782  -25.0942  36.080  -11.3531  34.098  3.3307 1.6287 3.4840 1.6746 -0.1533422     2.336037  
1 1 1 21 18 6  o 4.0691 1.3097 16.844   24.463  -5.4627   38.635  31.772    31.605  3.6785 1.7717 4.4598 1.9293 -0.7813938     2.619375  
1 1 1 21 18 7  o 5.6091 1.5761 68.213   26.327  75.898    39.199  61.897    35.534  5.7884 2.2880 5.4298 2.1682 0.3585844      3.152118  
1 1 1 21 18 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 18 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 0  o 3.1775 1.5713 -3.1583  35.529  18.262    55.859  -17.7121  46.043  3.5276 2.4251 2.8274 1.9988 -0.000000      0.000000  
1 1 1 21 19 1  o 3.6564 1.2178 -24.6435 24.913  44.599    36.359  -85.9242  34.205  4.7841 2.0694 2.5286 1.2843 2.255563       2.435532  
1 1 1 21 19 2  o 5.1222 1.4528 51.255   24.938  24.029    37.875  72.091    33.133  4.2115 1.9408 6.0330 2.1625 -1.821499      2.905671  
1 1 1 21 19 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 19 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 20 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 21 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 22 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 23 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 21 24 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 1  0  o 2.8680 1.7319 9.6783   18.181  0.0000    0.0000  9.6783    18.181  2.8680 1.7319 2.8680 1.7319 -0.000000      0.000000  
1 1 1 22 1  1  o 3.6164 1.0339 2.8823   12.987  -15.8120  18.819  19.879    17.944  2.8168 1.3213 4.4160 1.5905 -1.599173      2.067758  
1 1 1 22 1  2  o 15.371 0.6695 246.314  20.551  230.644   28.982  262.164   29.147  14.860 0.9752 15.881 0.9176 -1.021698      1.339041  
1 1 1 22 1  3  o 9.3421 0.8964 95.943   15.801  70.089    22.118  122.893   22.581  7.8826 1.4566 10.802 1.0453 -2.919077      1.792838  
1 1 1 22 1  4  o 8.1700 0.8410 72.065   13.634  64.541    19.710  78.968    18.878  7.7158 1.2772 8.6241 1.0945 -0.9082251     1.682053  
1 1 1 22 1  5  o 6.7952 1.3764 55.704   17.344  59.033    38.662  54.866    19.406  6.6642 2.3414 6.9261 1.4475 -0.2618189     2.752731  
1 1 1 22 1  6  o 6.8528 1.4042 54.468   17.139  67.047    40.706  51.757    18.895  6.9911 2.4055 6.7144 1.4495 0.2766628      2.808460  
1 1 1 22 1  7  o 8.1948 1.3784 85.148   18.207  75.761    44.921  86.993    19.916  7.3499 2.5271 9.0397 1.1016 -1.689720      2.756722  
1 1 1 22 1  8  o 7.0087 1.4617 50.266   18.235  93.377    42.078  40.297    20.234  8.2080 2.4070 5.8093 1.6591 2.398679       2.923385  
1 1 1 22 1  9  o 4.9922 1.4008 13.196   16.256  59.528    40.611  4.3560    17.739  6.5427 2.3872 3.4417 1.4663 3.100977       2.801584  
1 1 1 22 1  10 o 14.877 0.9298 224.493  22.903  281.339   50.658  209.888   25.677  15.605 1.6231 14.148 0.9074 1.456849       1.859581  
1 1 1 22 1  11 o 5.3160 1.4090 31.612   17.933  23.626    42.737  33.318    19.756  5.3171 2.2708 5.3148 1.6688 0.2320766E-02  2.818032  
1 1 1 22 1  12 o 4.5785 1.3593 -4.7236  17.611  51.600    40.550  -17.8176  19.551  6.3493 2.3731 2.8078 1.3263 3.541492       2.718523  
1 1 1 22 1  13 o 6.9000 1.4366 60.193   18.773  56.413    44.180  61.026    20.738  6.5067 2.4672 7.2933 1.4725 -0.7865648     2.873222  
1 1 1 22 1  14 o 8.0208 1.4505 78.684   20.052  87.465    46.699  76.699    22.203  7.7047 2.5774 8.3368 1.3316 -0.6320682     2.901030  
1 1 1 22 1  15 o 3.7090 1.2278 -9.9438  18.261  -26.8261  43.053  -6.2401   20.165  4.1799 1.9724 3.2381 1.4625 0.9417531      2.455502  
1 1 1 22 1  16 o 5.2823 1.3888 32.083   19.911  0.1359    43.315  40.642    22.421  4.7384 2.1415 5.8261 1.7688 -1.087774      2.777572  
1 1 1 22 1  17 o 6.7485 1.5645 41.900   19.966  101.684   47.656  29.172    21.989  8.4349 2.5826 5.0620 1.7665 3.372931       3.128907  
1 1 1 22 1  18 o 4.2179 1.2114 6.4836   19.427  -75.8262  41.643  29.380    21.963  3.3484 1.6587 5.0874 1.7660 -1.739046      2.422813  
1 1 1 22 1  19 o 7.6314 1.2869 72.011   18.989  69.831    24.191  75.511    30.651  7.6287 1.6347 7.6341 1.9879 -0.5357742E-02 2.573720  
1 1 1 22 1  20 o 3.7567 1.1738 0.3249   17.207  -7.8658   22.517  11.821    26.676  3.2878 1.5082 4.2256 1.7991 -0.9377482     2.347620  
1 1 1 22 1  21 o 3.5152 1.0909 -2.8512  16.498  16.481    20.890  -34.8934  26.895  4.1168 1.6559 2.9135 1.4207 1.203248       2.181794  
1 1 1 22 1  22 o 6.0387 1.4218 57.415   20.016  56.849    26.156  58.216    31.094  6.1378 1.9189 5.9395 2.0985 0.1982946      2.843582  
1 1 1 22 1  23 o 4.0329 1.2620 15.412   20.157  19.790    25.827  8.5885    32.239  4.1346 1.7655 3.9312 1.8038 0.2033451      2.524033  
1 1 1 22 1  24 o 4.0916 1.2769 20.949   20.106  12.838    26.098  32.792    31.538  3.7351 1.6775 4.4480 1.9257 -0.7128668     2.553870  
1 1 1 22 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 1  30 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 2  0  o 12.820 1.0167 171.811  25.690  0.0000    0.0000  171.811   25.690  12.820 1.0167 12.820 1.0167 -0.000000      0.000000  
1 1 1 22 2  1  o 9.1088 1.2853 111.504  18.614  75.925    39.972  121.356   21.034  7.4724 2.3770 10.745 0.9787 -3.272746      2.570606  
1 1 1 22 2  2  o 5.5873 1.3743 34.082   16.010  42.312    37.132  32.203    17.744  5.9146 2.2573 5.2600 1.5684 0.6545582      2.748648  
1 1 1 22 2  3  o 7.6822 1.3174 78.718   18.427  55.078    39.775  85.178    20.793  6.4623 2.3618 8.9020 1.1679 -2.439656      2.634809  
1 1 1 22 2  4  o 6.8920 1.3553 58.602   17.086  57.144    38.788  58.953    19.032  6.5572 2.3409 7.2268 1.3668 -0.6696591     2.710697  
1 1 1 22 2  5  o 12.051 1.0846 161.332  20.958  166.216   45.778  160.036   23.574  11.750 1.9480 12.352 0.9542 -0.6017637     2.169120  
1 1 1 22 2  6  o 4.6391 1.3267 19.593   16.166  0.3995    43.170  22.723    17.434  4.7237 2.1361 4.5546 1.5739 0.1690865      2.653317  
1 1 1 22 2  7  o 9.5629 1.3172 106.851  19.769  119.493   44.538  103.749   22.061  9.3034 2.3831 9.8223 1.1230 -0.5189161     2.634428  
1 1 1 22 2  8  o 7.9614 1.4310 77.944   18.838  84.766    47.034  76.641    20.560  7.5380 2.5862 8.3849 1.2260 -0.8468246     2.862039  
1 1 1 22 2  9  o 9.0086 1.3693 118.861  20.172  69.356    46.296  130.462   22.412  6.9248 2.5455 11.092 1.0102 -4.167624      2.738618  
1 1 1 22 2  10 o 11.177 1.2623 151.703  21.264  139.063   46.456  155.053   23.917  10.227 2.3240 12.126 0.9862 -1.898314      2.524560  
1 1 1 22 2  11 o 6.0225 1.4610 42.378   18.568  45.443    42.792  41.667    20.609  6.1164 2.3991 5.9286 1.6679 0.1877441      2.921968  
1 1 1 22 2  12 f 5.5826 1.3526 39.349   18.071  7.0961    43.876  45.938    19.832  4.9128 2.1929 6.2524 1.5841 -1.339631      2.705201  
1 1 1 22 2  13 o 10.634 1.3709 149.405  21.542  119.462   48.469  156.776   24.048  9.0924 2.5579 12.176 0.9875 -3.083740      2.741878  
1 1 1 22 2  14 o 4.7827 1.4241 11.969   18.035  36.543    43.783  6.9475    19.793  5.8206 2.3767 3.7449 1.5697 2.075669       2.848264  
1 1 1 22 2  15 o 5.1349 1.3832 28.852   18.521  3.4625    44.379  34.206    20.380  4.8671 2.1866 5.4027 1.6947 -0.5356107     2.766418  
1 1 1 22 2  16 o 5.3667 1.3187 35.346   19.344  -20.9632  45.127  48.022    21.411  4.3648 2.0470 6.3687 1.6630 -2.003867      2.637388  
1 1 1 22 2  17 o 4.8349 1.4556 10.830   19.525  41.401    45.844  4.0558    21.579  5.9543 2.4317 3.7155 1.6007 2.238858       2.911268  
1 1 1 22 2  18 o 4.8590 1.4145 -7.7564  19.570  68.442    44.085  -26.4577  21.840  6.9420 2.4938 2.7760 1.3358 4.165957       2.829004  
1 1 1 22 2  19 o 4.3798 1.3821 6.6610   20.139  16.368    45.416  4.2848    22.469  5.0347 2.2404 3.7248 1.6190 1.309948       2.764139  
1 1 1 22 2  20 o 3.9581 1.6608 11.101   22.194  0.0000    0.0000  11.101    22.194  ?      ?      3.9581 1.6608 ?              ?         
1 1 1 22 2  21 o 5.2464 1.4048 39.523   21.251  9.2545    46.387  47.563    23.908  4.5979 2.1290 5.8948 1.8333 -1.296949      2.809527  
1 1 1 22 2  22 o 5.2836 1.3981 45.557   22.566  3.0456    49.531  56.693    25.350  4.3486 2.0706 6.2186 1.8793 -1.869972      2.796234  
1 1 1 22 2  23 o 3.4769 1.1641 -5.7051  21.785  -55.3719  45.957  8.6894    24.741  3.3181 1.6594 3.6357 1.6330 -0.3175437     2.328201  
1 1 1 22 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 3  0  o 2.7369 1.3394 -21.0310 25.082  -18.6868  35.836  -23.2823  35.117  2.7973 1.9279 2.6765 1.8599 -0.000000      0.000000  
1 1 1 22 3  1  o 3.6981 1.1765 -9.1416  18.991  9.1692    26.864  -27.4370  26.852  4.2377 1.8049 3.1584 1.5095 1.079350       2.352921  
1 1 1 22 3  2  o 16.267 0.7704 281.434  25.057  288.718   35.479  274.185   35.393  16.489 1.0759 16.044 1.1030 0.4441833      1.540779  
1 1 1 22 3  3  o 14.443 0.7144 220.541  19.645  217.486   33.047  222.210   24.431  14.247 1.1598 14.639 0.8345 -0.3911018     1.428760  
1 1 1 22 3  4  f 3.6887 1.2000 -5.0798  16.164  -6.0897   37.245  -4.8455   17.941  4.2934 1.9582 3.0840 1.3875 1.209457       2.399909  
1 1 1 22 3  5  o 11.131 1.0701 127.757  19.896  166.313   43.671  117.658   22.350  11.759 1.8570 10.503 1.0640 1.255807       2.140182  
1 1 1 22 3  6  o 19.218 0.9225 435.549  27.916  353.686   58.463  459.727   31.772  17.358 1.6840 21.077 0.7537 -3.719229      1.844988  
1 1 1 22 3  7  o 12.368 1.2117 191.452  21.878  155.788   47.420  201.096   24.660  10.875 2.2542 13.862 0.8895 -2.986494      2.423392  
1 1 1 22 3  8  o 9.6734 1.3707 134.279  20.629  84.480    46.101  146.747   23.067  7.5640 2.5607 11.783 0.9789 -4.218666      2.741380  
1 1 1 22 3  9  o 5.0400 1.3867 26.333   17.844  16.735    41.694  28.485    19.743  5.0949 2.2099 4.9851 1.6758 0.1098447      2.773450  
1 1 1 22 3  10 o 6.9517 1.5116 50.509   18.903  88.022    44.793  42.380    20.851  7.9290 2.5156 5.9744 1.6766 1.954557       3.023112  
1 1 1 22 3  11 o 13.798 1.0981 223.355  22.926  198.056   51.462  229.618   25.607  12.738 2.0200 14.858 0.8617 -2.119536      2.196105  
1 1 1 22 3  12 o 3.7271 1.2412 -10.5973 17.289  -4.2072   42.760  -11.8461  18.903  4.5439 2.0822 2.9103 1.3516 1.633609       2.482374  
1 1 1 22 3  13 o 4.4822 1.3611 11.886   18.750  7.1492    42.206  13.050    20.929  4.8586 2.1610 4.1058 1.6553 0.7528195      2.722126  
1 1 1 22 3  14 o 6.9663 1.5105 61.264   20.694  56.650    48.030  62.315    22.931  6.6125 2.5561 7.3200 1.6101 -0.7074890     3.020924  
1 1 1 22 3  15 o 5.2027 1.3898 30.142   19.150  2.5568    44.126  36.544    21.257  4.8408 2.1770 5.5646 1.7283 -0.7238450     2.779675  
1 1 1 22 3  16 f 4.8526 1.4578 8.8270   19.224  46.915    46.101  0.8101    21.150  6.1503 2.4648 3.5550 1.5574 2.595357       2.915556  
1 1 1 22 3  17 o 4.6792 1.3671 17.864   20.014  -17.4602  45.903  26.156    22.239  4.4653 2.0845 4.8931 1.7694 -0.4277558     2.734265  
1 1 1 22 3  18 o 6.0711 1.2667 53.065   20.567  -14.1363  43.209  72.750    23.386  4.2887 2.0087 7.8535 1.5439 -3.564778      2.533484  
1 1 1 22 3  19 o 9.7050 1.4464 141.255  23.129  92.617    50.867  153.932   25.968  7.4889 2.6799 11.921 1.0892 -4.432013      2.892805  
1 1 1 22 3  20 o 7.4886 1.5122 78.967   21.337  86.717    48.165  77.075    23.800  7.0337 2.5947 7.9435 1.5537 -0.9098172     3.024313  
1 1 1 22 3  21 o 6.2380 1.5873 47.280   21.700  127.235   48.262  27.020    24.294  7.9669 2.6183 4.5091 1.7952 3.457841       3.174652  
1 1 1 22 3  22 o 4.3679 1.4022 18.108   21.938  40.471    50.057  12.791    24.407  4.8976 2.2474 3.8383 1.6775 1.059226       2.804374  
1 1 1 22 3  23 o 6.4379 1.4991 90.154   26.271  62.015    51.792  99.901    30.483  4.9743 2.2838 7.9015 1.9426 -2.927169      2.998256  
1 1 1 22 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 3  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 4  0  o 6.1055 1.9768 63.890   29.901  93.774    42.192  33.737    42.382  7.7389 2.9138 4.4722 2.6723 -0.000000      0.000000  
1 1 1 22 4  1  o 12.207 0.9563 165.926  22.978  134.681   32.370  197.659   32.622  10.922 1.4819 13.491 1.2090 -2.569786      1.912507  
1 1 1 22 4  2  o 4.2488 1.2844 9.8756   19.369  10.463    27.025  9.2556    27.773  4.2539 1.8110 4.2438 1.8220 0.1010227E-01  2.568875  
1 1 1 22 4  3  o 4.4090 1.3067 13.786   19.501  18.819    27.405  8.6243    27.754  4.6061 1.8805 4.2118 1.8150 0.3943291      2.613491  
1 1 1 22 4  4  o 7.5379 1.2382 69.359   20.168  33.725    28.019  107.669   29.052  5.3358 1.9769 9.7400 1.4914 -4.404206      2.476342  
1 1 1 22 4  5  o 5.7758 1.3245 37.212   19.740  9.8554    27.297  67.202    28.581  4.2530 1.8155 7.2987 1.9289 -3.045750      2.648913  
1 1 1 22 4  6  o 8.7469 1.1212 107.746  17.260  44.060    29.461  141.027   21.297  5.9047 2.0456 11.589 0.9188 -5.684442      2.242480  
1 1 1 22 4  7  o 9.7250 1.2778 105.057  19.801  129.492   44.073  98.877    22.164  9.8707 2.2787 9.5793 1.1569 0.2913828      2.555525  
1 1 1 22 4  8  o 10.878 1.2952 146.996  21.048  126.847   46.319  152.239   23.628  9.7226 2.3972 12.034 0.9817 -2.311108      2.590408  
1 1 1 22 4  9  o 4.9306 1.3804 23.933   18.290  12.211    41.088  26.830    20.426  4.9654 2.1731 4.8958 1.7029 0.6954002E-01  2.760786  
1 1 1 22 4  10 o 10.288 1.3300 117.808  21.038  144.059   48.815  111.820   23.314  10.357 2.4030 10.219 1.1408 0.1388741      2.660040  
1 1 1 22 4  11 o 7.7011 1.3193 89.370   20.621  31.634    45.446  104.339   23.140  5.5808 2.3609 9.8213 1.1781 -4.240472      2.638536  
1 1 1 22 4  12 o 9.7826 1.3928 115.357  20.703  119.213   48.769  114.509   22.865  9.1997 2.5580 10.366 1.1029 -1.165877      2.785611  
1 1 1 22 4  13 o 7.6182 1.5019 61.557   20.101  100.866   45.137  51.833    22.450  8.6102 2.4838 6.6263 1.6890 1.983830       3.003702  
1 1 1 22 4  14 o 4.9646 1.3433 26.138   19.018  -19.2025  45.502  35.735    20.935  4.4199 2.0673 5.5092 1.7158 -1.089306      2.686628  
1 1 1 22 4  15 o 9.3671 1.4214 123.765  21.856  81.359    48.626  134.501   24.467  7.4923 2.6262 11.242 1.0882 -3.749604      2.842722  
1 1 1 22 4  16 o 4.8985 1.4366 20.382   21.071  5.7135    45.849  24.309    23.725  4.9726 2.2290 4.8244 1.8128 0.1481543      2.873125  
1 1 1 22 4  17 o 8.6589 1.4801 99.018   22.455  94.896    49.181  100.103   25.239  7.8280 2.6448 9.4899 1.3298 -1.661896      2.960297  
1 1 1 22 4  18 o 11.057 1.4677 162.059  25.390  149.822   54.465  165.456   28.699  9.8103 2.6937 12.305 1.1662 -2.494428      2.935323  
1 1 1 22 4  19 o 7.0912 1.5581 70.373   21.871  78.218    51.142  68.617    24.195  6.7603 2.6308 7.4222 1.6703 -0.6618509     3.116215  
1 1 1 22 4  20 o 4.0025 1.3174 -0.6930  20.161  21.936    45.429  -6.2428   22.498  4.7801 2.1734 3.2248 1.4895 1.555337       2.634800  
1 1 1 22 4  21 o 6.3223 1.5893 62.752   22.157  91.344    51.185  56.159    24.579  6.4246 2.5892 6.2200 1.8439 0.2046061      3.178659  
1 1 1 22 4  22 o 5.2508 1.5235 35.563   21.959  104.428   46.746  16.063    24.875  6.6070 2.5300 3.8946 1.6980 2.712408       3.046968  
1 1 1 22 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 5  0  o 3.9127 1.7195 18.749   27.976  2.3055    42.054  31.802    37.468  3.4864 2.3071 4.3389 2.5502 -0.000000      0.000000  
1 1 1 22 5  1  o 11.586 1.0266 151.046  23.541  176.424   33.712  126.895   32.888  12.638 1.3338 10.535 1.5608 2.102545       2.053113  
1 1 1 22 5  2  o 4.1046 1.2372 2.3976   19.579  24.121    26.322  -24.5092  29.294  4.8363 1.8859 3.3728 1.6020 1.463562       2.474466  
1 1 1 22 5  3  o 7.5008 1.3756 71.240   20.840  75.095    29.236  67.257    29.716  7.7503 1.9006 7.2514 1.9891 0.4989133      2.751180  
1 1 1 22 5  4  o 11.003 1.0143 135.872  22.318  134.872   31.697  136.856   31.429  10.952 1.4471 11.054 1.4216 -0.1015739     2.028548  
1 1 1 22 5  5  o 6.3115 1.3773 49.743   19.961  32.969    28.236  66.501    28.222  5.3332 1.9828 7.2897 1.9120 -1.956469      2.754513  
1 1 1 22 5  6  o 5.5062 1.3797 34.940   19.588  47.005    27.600  22.697    27.804  6.1537 1.9770 4.8587 1.9249 1.294999       2.759323  
1 1 1 22 5  7  o 10.986 1.0291 134.078  22.606  137.181   32.392  131.132   31.563  11.108 1.4581 10.864 1.4526 0.2435722      2.058164  
1 1 1 22 5  8  o 6.3272 1.4353 50.208   20.576  48.453    28.815  52.034    29.390  6.2271 2.0220 6.4273 2.0375 -0.2001653     2.870569  
1 1 1 22 5  9  o 4.9224 1.2391 27.894   17.600  -29.4850  40.766  41.039    19.513  3.9596 1.8834 5.8852 1.6108 -1.925574      2.478288  
1 1 1 22 5  10 o 7.1530 1.4802 62.535   19.549  74.666    44.332  59.607    21.781  7.1906 2.5083 7.1154 1.5724 0.7516241E-01  2.960382  
1 1 1 22 5  11 o 6.8513 1.3342 64.890   19.772  24.490    44.057  75.079    22.126  5.4204 2.3100 8.2821 1.3357 -2.861699      2.668424  
1 1 1 22 5  12 o 11.429 1.3630 167.184  22.901  133.716   50.554  175.825   25.688  9.9112 2.5390 12.947 0.9920 -3.036107      2.725909  
1 1 1 22 5  13 f 3.9494 1.2708 -2.0834  19.251  -27.7848  43.706  4.1030    21.443  4.1714 1.9742 3.7275 1.6006 0.4439695      2.541545  
1 1 1 22 5  14 o 4.6041 1.3844 14.891   19.237  1.4954    45.338  17.832    21.244  4.8348 2.1875 4.3734 1.6973 0.4614410      2.768771  
1 1 1 22 5  15 o 4.2228 1.3035 7.2407   19.414  -31.5616  45.338  15.953    21.483  4.1641 1.9822 4.2815 1.6933 -0.1174006     2.607041  
1 1 1 22 5  16 o 5.2743 1.2672 35.349   19.283  -41.9861  47.123  50.903    21.133  4.0276 1.9441 6.5210 1.6260 -2.493385      2.534481  
1 1 1 22 5  17 o 4.3350 1.3112 10.404   21.375  -50.9047  47.897  25.650    23.885  3.8809 1.8931 4.7890 1.8145 -0.9081287     2.622304  
1 1 1 22 5  18 o 6.2307 1.3796 58.648   22.388  1.8152    49.095  73.569    25.156  4.7352 2.1918 7.7262 1.6762 -2.990922      2.759224  
1 1 1 22 5  19 o 4.8540 1.4076 28.279   21.211  0.4530    49.762  34.458    23.447  4.5739 2.1465 5.1341 1.8214 -0.5602064     2.815141  
1 1 1 22 5  20 o 7.3770 1.6304 70.423   22.512  153.091   51.042  50.460    25.083  8.9207 2.6601 5.8332 1.8858 3.087502       3.260749  
1 1 1 22 5  21 o 5.6341 1.5260 52.694   21.540  74.639    47.968  47.151    24.107  5.7363 2.4261 5.5318 1.8518 0.2045426      3.052051  
1 1 1 22 5  22 o 3.3540 1.1484 -7.8335  20.590  -21.8473  45.704  -4.2652   23.062  3.5910 1.7712 3.1170 1.4623 0.4740238      2.296873  
1 1 1 22 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 5  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 6  0  o 4.3160 1.8364 27.556   29.918  8.9134    43.655  44.067    41.083  3.7167 2.4215 4.9153 2.7614 -0.000000      0.000000  
1 1 1 22 6  1  o 6.5061 1.4205 53.605   20.847  40.433    29.579  66.607    29.387  5.7472 2.0450 7.2651 1.9720 -1.517843      2.840901  
1 1 1 22 6  2  f 3.6449 1.1772 -9.1216  19.205  -15.2545  27.145  -2.9758   27.174  3.4668 1.6132 3.8230 1.7147 -0.3561532     2.354317  
1 1 1 22 6  3  o 8.9610 1.2525 95.343   21.962  81.076    31.108  109.522   31.011  8.0914 1.9461 9.8306 1.5773 -1.739185      2.504982  
1 1 1 22 6  4  o 6.3917 1.2645 46.877   20.668  87.258    28.714  3.4605    29.774  8.5866 1.7318 4.1968 1.8429 4.389808       2.528912  
1 1 1 22 6  5  o 13.245 0.9143 191.061  24.180  202.295   34.148  179.765   34.243  13.672 1.2489 12.818 1.3357 0.8537178      1.828612  
1 1 1 22 6  6  o 6.2133 1.4281 48.176   20.321  48.352    29.273  48.013    28.233  6.2173 2.0390 6.2093 2.0001 0.7994175E-02  2.856155  
1 1 1 22 6  7  o 12.329 0.9762 167.433  23.870  196.511   34.675  141.244   32.908  13.417 1.2922 11.242 1.4636 2.174820       1.952428  
1 1 1 22 6  8  o 7.3210 1.2542 66.452   21.050  105.928   29.388  24.860    30.165  9.6604 1.5210 4.9816 1.9947 4.678742       2.508455  
1 1 1 22 6  9  o 4.6172 1.3093 15.032   20.031  -8.2933   29.314  35.463    27.436  3.7804 1.7292 5.4540 1.9664 -1.673589      2.618586  
1 1 1 22 6  10 o 4.9414 1.3209 16.160   21.088  -19.9067  30.581  48.859    29.118  3.6028 1.6882 6.2800 2.0320 -2.677171      2.641818  
1 1 1 22 6  11 o 4.8963 1.3648 16.766   21.325  42.543    30.783  -7.0182   29.569  5.9213 2.0884 3.8713 1.7576 2.050003       2.729565  
1 1 1 22 6  12 o 15.324 1.2303 309.272  26.237  202.925   56.058  339.100   29.689  12.544 2.3199 18.103 0.8200 -5.559447      2.460574  
1 1 1 22 6  13 o 5.8892 1.4828 29.656   19.249  76.225    41.420  16.828    21.739  7.4386 2.4247 4.3397 1.7075 3.098939       2.965603  
1 1 1 22 6  14 o 9.0525 1.4685 106.250  22.072  96.313    50.109  108.642   24.585  8.0849 2.6685 10.020 1.2268 -1.935158      2.936987  
1 1 1 22 6  15 o 6.5098 1.4838 53.665   20.213  54.695    42.496  53.364    22.979  6.3823 2.4198 6.6372 1.7178 -0.2549186     2.967537  
1 1 1 22 6  16 o 10.554 1.4380 142.451  23.688  141.484   52.219  142.701   26.580  9.6615 2.6313 11.446 1.1611 -1.784258      2.876089  
1 1 1 22 6  17 o 3.7615 1.2761 -20.0059 20.218  3.2177    46.560  -25.4025  22.444  4.7100 2.1636 2.8130 1.3537 1.897098       2.552183  
1 1 1 22 6  18 o 3.9113 1.2617 1.0459   20.860  -40.2536  46.783  11.294    23.305  3.8544 1.8782 3.9682 1.6853 -0.1138353     2.523482  
1 1 1 22 6  19 f 3.3075 1.1383 -17.8370 20.424  -48.5957  47.295  -10.7858  22.644  3.5644 1.7660 3.0507 1.4368 0.5136998      2.276685  
1 1 1 22 6  20 o 3.8000 1.2839 -3.0300  20.928  13.591    49.618  -6.6267   23.082  4.4330 2.0996 3.1670 1.4784 1.265987       2.567844  
1 1 1 22 6  21 o 6.2005 1.1016 72.051   22.893  -64.8286  51.666  105.492   25.537  3.3596 1.6910 9.0413 1.4122 -5.681703      2.203176  
1 1 1 22 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  0  o 2.8451 1.3857 -28.4253 27.421  -68.5673  41.387  2.9818    36.609  2.3442 1.6945 3.3460 2.1930 -0.000000      0.000000  
1 1 1 22 7  1  o 4.2934 1.2255 -0.3841  19.459  37.019    27.391  -38.4927  27.649  5.5855 1.9700 3.0014 1.4583 2.584096       2.451016  
1 1 1 22 7  2  o 4.5485 1.2783 12.983   18.838  -7.9586   26.275  35.135    27.023  3.6202 1.6486 5.4769 1.9540 -1.856685      2.556598  
1 1 1 22 7  3  o 4.9350 1.3639 23.470   19.921  13.071    28.407  33.534    27.945  4.4715 1.8777 5.3984 1.9787 -0.9269686     2.727829  
1 1 1 22 7  4  o 7.3224 1.4197 67.677   21.431  64.017    30.088  71.445    30.534  7.1084 2.0208 7.5364 1.9946 -0.4279871     2.839395  
1 1 1 22 7  5  o 13.660 0.8829 202.796  24.117  198.121   33.836  207.623   34.384  13.495 1.2536 13.824 1.2436 -0.3287172     1.765821  
1 1 1 22 7  6  f 6.6668 1.4484 57.453   21.219  53.502    29.952  61.435    30.066  6.4367 2.0586 6.8969 2.0381 -0.4601731     2.896848  
1 1 1 22 7  7  o 10.742 1.1597 135.674  23.667  106.097   33.670  164.561   33.274  9.3001 1.8749 12.185 1.3654 -2.884743      2.319414  
1 1 1 22 7  8  o 3.0863 1.0492 -32.2808 19.125  -21.4728  26.440  -44.1404  27.697  3.2681 1.5433 2.9045 1.4217 0.3635783      2.098313  
1 1 1 22 7  9  o 4.6801 1.3690 15.480   21.091  7.9206    30.186  22.690    29.480  4.4014 1.8947 4.9588 1.9765 -0.5574217     2.738005  
1 1 1 22 7  10 o 8.9644 1.3561 98.261   23.627  83.739    33.236  113.097   33.594  8.1651 2.0409 9.7638 1.7862 -1.598749      2.712119  
1 1 1 22 7  11 o 10.393 1.1478 122.819  23.815  127.023   33.190  118.357   34.191  10.623 1.5622 10.164 1.6820 0.4586763      2.295583  
1 1 1 22 7  12 o 9.1829 1.3533 103.187  24.059  115.135   34.500  91.875    33.569  9.7886 1.8295 8.5773 1.9946 1.211218       2.706539  
1 1 1 22 7  13 o 3.7868 1.2159 -20.1682 21.677  14.484    30.887  -53.8003  30.429  4.6304 1.9519 2.9432 1.4505 1.687269       2.431851  
1 1 1 22 7  14 o 6.5014 1.2323 62.511   20.004  -17.3291  47.407  79.805    22.064  4.4734 2.0980 8.5294 1.2934 -4.056073      2.464642  
1 1 1 22 7  15 o 5.5513 1.4426 39.835   20.745  14.250    47.536  45.854    23.057  5.0546 2.2675 6.0480 1.7841 -0.9933710     2.885180  
1 1 1 22 7  16 o 4.0928 1.3277 0.8177   20.394  -6.8378   47.177  2.5772    22.617  4.5340 2.1155 3.6515 1.6048 0.8825102      2.655312  
1 1 1 22 7  17 o 5.7323 1.5459 43.140   21.473  55.137    49.393  40.344    23.844  5.9378 2.4836 5.5268 1.8415 0.4109812      3.091888  
1 1 1 22 7  18 o 4.2061 1.2410 13.431   21.277  -64.1777  44.328  36.662    24.253  3.3276 1.6588 5.0846 1.8464 -1.756975      2.482091  
1 1 1 22 7  19 o 4.6440 1.3826 29.277   21.994  -1.0940   51.142  36.169    24.362  4.2918 2.0597 4.9961 1.8449 -0.7042599     2.765165  
1 1 1 22 7  20 o 3.1438 1.1085 -29.9366 19.781  -5.5966   43.083  -36.4384  22.267  3.8506 1.8588 2.4371 1.2083 1.413550       2.216952  
1 1 1 22 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 7  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  0  o 4.6984 1.8198 31.572   28.438  -3.1639   40.310  65.991    40.125  3.3027 2.2088 6.0941 2.8928 -0.000000      0.000000  
1 1 1 22 8  1  o 8.3531 1.3442 86.663   22.001  95.565    31.012  77.643    31.216  8.8794 1.8077 7.8268 1.9898 1.052656       2.688370  
1 1 1 22 8  2  o 9.9240 1.1946 115.747  22.921  96.078    31.871  136.821   32.990  8.8495 1.8598 10.999 1.4997 -2.149026      2.389149  
1 1 1 22 8  3  o 8.9575 1.3091 98.105   23.096  117.461   32.855  79.196    32.474  10.078 1.6300 7.8369 2.0488 2.241371       2.618142  
1 1 1 22 8  4  o 4.7352 1.3449 18.592   20.337  2.3813    28.989  34.304    28.539  4.0773 1.8033 5.3930 1.9957 -1.315664      2.689744  
1 1 1 22 8  5  o 4.0835 1.2598 3.9291   19.519  -2.7276   27.470  10.717    27.740  3.8406 1.7232 4.3265 1.8381 -0.4858453     2.519582  
1 1 1 22 8  6  f 4.8556 1.3489 16.901   20.874  42.029    29.885  -7.0384   29.170  5.8740 2.0588 3.8372 1.7435 2.036768       2.697849  
1 1 1 22 8  7  o 5.6056 1.2739 19.276   21.622  77.376    31.699  -31.2695  29.567  7.9168 2.0011 3.2945 1.5771 4.622263       2.547863  
1 1 1 22 8  8  o 4.9865 1.4087 23.077   21.471  15.187    31.107  30.256    29.672  4.6873 1.9665 5.2857 2.0177 -0.5983734     2.817467  
1 1 1 22 8  9  o 5.4743 1.3911 30.781   21.941  0.4308    32.356  56.616    29.853  4.2435 1.8895 6.7052 2.0423 -2.461671      2.782250  
1 1 1 22 8  10 o 8.0302 1.4439 81.364   23.288  75.679    33.654  86.587    32.258  7.6860 2.1203 8.3744 1.9606 -0.6883893     2.887861  
1 1 1 22 8  11 o 5.2390 1.4291 28.792   21.878  14.928    31.487  41.734    30.422  4.6555 1.9671 5.8225 2.0737 -1.166969      2.858268  
1 1 1 22 8  12 o 8.0563 1.4821 83.120   24.136  76.765    36.258  88.177    32.343  7.6508 2.2317 8.4618 1.9510 -0.8110127     2.964294  
1 1 1 22 8  13 o 4.5702 1.3891 12.424   22.997  5.7261    34.361  17.858    30.950  4.4337 1.9620 4.7067 1.9671 -0.2729278     2.778290  
1 1 1 22 8  14 o 4.2944 1.3468 3.7571   23.357  -8.5749   32.912  16.270    33.153  3.9208 1.8076 4.6679 1.9970 -0.7471449     2.693586  
1 1 1 22 8  15 o 6.3812 1.4450 44.095   26.461  105.547   38.552  -10.6425  36.385  8.7459 2.2047 4.0164 1.8686 4.729475       2.890013  
1 1 1 22 8  16 o 6.9472 1.3805 75.603   22.108  30.453    50.951  86.075    24.538  5.2965 2.3637 8.5979 1.4270 -3.301397      2.761075  
1 1 1 22 8  17 o 4.6674 1.4293 24.749   22.188  17.768    50.811  26.394    24.664  4.7501 2.2093 4.5847 1.8140 0.1654568      2.858648  
1 1 1 22 8  18 o 4.4309 1.4286 10.163   21.709  54.033    50.279  0.1101    24.069  5.4037 2.3831 3.4582 1.5761 1.945456       2.857131  
1 1 1 22 8  19 o 5.5450 1.2995 55.476   21.923  -6.7160   46.826  72.935    24.810  3.9629 1.9189 7.1270 1.7528 -3.164120      2.598949  
1 1 1 22 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 8  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  0  o 9.4710 1.9889 124.465  32.627  129.390   49.020  120.548   43.717  9.5241 2.9407 9.4179 2.6788 -0.000000      0.000000  
1 1 1 22 9  1  o 5.5486 1.4138 33.589   20.880  16.968    28.407  53.121    30.794  4.6305 1.9053 6.4667 2.0894 -1.836175      2.827657  
1 1 1 22 9  2  o 4.5069 1.3372 12.133   20.717  22.184    28.921  1.5408    29.690  4.8828 1.9539 4.1310 1.8261 0.7518749      2.674340  
1 1 1 22 9  3  o 5.0320 1.3754 22.076   21.074  42.273    29.510  1.0558    30.106  5.9113 2.0473 4.1527 1.8371 1.758571       2.750713  
1 1 1 22 9  4  o 4.2855 1.2993 7.5001   19.927  9.8297    28.654  5.3180    27.732  4.3938 1.8675 4.1772 1.8071 0.2165542      2.598674  
1 1 1 22 9  5  o 4.2064 1.2787 4.8873   19.792  16.300    28.003  -6.5031   27.976  4.6175 1.8948 3.7953 1.7176 0.8221991      2.557466  
1 1 1 22 9  6  o 4.0548 1.2738 -1.4926  20.928  -11.5361  29.572  8.5846    29.622  3.7397 1.7202 4.3700 1.8790 -0.6302934     2.547524  
1 1 1 22 9  7  o 4.7432 1.3966 16.615   22.031  11.688    31.702  21.216    30.638  4.5813 1.9562 4.9051 1.9938 -0.3238692     2.793184  
1 1 1 22 9  8  o 7.3616 1.4706 67.973   23.371  91.551    34.140  47.178    32.061  8.5700 2.0241 6.1533 2.1338 2.416698       2.941124  
1 1 1 22 9  9  o 12.234 1.0373 167.635  25.187  146.053   35.575  189.326   35.665  11.352 1.5670 13.117 1.3595 -1.765009      2.074539  
1 1 1 22 9  10 o 6.1734 1.4411 42.893   23.708  79.986    34.040  7.9514    33.039  7.8640 2.1173 4.4827 1.9556 3.381321       2.882215  
1 1 1 22 9  11 o 7.9435 1.4983 80.491   24.243  86.592    35.162  74.963    33.471  8.2356 2.1217 7.6513 2.1161 0.5843472      2.996582  
1 1 1 22 9  12 o 4.7074 1.3768 11.894   23.019  -16.1779  32.366  40.628    32.746  3.7284 1.7438 5.6864 2.1311 -1.958071      2.753605  
1 1 1 22 9  13 o 4.1049 1.3275 -4.2821  24.389  -6.9297   36.088  -2.0561   33.091  4.1142 1.8954 4.0955 1.8593 0.1872540E-01  2.655099  
1 1 1 22 9  14 o 8.0168 1.4929 91.432   27.679  41.815    40.043  136.828   38.302  5.6686 2.2881 10.365 1.9183 -4.696427      2.985881  
1 1 1 22 9  15 f 4.4522 1.3878 5.7507   25.433  34.743    36.398  -21.9093  35.551  5.2379 2.1561 3.6664 1.7481 1.571454       2.775684  
1 1 1 22 9  16 o 9.4634 1.4563 134.703  28.078  87.737    40.876  176.663   38.636  7.1033 2.4111 11.823 1.6339 -4.720070      2.912585  
1 1 1 22 9  17 o 4.0806 1.3318 3.8511   25.278  20.803    37.920  -9.7058   33.911  4.5005 2.0216 3.6607 1.7344 0.8397999      2.663622  
1 1 1 22 9  18 o 5.8514 1.3526 62.957   21.109  21.746    53.690  70.493    22.958  4.5244 2.1547 7.1783 1.6356 -2.653882      2.705153  
1 1 1 22 9  19 o 4.1276 1.3009 22.756   22.083  -9.1331   50.476  30.304    24.558  3.8475 1.8906 4.4078 1.7874 -0.5603292     2.601801  
1 1 1 22 9  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 9  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 0  o 5.3157 2.0335 51.712   30.225  50.237    44.782  52.945    40.961  5.2311 2.9038 5.4004 2.8474 -0.000000      0.000000  
1 1 1 22 10 1  o 4.0169 1.2527 -1.9179  19.918  -14.5623  26.903  13.423    29.632  3.4816 1.6154 4.5523 1.9151 -1.070702      2.505355  
1 1 1 22 10 2  o 4.5507 1.3313 11.246   20.903  -8.4569   29.912  30.053    29.224  3.8438 1.7538 5.2575 2.0035 -1.413702      2.662639  
1 1 1 22 10 3  o 6.9665 1.4623 61.475   21.904  67.915    31.552  55.484    30.431  7.3131 2.0660 6.6199 2.0699 0.6931162      2.924533  
1 1 1 22 10 4  o 10.358 1.1463 121.920  23.743  123.624   33.432  120.186   33.725  10.447 1.6000 10.269 1.6420 0.1782427      2.292681  
1 1 1 22 10 5  o 3.6628 1.2020 -15.6256 21.168  -21.8694  30.575  -9.8779   29.336  3.5522 1.6719 3.7734 1.7274 -0.2212255     2.404039  
1 1 1 22 10 6  o 17.313 0.8279 324.724  28.129  258.762   39.956  389.541   39.608  15.419 1.2957 19.206 1.0311 -3.787485      1.655876  
1 1 1 22 10 7  o 13.773 0.9598 208.364  26.377  215.611   38.880  202.184   35.904  13.962 1.3924 13.585 1.3215 0.3768625      1.919657  
1 1 1 22 10 8  o 5.3369 1.4069 29.863   22.339  1.1214    34.240  51.167    29.478  4.3281 1.9342 6.3458 2.0436 -2.017671      2.813811  
1 1 1 22 10 9  o 4.6947 1.3815 13.679   22.518  -6.4240   33.900  29.553    30.124  4.1318 1.8782 5.2576 2.0265 -1.125787      2.763015  
1 1 1 22 10 10 o 5.3644 1.4699 31.241   22.863  44.321    33.235  19.490    31.500  5.9243 2.1599 4.8045 1.9943 1.119780       2.939774  
1 1 1 22 10 11 o 13.430 1.0507 207.117  28.031  193.165   40.906  219.469   38.488  12.883 1.5876 13.978 1.3767 -1.095461      2.101417  
1 1 1 22 10 12 o 5.9418 1.5602 43.918   25.725  70.791    38.444  22.129    34.616  6.9841 2.3385 4.8994 2.0659 2.084732       3.120331  
1 1 1 22 10 13 o 5.7785 1.5557 43.767   25.849  62.271    36.603  25.359    36.508  6.5461 2.2794 5.0109 2.1177 1.535180       3.111356  
1 1 1 22 10 14 o 4.0349 1.3255 -5.5917  25.628  -5.1142   38.255  -5.9805   34.519  4.1230 1.9174 3.9469 1.8307 0.1761208      2.651054  
1 1 1 22 10 15 o 5.0159 1.4638 30.868   26.563  -5.4860   39.310  61.416    36.034  3.9911 1.8838 6.0407 2.2411 -2.049603      2.927639  
1 1 1 22 10 16 o 3.7105 1.2372 -17.2209 24.074  20.575    36.502  -46.3146  32.026  4.4698 1.9973 2.9512 1.4606 1.518596       2.474387  
1 1 1 22 10 17 o 4.9169 1.4823 40.750   26.352  27.174    39.715  51.427    35.222  4.5178 2.0454 5.3159 2.1459 -0.7981200     2.964565  
1 1 1 22 10 18 o 5.1314 1.5355 55.349   27.060  67.336    40.654  45.814    36.260  5.4240 2.2597 4.8389 2.0797 0.5851245      3.071059  
1 1 1 22 10 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 10 25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 0  o 4.8401 1.8802 34.273   29.738  68.081    42.426  1.6159    41.697  6.1887 2.9704 3.4914 2.3060 -0.000000      0.000000  
1 1 1 22 11 1  o 11.785 1.0117 153.410  23.803  141.926   32.729  166.305   34.681  11.305 1.4476 12.266 1.4138 -0.9606810     2.023397  
1 1 1 22 11 2  o 7.9249 1.4363 79.486   22.996  88.123    32.041  70.311    33.024  8.4604 1.9356 7.3894 2.1225 1.070974       2.872541  
1 1 1 22 11 3  o 6.6622 1.4370 54.661   22.941  84.381    32.642  25.654    32.248  8.2045 2.0060 5.1199 2.0580 3.084628       2.873974  
1 1 1 22 11 4  o 10.009 1.2416 118.597  24.157  107.610   34.669  128.965   33.679  9.3721 1.9143 10.647 1.5817 -1.274494      2.483205  
1 1 1 22 11 5  o 4.3581 1.3185 3.7546   21.362  27.445    31.577  -16.2347  29.006  5.1556 2.0486 3.5606 1.6605 1.594971       2.637003  
1 1 1 22 11 6  o 4.6535 1.3244 -0.0922  22.158  48.154    33.136  -39.1196  29.802  6.1689 2.1676 3.1381 1.5222 3.030790       2.648708  
1 1 1 22 11 7  o 6.0164 1.3858 40.615   22.150  6.4612    31.844  72.629    30.831  4.4073 1.9214 7.6254 1.9977 -3.218092      2.771688  
1 1 1 22 11 8  o 5.6663 1.4452 32.180   23.372  67.618    34.470  2.0243    31.797  7.1168 2.1993 4.2158 1.8754 2.901030       2.890316  
1 1 1 22 11 9  o 3.8260 1.2522 -13.5841 23.248  -33.6492  35.260  1.8467    30.921  3.5319 1.6990 4.1200 1.8399 -0.5881796     2.504318  
1 1 1 22 11 10 o 6.3516 1.5757 56.224   25.213  45.703    37.968  64.524    33.723  5.8704 2.2717 6.8327 2.1843 -0.9622273     3.151449  
1 1 1 22 11 11 o 14.845 1.0035 251.361  29.787  251.261   42.606  251.457   41.660  14.819 1.4376 14.872 1.4006 -0.5345440E-01 2.007070  
1 1 1 22 11 12 o 5.9823 1.6093 49.673   27.001  68.631    40.179  34.062    36.461  6.6858 2.3829 5.2789 2.1637 1.406909       3.218699  
1 1 1 22 11 13 f 4.8091 1.4754 21.336   26.851  6.0612    38.555  35.724    37.418  4.3784 1.9952 5.2398 2.1741 -0.8613515     2.950846  
1 1 1 22 11 14 o 4.5719 1.4099 17.705   25.586  51.269    37.651  -11.0918  34.875  5.4743 2.2156 3.6695 1.7444 1.804867       2.819879  
1 1 1 22 11 15 o 6.8792 1.3579 65.185   26.576  143.169   38.604  -5.0724   36.642  9.9060 2.0171 3.8524 1.8184 6.053615       2.715749  
1 1 1 22 11 16 o 5.3468 1.5594 53.628   26.795  64.917    40.730  45.015    35.577  5.6388 2.2962 5.0549 2.1105 0.5839243      3.118823  
1 1 1 22 11 17 o 3.2972 1.1413 -22.1724 25.096  -19.7511  37.383  -24.1590  33.861  3.3929 1.6588 3.2015 1.5681 0.1913738      2.282688  
1 1 1 22 11 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 11 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 0  o 2.2054 1.1358 -77.3935 27.721  -52.6114  40.184  -99.8943  38.290  2.4676 1.7659 1.9432 1.4288 -0.000000      0.000000  
1 1 1 22 12 1  o 6.1272 1.5252 47.125   23.216  45.762    32.649  48.518    33.019  6.0577 2.1492 6.1967 2.1645 -0.1390576     3.050304  
1 1 1 22 12 2  o 4.5810 1.3762 11.250   22.363  22.164    31.355  -0.0503   31.905  4.9617 2.0169 4.2002 1.8728 0.7615366      2.752329  
1 1 1 22 12 3  o 4.4685 1.3605 7.7772   22.088  -1.1168   29.860  18.526    32.825  4.0597 1.8108 4.8774 2.0311 -0.8177104     2.721077  
1 1 1 22 12 4  o 5.2254 1.4423 25.379   22.832  45.258    32.758  6.5994    31.840  6.0447 2.1520 4.4060 1.9210 1.638638       2.884640  
1 1 1 22 12 5  o 5.3952 1.3635 21.592   22.606  67.524    32.924  -19.3773  31.094  7.1774 2.1355 3.6131 1.6960 3.564241       2.727068  
1 1 1 22 12 6  o 4.9510 1.4171 20.652   23.602  -6.1544   35.330  42.257    31.719  4.1324 1.8932 5.7697 2.1091 -1.637277      2.834155  
1 1 1 22 12 7  o 4.5447 1.3622 10.291   23.356  -20.1834  35.965  32.515    30.713  3.8245 1.8041 5.2649 2.0415 -1.440423      2.724452  
1 1 1 22 12 8  o 4.1069 1.3009 -2.7188  23.026  -25.0883  33.697  16.875    31.537  3.5887 1.7085 4.6250 1.9622 -1.036238      2.601774  
1 1 1 22 12 9  f 4.1435 1.3248 -0.7095  23.484  8.1786    34.398  -8.4688   32.139  4.4250 1.9603 3.8620 1.7825 0.5630574      2.649597  
1 1 1 22 12 10 o 4.3115 1.3457 -3.1243  25.277  -44.8636  37.344  32.168    34.339  3.4144 1.6669 5.2087 2.1132 -1.794324      2.691458  
1 1 1 22 12 11 o 3.9711 1.3098 -8.8984  25.443  -0.1311   37.562  -16.3317  34.586  4.2167 1.9393 3.7255 1.7610 0.4911506      2.619561  
1 1 1 22 12 12 o 4.0011 1.3015 -3.2951  24.673  -24.1532  36.060  15.066    33.833  3.5863 1.7234 4.4159 1.9508 -0.8296664     2.603021  
1 1 1 22 12 13 f 5.4446 1.4389 36.139   25.477  91.666    37.435  -11.7652  34.771  7.2580 2.2994 3.6311 1.7306 3.626877       2.877875  
1 1 1 22 12 14 o 4.9435 1.4835 37.807   26.117  25.055    39.634  47.594    34.721  4.5757 2.0600 5.3112 2.1353 -0.7355561     2.967027  
1 1 1 22 12 15 o 3.8450 1.2908 -2.3544  26.593  16.488    39.872  -17.4529  35.691  4.2273 1.9631 3.4628 1.6764 0.7645004      2.581537  
1 1 1 22 12 16 f 3.9961 1.3124 6.3605   25.666  45.963    38.766  -24.5481  34.247  4.7867 2.1024 3.2055 1.5715 1.581242       2.624851  
1 1 1 22 12 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 12 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 0  o 6.8482 2.2465 87.586   34.642  78.350    51.020  95.486    47.186  6.2834 3.2122 7.4131 3.1416 -0.000000      0.000000  
1 1 1 22 13 1  o 4.9344 1.3597 12.951   23.035  -28.6466  32.475  55.071    32.679  3.4658 1.6575 6.4029 2.1560 -2.937120      2.719442  
1 1 1 22 13 2  o 6.7187 1.5205 60.443   23.936  79.648    34.299  42.211    33.420  7.6902 2.1476 5.7472 2.1531 1.943014       3.041087  
1 1 1 22 13 3  o 2.8764 1.0061 -59.4549 21.522  -87.3292  30.916  -33.2470  29.978  2.5391 1.2818 3.2138 1.5511 -0.6746957     2.012196  
1 1 1 22 13 4  o 4.0707 1.2528 -12.7088 22.340  31.470    30.967  -60.6599  32.262  5.2143 2.0421 2.9270 1.4517 2.287324       2.505541  
1 1 1 22 13 5  o 5.4200 1.4766 34.036   23.426  51.492    33.517  17.365    32.755  6.1555 2.1783 4.6844 1.9940 1.471087       2.953124  
1 1 1 22 13 6  o 3.5481 1.1853 -23.0685 22.370  -6.0177   31.971  -39.4242  31.312  3.9220 1.7983 3.1742 1.5445 0.7477140      2.370550  
1 1 1 22 13 7  f 5.4690 1.5140 35.654   24.288  52.244    36.507  22.479    32.533  6.1068 2.2577 4.8312 2.0178 1.275630       3.028002  
1 1 1 22 13 8  o 7.0790 1.6192 74.140   26.173  71.651    39.698  76.054    34.809  6.8655 2.3748 7.2925 2.2018 -0.4269505     3.238411  
1 1 1 22 13 9  o 6.2984 1.3905 31.455   26.173  121.703   40.782  -31.7490  34.129  9.1860 2.2400 3.4107 1.6483 5.775310       2.781092  
1 1 1 22 13 10 o 5.3819 1.3282 25.236   24.158  -41.1078  35.852  80.414    32.696  3.3185 1.6229 7.4454 2.1031 -4.126896      2.656421  
1 1 1 22 13 11 o 4.1374 1.3314 10.159   24.347  2.2441    35.718  17.028    33.275  3.9789 1.8512 4.2959 1.9142 -0.3169975     2.662893  
1 1 1 22 13 12 o 9.4155 1.5359 136.100  28.254  142.400   41.874  130.834   38.282  9.5070 2.2392 9.3240 2.1030 0.1829920      3.071873  
1 1 1 22 13 13 o 12.543 1.2500 212.302  29.780  275.615   44.848  162.368   39.828  14.610 1.5348 10.475 1.9735 4.135421       2.500091  
1 1 1 22 13 14 o 7.9804 1.5823 116.682  27.837  152.195   40.193  83.942    38.592  9.6073 2.1460 6.3535 2.3258 3.253844       3.164545  
1 1 1 22 13 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 13 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 0  o 5.1033 2.0383 50.998   32.853  35.923    47.473  64.851    45.510  4.5020 2.7567 5.7045 3.0031 -0.000000      0.000000  
1 1 1 22 14 1  o 8.6289 1.4931 99.658   25.764  119.900   37.633  81.801    35.347  9.5867 2.0262 7.6710 2.1936 1.915665       2.986192  
1 1 1 22 14 2  o 5.4602 1.5069 36.451   24.038  47.777    34.748  26.058    33.288  5.9276 2.2004 4.9929 2.0594 0.9347053      3.013776  
1 1 1 22 14 3  o 7.0641 1.5749 70.804   24.845  73.362    35.914  68.456    34.407  7.1646 2.2500 6.9635 2.2043 0.2011137      3.149813  
1 1 1 22 14 4  o 7.7597 1.7477 97.202   31.547  104.964   37.486  78.361    58.401  8.7536 2.1555 6.7658 2.7517 1.987861       3.495445  
1 1 1 22 14 5  o 4.9987 1.4680 27.224   24.119  25.515    36.070  28.607    32.437  4.9771 2.1043 5.0202 2.0473 -0.4304266E-01 2.935907  
1 1 1 22 14 6  o 5.5944 1.5573 43.534   25.770  37.067    38.089  48.993    34.996  5.3521 2.2046 5.8367 2.2000 -0.4846106     3.114577  
1 1 1 22 14 7  o 7.4739 1.5497 83.364   26.084  56.865    36.940  109.717   36.837  6.1066 2.2684 8.8412 2.1122 -2.734615      3.099500  
1 1 1 22 14 8  o 8.6928 1.5268 110.520  26.434  107.831   38.255  112.978   36.569  8.4794 2.2271 8.9062 2.0891 -0.4267359     3.053567  
1 1 1 22 14 9  o 5.5051 1.5410 51.460   25.400  44.800    37.014  57.388    34.919  5.2293 2.1655 5.7809 2.1931 -0.5515165     3.082029  
1 1 1 22 14 10 f 3.3315 1.1523 -34.7309 24.550  -13.2423  38.315  -49.6968  31.976  3.7602 1.7988 2.9029 1.4407 0.8573039      2.304637  
1 1 1 22 14 11 o 5.6728 1.4758 42.108   26.160  104.833   39.877  -5.2748   34.659  7.6171 2.3675 3.7284 1.7626 3.888705       2.951521  
1 1 1 22 14 12 o 4.0387 1.3100 4.6799   26.253  -37.6762  40.138  36.348    34.706  3.3410 1.6501 4.7365 2.0352 -1.395516      2.620096  
1 1 1 22 14 13 o 7.4481 1.5848 106.127  27.124  143.132   39.906  74.351    36.979  8.9925 2.2298 5.9036 2.2527 3.088901       3.169677  
1 1 1 22 14 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 14 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 0  o 3.6073 1.6881 8.8355   32.117  -6.5498   51.775  18.458    40.946  3.4568 2.3655 3.7579 2.4089 -0.000000      0.000000  
1 1 1 22 15 1  o 11.327 1.2212 160.616  26.289  125.930   36.934  196.237   37.429  9.7163 1.9681 12.938 1.4465 -3.221769      2.442468  
1 1 1 22 15 2  o 10.218 1.2885 133.321  25.663  150.792   37.290  117.602   35.372  11.039 1.6890 9.3958 1.9463 1.643462       2.576966  
1 1 1 22 15 3  o 5.1971 1.4739 35.268   23.408  31.297    34.644  38.603    31.753  5.0567 2.0946 5.3375 2.0741 -0.2808118     2.947717  
1 1 1 22 15 4  o 6.6255 1.5551 65.732   24.381  82.835    36.051  51.318    33.097  7.3729 2.2440 5.8782 2.1535 1.494740       3.110186  
1 1 1 22 15 5  o 4.5770 1.3793 21.810   22.770  8.3701    35.161  31.518    29.882  4.2416 1.9221 4.9124 1.9788 -0.6708012     2.758670  
1 1 1 22 15 6  o 4.4106 1.3990 15.593   25.613  34.406    38.530  0.6981    34.285  4.9101 2.1271 3.9111 1.8177 0.9990733      2.797940  
1 1 1 22 15 7  f 4.7772 1.4745 30.542   26.419  43.264    40.033  20.726    35.164  5.1322 2.1950 4.4222 1.9693 0.7100310      2.948922  
1 1 1 22 15 8  f 4.1903 1.3463 6.2699   26.029  -23.7010  38.391  31.766    35.409  3.5850 1.7364 4.7955 2.0580 -1.210433      2.692630  
1 1 1 22 15 9  o 5.7235 1.5553 54.806   26.567  91.655    40.031  25.799    35.517  6.9331 2.3855 4.5139 1.9962 2.419145       3.110509  
1 1 1 22 15 10 o 5.4491 1.5058 44.704   26.578  98.519    40.612  4.3874    35.151  7.0200 2.4032 3.8783 1.8150 3.141664       3.011582  
1 1 1 22 15 11 o 3.3533 1.1538 -28.4530 24.618  13.633    36.290  -64.3294  33.506  4.0014 1.8631 2.7052 1.3616 1.296279       2.307646  
1 1 1 22 15 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 15 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 0  o 5.3336 2.1525 71.935   36.823  94.089    53.881  52.519    50.441  6.0705 3.2465 4.5966 2.8273 -0.000000      0.000000  
1 1 1 22 16 1  o 5.1972 1.4704 37.468   25.761  74.270    36.938  2.6187    35.945  6.4233 2.2853 3.9711 1.8507 2.452287       2.940717  
1 1 1 22 16 2  o 3.7875 1.2571 -7.2790  24.457  15.240    35.545  -27.5256  33.704  4.2724 1.9346 3.3026 1.6059 0.9697809      2.514289  
1 1 1 22 16 3  o 4.9203 1.4747 34.250   26.071  15.545    37.654  51.474    36.133  4.3449 1.9767 5.4958 2.1890 -1.150891      2.949394  
1 1 1 22 16 4  o 6.1462 1.6015 66.105   25.803  71.837    38.971  61.630    34.430  6.2767 2.3302 6.0158 2.1976 0.2608743      3.203048  
1 1 1 22 16 5  o 5.3458 1.4966 42.667   24.124  70.296    37.505  23.169    31.507  6.2429 2.2916 4.4488 1.9254 1.794127       2.993101  
1 1 1 22 16 6  o 5.9513 1.5616 62.242   24.840  78.881    37.339  49.033    33.270  6.5362 2.3006 5.3663 2.1121 1.169894       3.123114  
1 1 1 22 16 7  o 5.0187 1.4628 38.065   24.733  68.021    37.077  14.049    33.199  5.9465 2.2589 4.0910 1.8592 1.855443       2.925636  
1 1 1 22 16 8  o 3.7888 1.2509 -6.8265  25.021  -47.2958  35.877  31.498    34.914  3.0343 1.5093 4.5434 1.9954 -1.509014      2.501896  
1 1 1 22 16 9  o 4.6981 1.4515 36.311   26.860  66.519    39.246  9.6938    36.840  5.4859 2.2462 3.9103 1.8389 1.575635       2.902936  
1 1 1 22 16 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 16 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 0  o 5.5840 2.0072 36.258   35.435  156.195   59.577  -29.3956  44.079  8.4619 3.5249 2.7061 1.9211 -0.000000      0.000000  
1 1 1 22 17 1  o 7.7320 1.5792 103.365  25.998  94.193    37.196  112.127   36.353  7.2058 2.2930 8.2581 2.1720 -1.052310      3.158384  
1 1 1 22 17 2  o 4.4787 1.3900 26.681   24.173  17.633    34.888  35.036    33.525  4.2179 1.9127 4.7396 2.0174 -0.5217385     2.779947  
1 1 1 22 17 3  o 3.1030 1.0800 -35.5342 23.640  -40.2703  33.934  -31.0679  32.953  3.0598 1.5124 3.1462 1.5423 -0.8639622E-01 2.160058  
1 1 1 22 17 4  o 3.5814 1.2057 -22.5252 24.452  27.087    36.125  -64.4764  33.219  4.4382 1.9848 2.7246 1.3693 1.713603       2.411336  
1 1 1 22 17 5  o 4.2051 1.3458 15.304   25.028  45.374    36.890  -10.3402  34.067  4.9221 2.1061 3.4882 1.6759 1.433903       2.691556  
1 1 1 22 17 6  o 4.2297 1.3510 15.887   25.732  53.538    37.424  -17.8746  35.439  5.0923 2.1477 3.3671 1.6394 1.725218       2.701910  
1 1 1 22 17 7  o 5.7506 1.5852 71.624   26.958  91.424    38.976  53.464    37.327  6.4527 2.3411 5.0486 2.1379 1.404116       3.170412  
1 1 1 22 17 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 17 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 0  o 4.4846 1.9992 62.886   37.984  62.674    58.500  63.040    49.943  4.3988 2.8424 4.5703 2.8121 -0.000000      0.000000  
1 1 1 22 18 1  o 4.8525 1.4908 47.889   26.936  46.630    38.479  49.098    37.719  4.8077 2.1035 4.8973 2.1131 -0.8960772E-01 2.981589  
1 1 1 22 18 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 18 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 19 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 20 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 21 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 22 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 22 23 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 1  0  o 4.3597 2.0708 30.782   20.565  0.0000    0.0000  30.782    20.565  4.3597 2.0708 4.3597 2.0708 -0.000000      0.000000  
1 1 1 23 1  1  f 9.6501 0.8862 101.778  16.848  82.815    23.756  120.968   23.898  8.6640 1.3710 10.636 1.1234 -1.972059      1.772475  
1 1 1 23 1  2  o 6.5469 1.1483 51.118   15.102  59.152    20.904  42.347    21.842  7.1585 1.5077 5.9353 1.7323 1.223202       2.296573  
1 1 1 23 1  3  o 3.9009 1.1184 7.3449   14.386  -6.1010   19.949  21.915    20.766  3.2097 1.4517 4.5921 1.7018 -1.382354      2.236859  
1 1 1 23 1  4  o 5.5798 1.1439 35.123   14.252  20.116    19.352  52.909    21.069  4.4384 1.6432 6.7213 1.5919 -2.282866      2.287832  
1 1 1 23 1  5  o 3.4634 1.1264 -7.8683  16.932  -51.7106  38.021  2.9773    18.911  3.4433 1.6812 3.4834 1.4996 -0.4006124E-01 2.252862  
1 1 1 23 1  6  o 5.5471 1.4043 38.037   18.453  23.658    42.936  41.294    20.437  5.2522 2.2604 5.8420 1.6671 -0.5897961     2.808615  
1 1 1 23 1  7  o 3.6171 1.2176 -12.1138 16.630  -10.9489  43.523  -12.3129  17.995  4.4216 2.0526 2.8126 1.3104 1.609005       2.435184  
1 1 1 23 1  8  o 3.4327 1.1698 -17.9400 16.167  -12.0678  40.949  -19.0244  17.597  4.2873 1.9905 2.5780 1.2293 1.709291       2.339531  
1 1 1 23 1  9  o 9.9593 1.3766 150.562  21.548  75.059    47.332  170.302   24.201  7.1917 2.5839 12.727 0.9508 -5.535094      2.753278  
1 1 1 23 1  10 o 10.165 1.3943 141.239  21.232  99.329    48.327  151.263   23.635  8.3337 2.6089 11.997 0.9851 -3.662980      2.788672  
1 1 1 23 1  11 o 9.0320 1.4230 112.577  20.582  80.272    49.159  119.443   22.664  7.4542 2.6380 10.610 1.0681 -3.155473      2.846060  
1 1 1 23 1  12 o 3.5626 1.1567 -8.6310  18.396  -89.2226  46.241  6.5228    20.051  3.4111 1.6994 3.7140 1.5695 -0.3029001     2.313335  
1 1 1 23 1  13 o 5.3458 1.2840 36.385   18.549  -26.5158  45.874  48.679    20.281  4.2631 2.0190 6.4284 1.5870 -2.165320      2.568074  
1 1 1 23 1  14 o 11.362 1.3027 145.563  22.401  161.042   51.242  141.906   24.907  11.136 2.3733 11.588 1.0747 -0.4522266     2.605325  
1 1 1 23 1  15 o 7.7063 1.5035 79.732   22.061  58.517    54.076  83.968    24.163  6.6701 2.6707 8.7424 1.3819 -2.072311      3.007081  
1 1 1 23 1  16 o 5.6276 1.5408 23.346   19.718  71.853    47.485  13.239    21.674  7.1085 2.5833 4.1467 1.6801 2.961765       3.081527  
1 1 1 23 1  17 o 5.1032 1.5026 10.379   20.256  56.445    47.725  0.2568    22.371  6.5712 2.5457 3.6352 1.5969 2.935999       3.005141  
1 1 1 23 1  18 f 4.5212 1.4001 11.917   20.789  8.2626    46.184  12.846    23.281  4.8936 2.2115 4.1487 1.7176 0.7449346      2.800207  
1 1 1 23 1  19 o 4.4172 1.4182 0.1054   21.444  30.068    48.561  -7.1524   23.900  5.4278 2.3693 3.4067 1.5594 2.021102       2.836420  
1 1 1 23 1  20 o 6.0311 1.5781 46.917   21.262  71.571    50.032  41.484    23.488  6.4564 2.5744 5.6059 1.8258 0.8504953      3.156181  
1 1 1 23 1  21 o 3.8699 1.2762 3.2711   21.311  -8.9282   47.483  6.3483    23.848  4.0955 1.9705 3.6443 1.6224 0.4511957      2.552480  
1 1 1 23 1  22 o 4.7740 1.3323 26.212   19.906  2.9280    25.743  60.840    31.393  3.5720 1.6287 5.9760 2.1089 -2.404019      2.664579  
1 1 1 23 1  23 o 3.3928 1.1316 -5.3644  18.992  -17.2362  23.868  15.127    31.357  2.8598 1.3812 3.9258 1.7929 -1.065974      2.263252  
1 1 1 23 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 1  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  0  o 15.536 0.9722 250.312  29.937  0.0000    0.0000  250.312   29.937  15.536 0.9722 15.536 0.9722 -0.000000      0.000000  
1 1 1 23 2  1  o 3.5672 1.0597 4.7407   12.985  12.002    18.884  -1.7730   17.885  3.9336 1.5771 3.2007 1.4160 0.7329209      2.119485  
1 1 1 23 2  2  o 7.1338 1.3644 65.917   18.773  52.013    41.235  69.553    21.084  6.3095 2.3857 7.9580 1.3247 -1.648513      2.728813  
1 1 1 23 2  3  o 4.8976 1.3762 10.921   16.969  56.365    38.478  -0.0510   18.907  6.4557 2.3285 3.3394 1.4675 3.116214       2.752367  
1 1 1 23 2  4  o 7.6441 1.3564 76.508   18.435  64.801    41.955  79.309    20.522  6.7521 2.4320 8.5360 1.2021 -1.783906      2.712878  
1 1 1 23 2  5  o 7.3759 1.3601 73.987   18.785  51.960    43.690  78.982    20.806  6.2380 2.4304 8.5139 1.2219 -2.275928      2.720294  
1 1 1 23 2  6  o 5.2910 1.3215 34.759   17.594  2.8411    41.486  41.759    19.428  4.6613 2.1022 5.9206 1.6019 -1.259354      2.642982  
1 1 1 23 2  7  o 7.3508 1.3182 77.977   18.434  37.596    44.815  86.200    20.224  5.7503 2.3821 8.9514 1.1297 -3.201101      2.636392  
1 1 1 23 2  8  o 6.7967 1.3419 62.941   19.103  30.399    43.833  70.571    21.225  5.5695 2.3353 8.0239 1.3226 -2.454434      2.683852  
1 1 1 23 2  9  o 9.5775 1.3053 83.617   20.064  169.355   47.509  65.006    22.134  11.638 2.1192 7.5171 1.5244 4.120759       2.610536  
1 1 1 23 2  10 o 8.1115 1.4595 87.720   20.060  70.296    51.676  90.811    21.766  7.0327 2.6679 9.1904 1.1842 -2.157689      2.918938  
1 1 1 23 2  11 o 7.4719 1.5338 61.543   20.054  100.413   47.151  52.960    22.157  8.2987 2.5735 6.6451 1.6694 1.653574       3.067540  
1 1 1 23 2  12 o 4.0381 1.3116 -6.0199  18.099  12.676    43.379  -9.9602   19.915  5.0115 2.2117 3.0647 1.4104 1.946768       2.623157  
1 1 1 23 2  13 o 5.9756 1.5428 30.880   19.116  72.795    46.456  22.336    20.974  7.2966 2.5664 4.6546 1.7130 2.641980       3.085554  
1 1 1 23 2  14 o 4.3377 1.3660 5.8303   18.991  -1.2139   47.198  7.1910    20.744  4.8598 2.2118 3.8155 1.6036 1.044258       2.731933  
1 1 1 23 2  15 o 3.9090 1.2511 -1.5031  19.225  -72.0865  51.132  10.118    20.747  3.8674 1.9009 3.9507 1.6272 -0.8331537E-01 2.502233  
1 1 1 23 2  16 o 5.9352 1.4009 47.039   20.476  0.3140    49.919  56.490    22.451  4.9650 2.2655 6.9054 1.6485 -1.940430      2.801741  
1 1 1 23 2  17 o 4.9877 1.4431 24.490   20.926  8.4695    47.255  28.398    23.339  4.9878 2.2471 4.9877 1.8113 0.1010895E-03  2.886209  
1 1 1 23 2  18 o 6.8053 1.6064 44.448   22.563  120.738   49.783  24.727    25.311  8.8400 2.6250 4.7706 1.8524 4.069415       3.212797  
1 1 1 23 2  19 o 9.2903 1.5313 119.441  23.648  118.435   54.626  119.673   26.234  8.2434 2.7874 10.337 1.2689 -2.093818      3.062613  
1 1 1 23 2  20 o 7.1586 1.6560 64.311   22.555  127.608   52.490  49.977    24.979  8.2970 2.7308 6.0203 1.8742 2.276690       3.312043  
1 1 1 23 2  21 o 3.5136 1.1950 -11.3630 21.042  -32.0575  47.598  -6.3365   23.459  3.7933 1.8582 3.2339 1.5031 0.5593436      2.390063  
1 1 1 23 2  22 o 3.8395 1.2804 4.3708   22.550  2.9164    47.983  4.7831    25.547  4.1146 1.9800 3.5643 1.6241 0.5503528      2.560885  
1 1 1 23 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 2  29 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 3  0  o 3.0359 1.4582 -14.3289 27.503  -37.5613  40.508  5.5392    37.461  2.6621 1.8806 3.4097 2.2290 -0.000000      0.000000  
1 1 1 23 3  1  o 5.7539 1.3296 36.818   20.860  69.667    29.029  1.7407    29.997  7.4109 1.9369 4.0969 1.8220 3.313979       2.659235  
1 1 1 23 3  2  o 6.9559 1.4156 62.337   20.808  66.205    28.982  58.222    29.894  7.2125 1.9586 6.6993 2.0444 0.5132174      2.831210  
1 1 1 23 3  3  o 15.519 0.9806 274.143  24.216  254.469   51.997  279.592   27.365  14.651 1.7746 16.388 0.8349 -1.737241      1.961165  
1 1 1 23 3  4  o 8.1292 1.3770 86.151   19.720  73.970    42.766  89.440    22.224  7.1936 2.4661 9.0649 1.2258 -1.871288      2.753994  
1 1 1 23 3  5  o 9.6565 1.3948 128.903  20.806  94.071    47.514  137.166   23.143  7.9462 2.5973 11.367 1.0180 -3.420597      2.789682  
1 1 1 23 3  6  o 11.092 1.2408 141.222  21.036  151.464   47.010  138.658   23.523  10.750 2.2584 11.435 1.0285 -0.6856489     2.481605  
1 1 1 23 3  7  o 6.5383 1.4626 50.444   18.661  59.730    42.110  48.175    20.817  6.6859 2.4322 6.3907 1.6250 0.2951536      2.925109  
1 1 1 23 3  8  o 4.7720 1.2538 23.456   18.232  -39.2649  42.319  37.751    20.204  3.8930 1.8697 5.6510 1.6709 -1.758031      2.507562  
1 1 1 23 3  9  o 9.9430 1.3152 114.757  20.547  124.528   45.559  112.262   23.021  9.6338 2.3788 10.252 1.1227 -0.6184454     2.630406  
1 1 1 23 3  10 o 19.157 0.8667 370.507  27.820  455.071   60.399  347.736   31.342  20.052 1.5061 18.261 0.8582 1.790907       1.733402  
1 1 1 23 3  11 o 6.3894 1.3995 56.403   20.273  21.090    46.392  64.738    22.539  5.3319 2.3219 7.4469 1.5631 -2.114995      2.799040  
1 1 1 23 3  12 o 9.7697 1.3985 104.654  21.633  134.749   49.845  97.669    24.013  10.020 2.4964 9.5194 1.2613 0.5005913      2.796949  
1 1 1 23 3  13 o 6.5042 1.5812 45.271   20.897  77.658    47.172  37.364    23.309  7.4075 2.5872 5.6009 1.8186 1.806601       3.162400  
1 1 1 23 3  14 o 4.5809 1.3883 13.622   20.057  -8.9956   47.541  18.519    22.122  4.7062 2.1707 4.4557 1.7313 0.2505603      2.776566  
1 1 1 23 3  15 o 5.0512 1.2426 27.814   20.073  -68.9859  46.825  49.608    22.218  3.6797 1.8107 6.4227 1.7022 -2.743043      2.485175  
1 1 1 23 3  16 o 7.1104 1.4139 71.218   21.630  29.781    50.712  80.433    23.914  5.7010 2.4550 8.5198 1.4035 -2.818717      2.827870  
1 1 1 23 3  17 o 7.8077 1.5596 82.935   23.067  85.071    50.680  82.376    25.906  7.3104 2.6669 8.3051 1.6178 -0.9946856     3.119254  
1 1 1 23 3  18 o 7.5921 1.5904 77.434   22.983  92.436    50.880  73.588    25.761  7.4694 2.6795 7.7149 1.7141 -0.2454133     3.180845  
1 1 1 23 3  19 o 16.312 1.1084 319.172  28.902  314.796   61.553  320.410   32.735  15.359 2.0038 17.265 0.9480 -1.906598      2.216774  
1 1 1 23 3  20 o 3.7615 1.2225 3.8854   20.176  -36.8003  46.896  13.127    22.350  3.6842 1.8127 3.8387 1.6409 -0.1545408     2.445087  
1 1 1 23 3  21 o 5.8137 1.6331 48.661   23.880  116.122   52.276  30.871    26.845  6.9930 2.6760 4.6345 1.8725 2.358490       3.266103  
1 1 1 23 3  22 o 4.3762 1.4134 23.850   23.469  58.133    49.303  13.806    26.686  4.9574 2.2579 3.7950 1.7009 1.162455       2.826880  
1 1 1 23 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 3  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  0  o 3.5100 1.6403 3.0231   29.898  5.8887    42.734  0.2754    41.846  3.5937 2.3603 3.4263 2.2785 -0.000000      0.000000  
1 1 1 23 4  1  o 10.420 1.1006 124.206  22.920  118.846   32.297  129.643   32.530  10.166 1.5884 10.674 1.5238 -0.5073452     2.201196  
1 1 1 23 4  2  o 5.1639 1.4099 29.094   21.083  37.916    28.621  18.629    31.174  5.5760 2.0087 4.7517 1.9791 0.8243022      2.819852  
1 1 1 23 4  3  o 6.8098 1.4184 58.155   21.875  34.733    30.164  84.136    31.769  5.4428 2.0443 8.1768 1.9667 -2.734052      2.836704  
1 1 1 23 4  4  o 4.0606 1.3183 -7.8037  23.184  -9.5855   40.137  -6.9115   28.402  4.3426 2.0000 3.7785 1.7182 0.5640478      2.636653  
1 1 1 23 4  5  o 7.1159 1.4351 63.934   21.386  63.204    29.118  64.789    31.512  7.1073 1.9766 7.1245 2.0812 -0.1714277E-01 2.870288  
1 1 1 23 4  6  o 8.7531 1.4168 90.605   20.261  101.033   46.603  88.174    22.499  8.4780 2.5449 9.0283 1.2460 -0.5503054     2.833544  
1 1 1 23 4  7  o 15.238 1.0044 259.693  24.733  250.385   52.717  262.320   28.006  14.605 1.8047 15.870 0.8824 -1.264824      2.008896  
1 1 1 23 4  8  o 6.0851 1.4932 44.243   19.480  47.148    45.089  43.576    21.600  6.1504 2.4466 6.0198 1.7125 0.1305962      2.986402  
1 1 1 23 4  9  o 12.617 1.0794 161.782  22.818  220.367   50.367  146.653   25.595  13.528 1.8615 11.705 1.0933 1.823312       2.158872  
1 1 1 23 4  10 f 7.8757 1.3994 87.877   20.919  51.114    47.605  96.674    23.288  6.3087 2.5126 9.4427 1.2331 -3.133965      2.798874  
1 1 1 23 4  11 o 6.9319 1.5521 53.378   20.471  78.922    46.217  47.144    22.832  7.5677 2.5639 6.2961 1.7501 1.271626       3.104215  
1 1 1 23 4  12 o 9.9811 1.4167 118.466  21.986  127.447   50.404  116.356   24.433  9.5446 2.5792 10.418 1.1727 -0.8729944     2.833303  
1 1 1 23 4  13 o 10.291 1.3913 120.108  22.999  144.279   50.614  113.819   25.819  10.327 2.4814 10.254 1.2589 0.7300949E-01  2.782525  
1 1 1 23 4  14 o 4.3171 1.3261 8.6115   20.410  -30.6741  45.931  18.278    22.783  4.1891 1.9944 4.4450 1.7483 -0.2558374     2.652239  
1 1 1 23 4  15 o 8.9016 1.4180 118.360  22.711  57.439    50.352  133.921   25.447  6.6034 2.5985 11.200 1.1360 -4.596488      2.835989  
1 1 1 23 4  16 o 8.0088 1.4549 95.822   23.353  55.237    52.267  105.945   26.104  6.2735 2.5832 9.7442 1.3395 -3.470728      2.909806  
1 1 1 23 4  17 o 6.8246 1.4048 69.666   22.343  28.392    45.336  82.907    25.678  5.3309 2.3084 8.3183 1.6016 -2.987389      2.809545  
1 1 1 23 4  18 o 4.0577 1.3552 -10.0526 22.015  14.901    50.070  -16.0330  24.512  4.9531 2.2635 3.1623 1.4910 1.790764       2.710448  
1 1 1 23 4  19 o 10.101 1.4565 149.789  24.416  137.926   50.162  153.472   27.951  8.6367 2.6505 11.566 1.2083 -2.929268      2.912922  
1 1 1 23 4  20 o 6.8477 1.2581 85.951   23.999  -6.2234   54.141  108.492   26.774  4.2924 2.0748 9.4031 1.4237 -5.110682      2.516295  
1 1 1 23 4  21 o 7.5730 1.5588 105.861  24.807  111.464   52.147  104.223   28.203  6.5128 2.6174 8.6333 1.6939 -2.120541      3.117686  
1 1 1 23 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 4  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 5  0  o 3.1276 1.4962 -9.6221  27.606  -10.8102  39.283  -8.4629   38.803  3.1114 2.1100 3.1439 2.1219 -0.000000      0.000000  
1 1 1 23 5  1  o 7.6308 1.4392 73.336   22.382  68.494    31.094  78.543    32.242  7.3590 2.0412 7.9026 2.0294 -0.5436406     2.878342  
1 1 1 23 5  2  o 4.2745 1.2027 -7.0772  19.425  41.132    27.897  -52.4460  27.063  5.8217 1.9918 2.7274 1.3486 3.094292       2.405407  
1 1 1 23 5  3  o 6.5957 1.4202 53.593   22.055  28.306    31.185  78.900    31.197  5.2189 2.0478 7.9724 1.9684 -2.753482      2.840392  
1 1 1 23 5  4  o 5.0422 1.2647 17.055   20.209  56.260    27.948  -25.9106  29.258  6.7174 1.9593 3.3670 1.5998 3.350425       2.529446  
1 1 1 23 5  5  o 9.4794 1.2482 106.669  22.791  103.176   32.060  110.237   32.404  9.2995 1.7887 9.6594 1.7414 -0.3599043     2.496382  
1 1 1 23 5  6  o 9.6198 1.2228 109.710  22.702  89.892    32.372  128.887   31.845  8.5185 1.9431 10.721 1.4852 -2.202655      2.445691  
1 1 1 23 5  7  o 9.6042 1.2974 111.868  23.993  105.423   33.101  119.002   34.827  9.2969 1.8453 9.9116 1.8241 -0.6147413     2.594724  
1 1 1 23 5  8  o 5.5247 1.4684 36.224   22.046  38.910    31.129  33.520    31.227  5.6529 2.0858 5.3965 2.0675 0.2563748      2.936869  
1 1 1 23 5  9  o 8.1453 1.5071 70.962   20.899  116.059   47.452  60.110    23.278  9.1552 2.5145 7.1355 1.6620 2.019671       3.014160  
1 1 1 23 5  10 o 5.5913 1.4928 14.187   19.872  79.806    45.217  -1.5203   22.123  7.6191 2.5359 3.5634 1.5757 4.055697       2.985531  
1 1 1 23 5  11 o 6.7451 1.5440 48.281   20.145  84.568    44.867  39.119    22.545  7.7688 2.5232 5.7214 1.7804 2.047437       3.088074  
1 1 1 23 5  12 o 3.1159 1.0806 -29.1903 17.880  -74.6652  43.888  -20.1410  19.578  3.4835 1.7215 2.7483 1.3066 0.7351985      2.161203  
1 1 1 23 5  13 o 8.0179 1.4440 87.917   21.468  64.453    48.511  93.631    23.940  6.7826 2.5821 9.2532 1.2936 -2.470624      2.888008  
1 1 1 23 5  14 o 10.210 1.4684 139.699  23.366  109.852   52.459  147.086   26.098  8.6639 2.7191 11.757 1.1099 -3.093182      2.936879  
1 1 1 23 5  15 o 6.7828 1.4650 65.371   21.625  40.821    48.162  71.570    24.202  5.8211 2.4447 7.7444 1.6148 -1.923383      2.929934  
1 1 1 23 5  16 o 6.1288 1.4410 53.914   21.679  16.044    50.621  62.419    23.990  5.1454 2.3212 7.1122 1.7080 -1.966841      2.881918  
1 1 1 23 5  17 o 7.3651 1.6157 76.904   24.107  87.426    51.210  73.908    27.324  7.1452 2.6675 7.5851 1.8236 -0.4399385     3.231325  
1 1 1 23 5  18 o 4.3318 1.3162 12.464   23.071  -63.8074  51.374  31.731    25.821  3.7088 1.8381 4.9549 1.8844 -1.246041      2.632444  
1 1 1 23 5  19 o 4.1332 1.3528 8.4848   22.002  14.547    50.399  7.0576    24.455  4.5619 2.1470 3.7044 1.6464 0.8574862      2.705619  
1 1 1 23 5  20 o 5.1120 1.4326 45.918   23.323  16.978    52.847  52.918    25.990  4.4501 2.1243 5.7740 1.9226 -1.323923      2.865168  
1 1 1 23 5  21 o 3.5249 1.2176 -9.8604  21.060  20.446    47.636  -17.2227  23.479  4.2182 2.0145 2.8316 1.3682 1.386519       2.435208  
1 1 1 23 5  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 5  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  0  o 4.5937 1.7859 25.144   29.934  -28.3760  45.423  66.232    39.799  3.0234 2.1043 6.1640 2.8861 -0.000000      0.000000  
1 1 1 23 6  1  o 8.5696 1.3387 90.036   23.229  121.479   33.247  60.047    32.469  10.324 1.6102 6.8156 2.1392 3.508022       2.677482  
1 1 1 23 6  2  o 4.0288 1.2054 -11.5301 19.974  -54.0996  28.219  31.208    28.275  2.7823 1.3760 5.2754 1.9797 -2.493058      2.410873  
1 1 1 23 6  3  o 4.3760 1.3290 9.0374   20.969  3.7669    29.160  14.681    30.176  4.1557 1.8244 4.5963 1.9330 -0.4406147     2.657989  
1 1 1 23 6  4  o 3.8927 1.2420 -6.6207  20.833  7.7578    30.082  -19.8741  28.881  4.3263 1.8768 3.4592 1.6272 0.8671269      2.483994  
1 1 1 23 6  5  o 9.4266 1.2905 108.025  23.448  110.836   33.545  105.340   32.788  9.5518 1.8224 9.3013 1.8277 0.2504768      2.581064  
1 1 1 23 6  6  f 7.4365 1.4428 71.605   22.289  62.549    32.197  79.938    30.886  6.9019 2.1244 7.9710 1.9528 -1.069141      2.885525  
1 1 1 23 6  7  o 8.0344 1.4280 81.604   22.990  74.373    33.123  88.326    31.935  7.6042 2.1058 8.4646 1.9293 -0.8603964     2.856006  
1 1 1 23 6  8  o 11.186 1.1119 140.334  24.825  130.144   34.923  150.743   35.297  10.733 1.6268 11.640 1.5162 -0.9063635     2.223864  
1 1 1 23 6  9  o 4.9430 1.3945 21.905   21.347  32.899    29.140  9.1715    31.361  5.4055 2.0134 4.4806 1.9300 0.9249339      2.789023  
1 1 1 23 6  10 o 5.9792 1.4962 43.722   22.345  45.159    32.368  42.414    30.885  6.0515 2.1407 5.9069 2.0909 0.1445518      2.992437  
1 1 1 23 6  11 o 9.3890 1.4234 114.901  20.911  97.045    48.795  118.918   23.143  8.2032 2.6280 10.575 1.0943 -2.371496      2.846747  
1 1 1 23 6  12 o 6.0570 1.4969 46.288   20.709  34.236    47.914  49.057    22.965  5.7546 2.4288 6.3594 1.7504 -0.6047416     2.993784  
1 1 1 23 6  13 o 9.4793 1.4589 106.323  22.333  120.480   50.682  102.912   24.878  9.2192 2.6234 9.7393 1.2772 -0.5201263     2.917754  
1 1 1 23 6  14 o 4.2452 1.3298 6.7178   20.677  -9.6716   42.487  11.804    23.669  4.3650 2.0269 4.1254 1.7219 0.2396393      2.659540  
1 1 1 23 6  15 o 4.4596 1.3722 13.286   20.958  -15.6040  48.991  19.757    23.186  4.4632 2.1055 4.4560 1.7602 0.7223129E-02  2.744344  
1 1 1 23 6  16 o 9.3599 1.4439 115.988  23.539  115.512   47.219  116.145   27.153  8.5899 2.5578 10.130 1.3402 -1.539898      2.887707  
1 1 1 23 6  17 o 3.5070 1.1794 -14.4419 20.917  -82.9657  50.992  -0.5783   22.936  3.5267 1.7614 3.4872 1.5688 0.3953576E-01  2.358714  
1 1 1 23 6  18 o 6.2641 1.5890 37.948   22.836  150.955   51.501  10.294    25.477  8.6902 2.6888 3.8380 1.6943 4.852173       3.178070  
1 1 1 23 6  19 o 6.8254 1.4608 88.447   24.822  54.049    53.761  97.767    27.984  5.2038 2.3654 8.4470 1.7150 -3.243153      2.921663  
1 1 1 23 6  20 o 6.3938 1.5489 81.304   23.860  92.914    54.834  78.592    26.500  5.6476 2.4898 7.1400 1.8431 -1.492355      3.097808  
1 1 1 23 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 6  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  0  o 3.5914 1.6455 4.2153   29.750  -26.6727  46.340  25.870    38.801  3.0638 2.1308 4.1189 2.5080 -0.000000      0.000000  
1 1 1 23 7  1  f 4.3309 1.3196 9.3123   20.748  9.9846    29.287  8.6348    29.399  4.3524 1.8698 4.3095 1.8625 0.4285669E-01  2.639143  
1 1 1 23 7  2  o 3.4287 1.1464 -22.2368 20.759  -20.8353  29.054  -23.6984  29.670  3.4407 1.6226 3.4168 1.6198 0.2397871E-01  2.292744  
1 1 1 23 7  3  o 5.1065 1.5045 23.563   24.774  22.657    41.891  24.050    30.722  5.2416 2.2436 4.9715 2.0051 0.2701483      3.009033  
1 1 1 23 7  4  o 3.2981 1.0881 -41.4091 20.033  8.5218    27.645  -96.6205  29.070  4.2450 1.8200 2.3511 1.1931 1.893900       2.176208  
1 1 1 23 7  5  o 5.9788 1.5077 43.801   22.767  41.801    32.646  45.695    31.766  5.8820 2.1413 6.0757 2.1230 -0.1936789     3.015331  
1 1 1 23 7  6  o 7.7858 1.3982 75.395   22.842  48.058    32.286  102.791   32.321  6.2404 2.1426 9.3313 1.7970 -3.090897      2.796415  
1 1 1 23 7  7  o 4.6772 1.3855 15.104   21.801  12.565    31.755  17.368    29.984  4.6228 1.9654 4.7315 1.9533 -0.1086354     2.770980  
1 1 1 23 7  8  o 8.9522 1.3857 97.827   24.096  111.371   35.678  86.467    32.673  9.5585 1.9327 8.3458 1.9862 1.212645       2.771331  
1 1 1 23 7  9  o 11.807 1.1630 162.631  25.816  123.430   37.197  199.059   35.858  10.107 1.9101 13.507 1.3274 -3.399689      2.326004  
1 1 1 23 7  10 o 5.9681 1.5292 44.128   23.524  42.024    34.332  45.991    32.298  5.8751 2.1860 6.0612 2.1390 -0.1861620     3.058410  
1 1 1 23 7  11 o 5.4268 1.3824 21.828   23.515  67.520    33.470  -22.7085  33.044  7.1856 2.1566 3.6681 1.7300 3.517503       2.764785  
1 1 1 23 7  12 o 5.5691 1.4400 30.716   23.472  61.147    33.047  -0.2612   33.343  6.8740 2.1583 4.2642 1.9069 2.609744       2.880032  
1 1 1 23 7  13 o 4.9918 1.4055 18.160   19.286  51.708    37.382  5.9911    22.514  6.1723 2.2841 3.8114 1.6385 2.360863       2.810980  
1 1 1 23 7  14 o 4.9655 1.4780 5.4620   20.686  67.220    47.009  -9.3683   23.036  6.6455 2.5389 3.2855 1.5139 3.359986       2.955997  
1 1 1 23 7  15 o 5.1936 1.5447 26.100   23.015  45.980    50.868  20.983    25.808  5.8293 2.4832 4.5580 1.8380 1.271290       3.089386  
1 1 1 23 7  16 o 8.8602 1.5230 118.311  25.111  101.719   52.389  123.260   28.612  7.4215 2.7109 10.299 1.3891 -2.877394      3.046035  
1 1 1 23 7  17 o 5.8626 1.5670 52.943   22.252  82.769    46.811  44.236    25.292  6.2964 2.4966 5.4289 1.8945 0.8674874      3.134065  
1 1 1 23 7  18 o 3.8492 1.3178 -15.0033 21.484  38.712    51.019  -26.5818  23.687  4.9483 2.2700 2.7500 1.3392 2.198248       2.635602  
1 1 1 23 7  19 o 4.5470 1.4286 21.307   22.424  71.904    45.266  4.8530    25.813  5.5508 2.3527 3.5431 1.6214 2.007766       2.857295  
1 1 1 23 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 7  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  0  o 4.9961 1.9585 33.519   31.624  76.363    48.268  1.2958    41.860  6.4875 3.1609 3.5047 2.3134 -0.000000      0.000000  
1 1 1 23 8  1  o 13.189 0.9468 189.881  24.877  180.272   36.115  198.557   34.317  12.813 1.4093 13.565 1.2649 -0.7524576     1.893695  
1 1 1 23 8  2  o 9.7158 1.2441 110.045  23.556  99.602    33.539  120.211   33.093  9.0957 1.9047 10.336 1.6009 -1.240102      2.488108  
1 1 1 23 8  3  o 7.2048 1.4742 65.031   23.160  46.790    32.487  83.880    33.025  6.1736 2.1476 8.2359 2.0202 -2.062277      2.948438  
1 1 1 23 8  4  o 4.0223 1.2811 -4.3332  21.711  -3.2605   30.498  -5.4354   30.913  4.0419 1.8145 4.0026 1.8091 0.3929663E-01  2.562228  
1 1 1 23 8  5  o 4.6930 1.3988 14.829   22.439  11.175    33.239  17.889    30.416  4.6276 1.9902 4.7584 1.9661 -0.1307368     2.797554  
1 1 1 23 8  6  o 6.4966 1.4962 52.865   22.561  64.950    32.828  42.048    31.058  7.1090 2.1364 5.8843 2.0953 1.224671       2.992381  
1 1 1 23 8  7  o 10.959 1.0958 135.148  23.976  130.362   34.426  139.656   33.412  10.727 1.6046 11.191 1.4927 -0.4645538     2.191603  
1 1 1 23 8  8  o 4.3923 1.3556 2.4694   23.065  21.335    33.561  -14.4170  31.752  4.9925 2.0642 3.7920 1.7578 1.200551       2.711259  
1 1 1 23 8  9  o 10.646 1.2647 134.715  26.270  129.142   37.840  139.899   36.500  10.281 1.9107 11.012 1.6573 -0.7311659     2.529303  
1 1 1 23 8  10 o 5.0809 1.4221 18.234   23.620  -11.0779  33.249  48.102    33.562  3.9712 1.8257 6.1906 2.1809 -2.219372      2.844240  
1 1 1 23 8  11 o 12.799 1.1096 187.595  28.258  177.574   41.159  196.531   38.865  12.377 1.6627 13.221 1.4698 -0.8437462     2.219170  
1 1 1 23 8  12 o 5.6540 1.5648 40.028   25.857  33.932    38.065  45.252    35.234  5.4345 2.2172 5.8736 2.2087 -0.4391041     3.129612  
1 1 1 23 8  13 o 13.794 1.1293 223.632  31.099  218.439   44.862  228.436   43.148  13.566 1.6535 14.022 1.5386 -0.4558325     2.258616  
1 1 1 23 8  14 o 7.7099 1.6461 87.577   28.892  118.045   41.770  59.627    40.006  9.0897 2.2968 6.3302 2.3588 2.759521       3.292295  
1 1 1 23 8  15 o 6.5627 1.6266 66.406   27.570  44.466    38.684  89.054    39.303  5.5714 2.2489 7.5541 2.3507 -1.982686      3.253270  
1 1 1 23 8  16 o 4.5302 1.4287 21.401   22.080  33.933    51.588  18.591    24.432  4.9206 2.2666 4.1398 1.7401 0.7807975      2.857495  
1 1 1 23 8  17 o 5.1261 1.3359 41.045   23.510  -40.5083  51.565  62.446    26.415  3.7821 1.8684 6.4702 1.9099 -2.688110      2.671822  
1 1 1 23 8  18 o 4.8956 1.4952 34.490   22.555  74.501    49.160  23.822    25.384  5.5638 2.4065 4.2273 1.7751 1.336523       2.990335  
1 1 1 23 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  0  o 9.3715 2.0644 128.149  34.497  110.028   51.404  142.997   46.530  8.1983 3.2514 10.545 2.5449 -0.000000      0.000000  
1 1 1 23 9  1  o 4.9663 1.4270 21.099   22.502  31.471    32.032  10.994    31.618  5.3837 2.0856 4.5489 1.9482 0.8347807      2.854028  
1 1 1 23 9  2  o 4.4460 1.3463 7.8871   21.663  -3.6265   29.917  20.579    31.411  3.9860 1.7926 4.9060 2.0093 -0.9200318     2.692681  
1 1 1 23 9  3  o 3.4033 1.1240 -40.1820 20.743  -86.4280  29.047  7.9407    29.631  2.4543 1.2394 4.3524 1.8754 -1.898084      2.247926  
1 1 1 23 9  4  o 5.7332 1.4806 38.466   22.444  28.595    32.034  47.984    31.456  5.2645 2.0723 6.2019 2.1151 -0.9374042     2.961110  
1 1 1 23 9  5  o 3.6058 1.1963 -20.7031 21.945  -28.8877  31.998  -13.4345  30.154  3.4877 1.6616 3.7239 1.7215 -0.2361507     2.392638  
1 1 1 23 9  6  o 7.2108 1.5239 67.600   23.637  69.469    34.490  65.944    32.457  7.2782 2.1904 7.1435 2.1192 0.1346321      3.047729  
1 1 1 23 9  7  f 7.2165 1.5227 68.252   23.646  68.860    33.547  67.652    33.336  7.2468 2.1555 7.1861 2.1513 0.6069565E-01  3.045396  
1 1 1 23 9  8  o 10.856 1.2761 142.109  26.191  116.280   39.151  163.031   35.236  9.6069 2.0965 12.105 1.4554 -2.498127      2.552212  
1 1 1 23 9  9  o 9.7921 1.3343 115.906  25.488  108.159   37.220  122.747   34.975  9.2767 2.0598 10.307 1.6966 -1.030732      2.668524  
1 1 1 23 9  10 o 4.9651 1.4620 20.591   25.020  1.5217    36.610  37.305    34.274  4.3841 1.9763 5.5462 2.1549 -1.162062      2.923924  
1 1 1 23 9  11 o 13.541 1.0745 213.008  28.576  174.401   40.707  250.520   40.125  12.121 1.6792 14.960 1.3410 -2.839551      2.148962  
1 1 1 23 9  12 f 7.3516 1.6258 79.461   27.976  55.551    41.304  99.726    38.026  6.2197 2.3790 8.4836 2.2167 -2.263810      3.251688  
1 1 1 23 9  13 o 5.7677 1.4604 34.849   27.144  -23.8101  39.823  85.751    37.097  3.8686 1.8460 7.6668 2.2634 -3.798172      2.920734  
1 1 1 23 9  14 o 12.461 1.2696 196.735  31.404  228.491   46.046  169.119   42.940  13.534 1.7011 11.389 1.8852 2.145202       2.539283  
1 1 1 23 9  15 o 5.8687 1.5835 57.379   28.142  96.556    41.286  23.379    38.461  7.1933 2.4233 4.5442 2.0390 2.649047       3.166989  
1 1 1 23 9  16 o 4.8121 1.4822 32.911   26.826  40.538    38.456  25.681    37.440  5.0389 2.1531 4.5854 2.0376 0.4535170      2.964381  
1 1 1 23 9  17 o 4.0179 1.3282 4.5680   26.682  31.779    39.583  -18.0925  36.122  4.5756 2.0595 3.4602 1.6779 1.115310       2.656461  
1 1 1 23 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 9  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 0  o 8.7610 2.1168 114.300  33.494  129.359   48.952  101.045   45.926  9.5234 2.9373 7.9985 3.0487 -0.000000      0.000000  
1 1 1 23 10 1  f 5.7671 1.5059 39.809   23.012  34.705    32.006  45.271    33.109  5.5091 2.0973 6.0250 2.1615 -0.5158911     3.011764  
1 1 1 23 10 2  o 14.313 1.1339 233.499  30.767  233.139   51.934  233.693   38.190  14.007 1.8539 14.619 1.3062 -0.6120739     2.267826  
1 1 1 23 10 3  o 4.2834 1.3196 4.8911   21.687  -8.4501   32.207  15.959    29.334  3.9579 1.8112 4.6089 1.9197 -0.6510293     2.639272  
1 1 1 23 10 4  o 5.7482 1.4868 40.249   22.301  38.958    31.785  41.501    31.299  5.6869 2.1058 5.8096 2.0994 -0.1227207     2.973527  
1 1 1 23 10 5  o 5.7376 1.4887 37.030   23.292  57.539    34.000  18.893    31.973  6.6411 2.1984 4.8341 2.0081 1.807033       2.977469  
1 1 1 23 10 6  o 7.3720 1.4860 70.780   23.658  53.520    35.592  84.441    31.666  6.4591 2.2478 8.2850 1.9444 -1.825892      2.972098  
1 1 1 23 10 7  o 7.6909 1.4601 73.192   24.602  115.177   36.992  39.896    32.943  9.6329 1.9861 5.7489 2.1408 3.883995       2.920243  
1 1 1 23 10 8  o 9.6511 1.3467 115.686  25.010  122.271   36.969  110.128   33.962  9.8721 1.9416 9.4302 1.8668 0.4418507      2.693420  
1 1 1 23 10 9  o 8.3556 1.4223 96.921   26.196  49.610    39.612  133.692   34.922  6.0492 2.3260 10.662 1.6377 -4.612812      2.844685  
1 1 1 23 10 10 o 7.3433 1.5731 78.091   26.533  54.090    40.505  96.131    35.117  6.1883 2.3585 8.4983 2.0824 -2.310006      3.146291  
1 1 1 23 10 11 o 8.3521 1.5464 101.515  28.379  60.541    41.643  137.049   38.779  6.3809 2.4009 10.323 1.9497 -3.942464      3.092839  
1 1 1 23 10 12 o 13.910 1.1273 232.998  31.356  236.860   44.861  229.309   43.845  14.013 1.6006 13.807 1.5878 0.2062378      2.254562  
1 1 1 23 10 13 o 4.7349 1.4635 18.599   27.607  -7.0588   40.344  41.194    37.859  4.1006 1.9271 5.3692 2.2032 -1.268535      2.927073  
1 1 1 23 10 14 o 3.7158 1.2381 -16.5962 25.669  -61.8283  38.604  19.252    34.367  3.0723 1.5341 4.3593 1.9437 -1.286987      2.476175  
1 1 1 23 10 15 o 4.9577 1.4993 38.744   26.329  43.205    38.922  34.980    35.749  5.0864 2.1695 4.8290 2.0700 0.2573996      2.998613  
1 1 1 23 10 16 o 3.7209 1.2360 -21.4200 26.375  -90.0281  39.081  35.970    35.743  2.7583 1.3980 4.6834 2.0388 -1.925097      2.472056  
1 1 1 23 10 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 10 24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 0  o 4.4742 1.8802 20.334   32.345  61.888    47.504  -15.5807  44.163  5.7405 3.0553 3.2078 2.1923 -0.000000      0.000000  
1 1 1 23 11 1  o 7.8071 1.5191 79.106   24.876  92.250    34.332  64.580    36.093  8.5999 2.0289 7.0142 2.2616 1.585730       3.038289  
1 1 1 23 11 2  o 7.8131 1.4510 75.326   23.813  107.355   35.628  49.466    32.014  9.3545 1.9667 6.2718 2.1338 3.082768       2.901922  
1 1 1 23 11 3  o 4.4239 1.3672 5.3544   23.129  14.900    32.991  -3.8722   32.435  4.7361 2.0080 4.1116 1.8562 0.6245279      2.734501  
1 1 1 23 11 4  o 7.1305 1.5366 67.829   24.708  50.217    36.011  83.495    33.964  6.2200 2.2512 8.0410 2.0919 -1.821030      3.073164  
1 1 1 23 11 5  o 4.4323 1.3178 -0.0751  22.195  39.091    32.618  -33.8474  30.289  5.6281 2.1233 3.2365 1.5613 2.391585       2.635587  
1 1 1 23 11 6  o 5.2029 1.4783 29.568   23.917  18.833    36.097  37.969    31.933  4.8678 2.0831 5.5380 2.0981 -0.6702857     2.956618  
1 1 1 23 11 7  o 5.1489 1.3725 20.931   23.888  -29.8634  36.226  60.014    31.776  3.6428 1.7443 6.6551 2.1196 -3.012309      2.745040  
1 1 1 23 11 8  o 7.2525 1.4537 73.287   26.039  25.208    38.816  112.629   35.112  5.1066 2.1721 9.3984 1.9325 -4.291842      2.907342  
1 1 1 23 11 9  o 3.9962 1.3131 -10.0317 25.300  -11.4151  36.244  -8.7171   35.333  3.9870 1.8583 4.0053 1.8558 -0.1828694E-01 2.626251  
1 1 1 23 11 10 o 4.0216 1.3130 -11.4150 25.550  -37.0334  36.193  14.031    36.072  3.4562 1.6768 4.5870 2.0210 -1.130791      2.626002  
1 1 1 23 11 11 o 6.1740 1.5393 56.566   26.916  19.796    40.939  84.560    35.721  4.8060 2.1334 7.5419 2.2195 -2.735894      3.078537  
1 1 1 23 11 12 o 5.1598 1.4967 35.881   27.637  -1.9355   41.392  66.302    37.125  4.1170 1.9401 6.2026 2.2795 -2.085590      2.993375  
1 1 1 23 11 13 o 5.7918 1.5821 55.829   27.082  84.740    40.182  31.764    36.660  6.7813 2.3866 4.8023 2.0776 1.979015       3.164248  
1 1 1 23 11 14 o 4.8713 1.4934 37.742   27.140  30.261    40.979  43.587    36.222  4.6670 2.0985 5.0757 2.1253 -0.4087410     2.986750  
1 1 1 23 11 15 o 4.6912 1.4432 34.084   27.610  -0.1361   41.693  60.812    36.847  3.8912 1.8654 5.4911 2.2025 -1.599888      2.886321  
1 1 1 23 11 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 11 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 0  o 4.7847 1.9120 40.148   31.239  9.1362    48.123  62.732    41.067  3.7902 2.4948 5.7793 2.8981 -0.000000      0.000000  
1 1 1 23 12 1  o 5.5405 1.4257 34.207   22.791  5.4339    32.492  62.078    31.979  4.2985 1.9047 6.7825 2.1220 -2.484025      2.851482  
1 1 1 23 12 2  f 6.4118 1.5627 56.216   24.550  65.468    34.741  46.986    34.697  6.8731 2.2191 5.9505 2.2008 0.9226241      3.125403  
1 1 1 23 12 3  o 6.9961 1.5331 67.525   25.009  44.319    35.992  89.185    34.774  5.8224 2.2223 8.1697 2.1125 -2.347350      3.066170  
1 1 1 23 12 4  o 5.5810 1.5033 38.220   24.441  18.865    36.107  54.590    33.205  4.8429 2.0782 6.3192 2.1727 -1.476300      3.006593  
1 1 1 23 12 5  o 3.5420 1.1949 -25.6695 23.425  -29.7789  35.580  -22.5254  31.122  3.5983 1.7246 3.4856 1.6543 0.1126969      2.389761  
1 1 1 23 12 6  o 6.8993 1.5784 65.352   25.735  92.620    38.493  43.312    34.606  8.0724 2.2825 5.7261 2.1806 2.346355       3.156706  
1 1 1 23 12 7  o 3.0608 1.0645 -51.1094 22.997  -68.7074  33.781  -35.9096  31.395  2.8977 1.4451 3.2239 1.5635 -0.3261485     2.129037  
1 1 1 23 12 8  o 5.8983 1.6060 50.237   26.683  52.042    39.345  48.701    36.309  5.9553 2.3103 5.8413 2.2314 0.1140294      3.211949  
1 1 1 23 12 9  o 4.4042 1.4031 1.6899   26.584  32.461    40.051  -22.5423  35.542  5.1691 2.2027 3.6393 1.7386 1.529780       2.806198  
1 1 1 23 12 10 o 4.3742 1.4021 4.8377   26.421  35.188    41.178  -16.4010  34.447  5.1128 2.2069 3.6357 1.7299 1.477060       2.804120  
1 1 1 23 12 11 o 5.5741 1.5532 53.420   26.867  31.232    38.778  73.903    37.259  4.7581 2.0959 6.3900 2.2929 -1.631967      3.106477  
1 1 1 23 12 12 f 5.1065 1.4939 38.631   27.224  6.7133    40.724  64.421    36.606  4.2014 1.9620 6.0115 2.2532 -1.810086      2.987704  
1 1 1 23 12 13 o 5.9711 1.6361 70.599   27.754  84.116    41.884  60.019    37.058  6.3405 2.4027 5.6017 2.2213 0.7388515      3.272193  
1 1 1 23 12 14 o 6.0037 1.5735 77.590   28.535  42.149    43.182  105.063   38.019  4.6967 2.1290 7.3106 2.3174 -2.613860      3.146926  
1 1 1 23 12 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 12 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 0  o 4.0004 1.8103 15.735   31.902  41.066    50.683  -0.8859   41.055  4.6817 2.8581 3.3192 2.2228 -0.000000      0.000000  
1 1 1 23 13 1  o 4.6636 1.4582 6.4768   26.806  34.472    41.902  -12.9182  34.877  5.4375 2.2818 3.8898 1.8163 1.547729       2.916423  
1 1 1 23 13 2  o 4.4247 1.3267 3.7766   23.305  37.816    31.568  -37.0006  34.551  5.4519 2.0811 3.3976 1.6460 2.054353       2.653364  
1 1 1 23 13 3  o 6.4015 1.5342 56.499   24.715  79.166    35.171  34.387    34.738  7.4850 2.2022 5.3179 2.1366 2.167092       3.068332  
1 1 1 23 13 4  o 5.4235 1.6420 34.710   30.964  38.508    37.071  25.945    56.314  5.4721 2.2041 5.3748 2.4343 0.9737110E-01  3.283919  
1 1 1 23 13 5  o 4.9996 1.4758 27.490   24.882  18.288    36.495  35.483    34.012  4.7169 2.0566 5.2823 2.1170 -0.5653963     2.951502  
1 1 1 23 13 6  o 4.9324 1.4915 26.041   25.994  28.514    39.082  24.079    34.809  5.0446 2.1634 4.8201 2.0537 0.2244749      2.982985  
1 1 1 23 13 7  o 7.2295 1.5926 74.578   26.569  120.146   42.259  44.792    34.166  8.8809 2.3447 5.5781 2.1559 3.302868       3.185216  
1 1 1 23 13 8  o 4.1515 1.3110 -0.1692  24.741  -42.7305  36.565  35.773    33.601  3.2694 1.6071 5.0336 2.0718 -1.764226      2.621999  
1 1 1 23 13 9  o 6.0498 1.5972 66.610   26.882  51.119    39.602  79.849    36.609  5.3835 2.2355 6.7161 2.2818 -1.332594      3.194375  
1 1 1 23 13 10 o 4.6622 1.4109 22.923   26.086  -14.9977  39.820  51.430    34.526  3.7806 1.8152 5.5439 2.1604 -1.763281      2.821760  
1 1 1 23 13 11 o 5.4356 1.5413 53.694   27.424  28.257    41.294  73.766    36.682  4.5991 2.0836 6.2722 2.2718 -1.673130      3.082650  
1 1 1 23 13 12 o 4.9215 1.4846 35.143   27.155  79.931    41.502  1.6159    35.908  6.0447 2.3650 3.7982 1.7951 2.246467       2.969114  
1 1 1 23 13 13 o 4.1319 1.3520 19.252   26.929  2.5993    39.416  33.829    36.878  3.8020 1.8203 4.4618 1.9996 -0.6597710     2.704092  
1 1 1 23 13 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 13 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 0  o 5.5438 2.1653 66.402   36.103  87.402    52.070  46.957    50.103  6.3533 3.2457 4.7343 2.8669 -0.000000      0.000000  
1 1 1 23 14 1  o 4.7194 1.4590 19.875   26.129  19.418    36.591  20.350    37.323  4.6964 2.0532 4.7423 2.0734 -0.4589653E-01 2.917946  
1 1 1 23 14 2  o 8.8954 1.5187 112.734  26.724  108.876   38.556  116.301   37.076  8.6350 2.2202 9.1558 2.0729 -0.5208445     3.037460  
1 1 1 23 14 3  o 3.7491 1.2467 -15.6135 24.398  -34.8410  34.709  3.1650    34.302  3.3630 1.6340 4.1352 1.8834 -0.7722473     2.493392  
1 1 1 23 14 4  o 5.0011 1.4226 23.033   24.967  -16.2046  35.171  62.886    35.446  3.6956 1.7553 6.3066 2.2392 -2.610983      2.845232  
1 1 1 23 14 5  o 4.7398 1.4216 24.211   24.715  50.141    35.386  -0.4848   34.534  5.5542 2.1807 3.9253 1.8243 1.628924       2.843133  
1 1 1 23 14 6  o 6.3927 1.6201 73.679   26.297  76.399    37.698  71.102    36.700  6.4886 2.3087 6.2968 2.2737 0.1918650      3.240287  
1 1 1 23 14 7  o 3.3694 1.1556 -37.4978 24.607  4.1275    35.526  -75.8846  34.116  4.0202 1.8621 2.7187 1.3691 1.301524       2.311238  
1 1 1 23 14 8  o 5.6032 1.4311 41.925   26.991  -22.5105  40.038  95.606    36.544  3.6490 1.7688 7.5575 2.2502 -3.908472      2.862141  
1 1 1 23 14 9  o 4.6254 1.4219 27.619   26.457  -2.6414   40.311  50.519    35.067  3.9212 1.8673 5.3296 2.1448 -1.408441      2.843748  
1 1 1 23 14 10 o 4.8229 1.4818 40.588   27.259  27.603    42.233  49.861    35.689  4.4806 2.0591 5.1652 2.1316 -0.6846118     2.963694  
1 1 1 23 14 11 o 5.3377 1.5670 62.498   27.522  61.864    39.680  63.087    38.205  5.2883 2.2199 5.3871 2.2122 -0.9884644E-01 3.134016  
1 1 1 23 14 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 14 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 0  o 5.7963 2.1612 80.746   36.923  47.892    52.916  111.919   51.544  4.4511 2.8062 7.1415 3.2877 -0.000000      0.000000  
1 1 1 23 15 1  o 3.9381 1.3028 0.0782   25.511  4.9071    37.290  -4.1701   34.977  4.0745 1.8943 3.8016 1.7890 0.2729108      2.605558  
1 1 1 23 15 2  o 6.1866 1.5798 64.479   27.241  100.220   39.735  32.783    37.419  7.5449 2.3662 4.8283 2.0939 2.716622       3.159675  
1 1 1 23 15 3  f 5.4155 1.5101 40.826   27.031  83.752    39.315  2.3416    37.226  6.7961 2.3626 4.0350 1.8815 2.761157       3.020221  
1 1 1 23 15 4  o 4.9698 1.5029 36.725   26.503  42.399    38.704  31.715    36.366  5.1439 2.1776 4.7957 2.0720 0.3481250      3.005857  
1 1 1 23 15 5  o 4.9054 1.4951 36.417   27.174  23.505    40.025  47.458    37.012  4.5422 2.0552 5.2686 2.1721 -0.7264142     2.990293  
1 1 1 23 15 6  f 4.2911 1.3898 15.211   27.021  31.470    39.461  0.8554    37.078  4.6765 2.0841 3.9057 1.8392 0.7708452      2.779614  
1 1 1 23 15 7  o 6.4689 1.5291 76.150   28.681  22.079    41.182  127.076   39.966  4.3953 2.0248 8.5425 2.2918 -4.147273      3.058116  
1 1 1 23 15 8  o 3.7538 1.2600 -0.8833  25.592  10.481    36.728  -11.6083  35.679  3.9840 1.8615 3.5236 1.6985 0.4604588      2.519920  
1 1 1 23 15 9  o 4.0502 1.3326 14.926   26.280  31.851    38.293  -0.1424   36.133  4.4172 2.0034 3.6831 1.7578 0.7341149      2.665185  
1 1 1 23 15 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 15 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 0  o 4.9943 2.1360 65.291   39.663  107.708   61.696  35.412    51.780  5.9835 3.3750 4.0050 2.6190 -0.000000      0.000000  
1 1 1 23 16 1  o 3.5154 1.1928 -33.9454 25.482  24.035    36.390  -89.7328  35.695  4.4044 1.9792 2.6265 1.3317 1.777900       2.385531  
1 1 1 23 16 2  o 4.2365 1.3541 9.3395   26.800  -32.6200  38.981  46.952    36.907  3.3746 1.6589 5.0984 2.1406 -1.723792      2.708166  
1 1 1 23 16 3  o 4.0851 1.3401 5.4016   26.853  37.665    39.198  -23.1292  36.861  4.7532 2.0998 3.4170 1.6655 1.336222       2.680141  
1 1 1 23 16 4  o 4.3130 1.3792 23.095   25.317  31.832    37.787  15.978    34.103  4.5421 2.0307 4.0838 1.8669 0.4583473      2.758477  
1 1 1 23 16 5  o 4.8688 1.4712 41.391   25.401  65.234    39.087  23.961    33.420  5.4989 2.2455 4.2387 1.9013 1.260249       2.942333  
1 1 1 23 16 6  o 3.6043 1.2226 -4.1494  25.399  -8.1502   38.034  -0.9293   34.122  3.5938 1.7376 3.6148 1.7204 -0.2098370E-01 2.445238  
1 1 1 23 16 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 16 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 17 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 18 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 19 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 20 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 21 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 23 22 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 1  0  o 3.9409 2.0216 25.844   20.248  0.0000    0.0000  25.844    20.248  3.9409 2.0216 3.9409 2.0216 -0.000000      0.000000  
1 1 1 24 1  1  o 6.8437 1.1795 56.901   16.200  68.579    22.869  45.138    22.952  7.6441 1.5489 6.0433 1.7793 1.600831       2.359024  
1 1 1 24 1  2  o 5.7911 1.2753 41.357   16.350  42.588    23.463  40.196    22.797  5.8648 1.8149 5.7174 1.7922 0.1474795      2.550604  
1 1 1 24 1  3  o 4.3314 1.1064 14.517   14.822  36.492    19.807  -13.4500  22.345  5.5175 1.6597 3.1452 1.4636 2.372328       2.212900  
1 1 1 24 1  4  o 4.5277 1.2215 20.605   15.366  17.315    20.962  24.426    22.593  4.3024 1.6815 4.7530 1.7723 -0.4506435     2.443064  
1 1 1 24 1  5  o 4.6459 1.1427 20.234   14.322  3.0626    19.480  40.432    21.128  3.5143 1.5174 5.7775 1.7088 -2.263180      2.285311  
1 1 1 24 1  6  o 8.0396 1.0113 74.191   15.557  94.033    22.057  54.548    21.946  9.3223 1.1830 6.7568 1.6405 2.565475       2.022542  
1 1 1 24 1  7  o 10.120 1.4072 118.204  21.094  137.515   51.661  114.340   23.108  9.8900 2.5835 10.350 1.1164 -0.4597273     2.814361  
1 1 1 24 1  8  o 5.9737 1.5235 39.571   19.540  50.849    46.768  37.186    21.507  6.3492 2.5025 5.5981 1.7384 0.7511077      3.047061  
1 1 1 24 1  9  o 14.287 1.0040 212.664  23.406  250.966   51.987  202.926   26.213  14.656 1.7736 13.919 0.9416 0.7373466      2.008051  
1 1 1 24 1  10 o 16.018 1.0116 277.956  25.675  299.649   57.763  272.615   28.662  15.883 1.8184 16.154 0.8872 -0.2712641     2.023299  
1 1 1 24 1  11 o 5.7171 1.5312 24.248   18.759  78.852    47.140  13.975    20.448  7.3292 2.5844 4.1050 1.6428 3.224159       3.062365  
1 1 1 24 1  12 o 4.2172 1.3187 5.1788   19.360  -20.3917  44.748  11.067    21.474  4.3782 2.0485 4.0561 1.6613 0.3220840      2.637486  
1 1 1 24 1  13 o 5.1096 1.4204 27.100   18.983  1.4219    49.241  31.583    20.574  4.9989 2.2689 5.2202 1.7092 -0.2213264     2.840703  
1 1 1 24 1  14 o 11.449 1.4125 166.101  23.857  144.434   53.710  171.426   26.628  10.160 2.6246 12.738 1.0452 -2.577963      2.825094  
1 1 1 24 1  15 o 4.8256 1.4005 20.923   21.147  -18.2118  48.815  29.964    23.463  4.5368 2.1281 5.1144 1.8212 -0.5776033     2.801004  
1 1 1 24 1  16 f 4.5773 1.4267 9.2917   20.911  2.9741    49.864  10.640    23.034  5.0474 2.2879 4.1071 1.7051 0.9402237      2.853439  
1 1 1 24 1  17 o 4.8892 1.4531 22.653   21.458  -6.9953   55.557  27.851    23.263  4.8639 2.2780 4.9146 1.8047 -0.5071115E-01 2.906217  
1 1 1 24 1  18 o 4.1359 1.3154 3.8077   21.541  -44.0247  50.591  14.399    23.806  4.0637 1.9740 4.2080 1.7391 -0.1443019     2.630848  
1 1 1 24 1  19 o 5.0221 1.5211 20.450   22.082  57.587    50.183  11.532    24.590  6.0017 2.5063 4.0426 1.7244 1.959094       3.042219  
1 1 1 24 1  20 o 7.2885 1.5531 88.841   23.589  92.953    52.012  87.776    26.468  6.4652 2.6084 8.1119 1.6864 -1.646741      3.106136  
1 1 1 24 1  21 o 4.2484 1.3731 15.814   23.287  8.7869    52.733  17.517    25.955  4.4092 2.1096 4.0876 1.7583 0.3216333      2.746248  
1 1 1 24 1  22 o 6.1710 1.4872 79.302   24.655  60.959    52.858  84.403    27.873  4.9965 2.2989 7.3454 1.8872 -2.348904      2.974324  
1 1 1 24 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 1  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  0  o 4.5273 2.1616 33.789   22.438  0.0000    0.0000  33.789    22.438  4.5273 2.1616 4.5273 2.1616 -0.000000      0.000000  
1 1 1 24 2  1  o 10.626 0.8862 124.063  18.600  144.822   26.317  103.343   26.292  11.602 1.1342 9.6511 1.3621 1.950754       1.772485  
1 1 1 24 2  2  o 4.5794 1.1572 19.421   14.346  37.788    21.551  4.8058    19.224  5.5850 1.7412 3.5738 1.5246 2.011156       2.314312  
1 1 1 24 2  3  o 4.2313 1.1228 7.3706   18.238  -104.3909 39.897  36.892    20.505  2.9259 1.4744 5.5367 1.6939 -2.610832      2.245658  
1 1 1 24 2  4  o 4.6921 1.3200 21.774   17.853  -9.6774   42.445  28.534    19.678  4.4177 2.0424 4.9664 1.6730 -0.5487761     2.640095  
1 1 1 24 2  5  o 4.9808 1.4461 13.172   18.627  50.335    43.216  4.6931    20.642  6.2749 2.4249 3.6867 1.5764 2.588208       2.892251  
1 1 1 24 2  6  o 5.1795 1.2818 32.420   17.901  -19.7847  42.957  43.391    19.693  4.2805 2.0042 6.0784 1.5986 -1.797970      2.563626  
1 1 1 24 2  7  o 10.126 1.3154 112.264  20.973  141.426   47.575  105.230   23.366  10.353 2.3513 9.8998 1.1801 0.4527397      2.630836  
1 1 1 24 2  8  o 6.0000 1.5319 31.626   19.826  78.762    44.734  20.103    22.117  7.4703 2.5224 4.5297 1.7389 2.940599       3.063723  
1 1 1 24 2  9  o 9.2137 1.4443 109.142  21.506  102.469   49.181  110.719   23.914  8.3047 2.6361 10.123 1.1812 -1.818007      2.888601  
1 1 1 24 2  10 o 10.134 1.4358 140.162  22.154  107.694   50.696  147.826   24.630  8.4741 2.6749 11.793 1.0443 -3.318805      2.871534  
1 1 1 24 2  11 f 5.8457 1.5525 35.290   20.557  52.279    47.562  31.387    22.796  6.4531 2.5299 5.2383 1.8003 1.214755       3.105016  
1 1 1 24 2  12 o 6.3503 1.3976 54.905   19.985  14.095    48.788  63.134    21.908  5.2911 2.3398 7.4094 1.5291 -2.118309      2.795106  
1 1 1 24 2  13 o 7.9342 1.3781 94.360   21.845  31.641    50.794  108.592   24.197  5.8157 2.4795 10.053 1.2035 -4.236983      2.756129  
1 1 1 24 2  14 f 5.6649 1.5770 28.811   21.065  60.989    50.092  21.899    23.218  6.6712 2.6015 4.6587 1.7832 2.012565       3.154047  
1 1 1 24 2  15 o 11.716 1.2867 141.467  23.954  201.977   54.795  127.171   26.634  12.571 2.2626 10.860 1.2263 1.711451       2.573485  
1 1 1 24 2  16 o 4.7752 1.4725 12.155   20.577  34.048    49.819  7.6519    22.595  5.6591 2.4351 3.8913 1.6562 1.767753       2.945011  
1 1 1 24 2  17 o 3.9832 1.3402 -19.8754 21.107  16.908    49.248  -28.1524  23.361  5.1328 2.3049 2.8337 1.3681 2.299074       2.680307  
1 1 1 24 2  18 o 6.2034 1.5343 57.289   24.014  32.211    52.752  63.844    26.970  5.4427 2.4186 6.9640 1.8887 -1.521280      3.068671  
1 1 1 24 2  19 o 5.0738 1.3967 35.337   22.601  -19.1658  52.576  47.691    25.031  4.2826 2.0638 5.8649 1.8826 -1.582247      2.793464  
1 1 1 24 2  20 o 4.4055 1.4119 17.422   23.142  19.115    53.391  17.030    25.679  4.6899 2.2080 4.1212 1.7601 0.5687361      2.823743  
1 1 1 24 2  21 o 5.1771 1.5621 36.786   23.913  98.132    51.525  19.945    26.996  6.2320 2.5653 4.1221 1.7831 2.109949       3.124137  
1 1 1 24 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 2  28 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 3  0  o 7.0582 1.9718 81.013   31.295  43.634    44.425  117.835   44.093  4.9134 2.8257 9.2029 2.7508 -0.000000      0.000000  
1 1 1 24 3  1  o 6.2781 1.4284 48.881   22.223  71.433    30.458  23.209    32.496  7.5346 1.9912 5.0217 2.0487 2.512887       2.856891  
1 1 1 24 3  2  o 9.8042 1.3577 123.398  20.513  103.265   45.767  128.459   22.948  8.5913 2.5077 11.017 1.0415 -2.425787      2.715349  
1 1 1 24 3  3  o 5.7893 1.4258 11.140   18.567  96.583    43.675  -7.7080   20.513  8.3767 2.4510 3.2019 1.4576 5.174796       2.851695  
1 1 1 24 3  4  o 15.035 1.0593 251.768  24.753  251.898   55.869  251.737   27.611  14.522 1.9236 15.547 0.8880 -1.025567      2.118680  
1 1 1 24 3  5  o 4.4408 1.3880 4.3215   18.475  22.306    45.131  0.7009    20.249  5.3854 2.3176 3.4962 1.5279 1.889257       2.775903  
1 1 1 24 3  6  o 6.5345 1.5406 50.497   19.871  60.653    48.986  48.497    21.740  6.6898 2.5827 6.3792 1.6805 0.3105745      3.081275  
1 1 1 24 3  7  o 4.3347 1.3582 6.4602   20.551  -6.9069   44.931  9.9964    23.110  4.6058 2.1193 4.0637 1.6992 0.5420456      2.716364  
1 1 1 24 3  8  o 9.9854 1.4396 134.065  22.881  108.839   49.979  140.755   25.737  8.5249 2.6505 11.446 1.1243 -2.920939      2.879123  
1 1 1 24 3  9  o 6.7151 1.2730 66.289   20.521  -4.5672   47.417  82.617    22.763  4.7499 2.1824 8.6804 1.3112 -3.930541      2.546003  
1 1 1 24 3  10 o 4.9071 1.4236 20.822   19.378  6.8764    46.625  23.734    21.305  5.0692 2.2618 4.7450 1.7294 0.3242183      2.847219  
1 1 1 24 3  11 o 9.9140 1.3922 95.409   22.776  178.134   51.193  74.993    25.432  11.812 2.2491 8.0157 1.6416 3.796478       2.784458  
1 1 1 24 3  12 o 8.3007 1.2545 115.192  22.243  -3.0666   50.762  143.293   24.745  4.9647 2.2726 11.637 1.0632 -6.672015      2.509033  
1 1 1 24 3  13 o 4.2669 1.3829 -3.0790  19.877  11.058    48.884  -5.8792   21.756  5.1772 2.3125 3.3566 1.5173 1.820641       2.765866  
1 1 1 24 3  14 o 5.9353 1.4695 45.357   22.245  11.172    48.159  54.629    25.080  5.1753 2.3047 6.6953 1.8236 -1.519996      2.938903  
1 1 1 24 3  15 o 6.7395 1.4684 65.754   22.802  25.363    52.050  75.346    25.366  5.5226 2.4306 7.9564 1.6482 -2.433771      2.936789  
1 1 1 24 3  16 o 10.462 1.4845 144.598  24.585  137.825   53.901  146.376   27.626  9.3642 2.7180 11.560 1.1948 -2.196248      2.969047  
1 1 1 24 3  17 o 4.7241 1.4684 15.874   22.280  18.480    52.275  15.295    24.629  5.1801 2.3459 4.2680 1.7668 0.9121380      2.936772  
1 1 1 24 3  18 o 5.0597 1.5440 20.695   23.351  61.865    51.813  10.202    26.158  6.0753 2.5427 4.0441 1.7523 2.031185       3.088001  
1 1 1 24 3  19 o 3.8426 1.2494 2.1712   22.861  -60.4945  50.954  17.966    25.581  3.5576 1.7742 4.1276 1.7597 -0.5700517     2.498867  
1 1 1 24 3  20 o 6.9220 1.1985 91.787   24.855  -32.1294  56.490  121.537   27.679  3.9390 1.9478 9.9050 1.3972 -5.966032      2.397084  
1 1 1 24 3  21 o 4.4109 1.3847 30.784   23.881  18.974    51.187  34.070    27.000  4.2542 2.0466 4.5676 1.8659 -0.3133631     2.769478  
1 1 1 24 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  0  f 4.5648 1.8041 22.286   30.397  -27.8685  44.306  66.888    41.781  2.9917 2.0813 6.1380 2.9476 -0.000000      0.000000  
1 1 1 24 4  1  o 7.5189 1.3577 70.698   22.720  32.191    32.127  109.225   32.135  5.4103 2.0907 9.6275 1.7326 -4.217244      2.715364  
1 1 1 24 4  2  o 5.3038 1.4016 27.617   21.974  51.011    30.328  1.7637    31.883  6.3576 2.0749 4.2500 1.8848 2.107628       2.803188  
1 1 1 24 4  3  o 4.7087 1.3926 16.056   22.075  21.218    30.396  10.293    32.113  4.8813 1.9852 4.5361 1.9535 0.3452382      2.785191  
1 1 1 24 4  4  o 9.2571 1.3021 107.994  23.734  155.904   33.120  57.419    34.028  11.875 1.3945 6.6389 2.1994 5.236514       2.604195  
1 1 1 24 4  5  o 4.0920 1.2947 4.2326   17.504  -8.0858   43.552  6.6058    19.116  4.5185 2.0818 3.6655 1.5399 0.8530717      2.589453  
1 1 1 24 4  6  f 8.8118 1.4289 97.534   21.239  98.097    46.644  97.386    23.856  8.1870 2.5631 9.4366 1.2640 -1.249626      2.857793  
1 1 1 24 4  7  o 5.2052 1.4633 26.387   18.972  34.799    44.845  24.553    20.938  5.6831 2.3709 4.7273 1.7158 0.9558043      2.926623  
1 1 1 24 4  8  o 3.7741 1.2515 -9.8877  19.002  -24.5748  44.826  -6.6705   20.980  4.2737 2.0155 3.2745 1.4842 0.9991627      2.502986  
1 1 1 24 4  9  o 5.5934 1.5040 32.793   19.880  35.679    46.496  32.148    21.991  5.8963 2.4331 5.2905 1.7687 0.6057816      3.008053  
1 1 1 24 4  10 o 9.7208 1.4538 127.401  22.784  97.786    50.470  134.982   25.534  8.1967 2.6768 11.245 1.1353 -3.048053      2.907587  
1 1 1 24 4  11 o 5.7151 1.5634 24.496   21.017  71.894    48.059  13.287    23.371  7.1763 2.6002 4.2539 1.7366 2.922392       3.126811  
1 1 1 24 4  12 o 10.286 1.3872 116.777  22.906  153.672   51.229  107.559   25.608  10.643 2.4566 9.9299 1.2894 0.7127104      2.774441  
1 1 1 24 4  13 o 9.7235 1.4987 112.446  23.547  131.151   53.493  107.951   26.225  9.5111 2.6912 9.9359 1.3197 -0.4247923     2.997381  
1 1 1 24 4  14 o 11.139 1.4356 134.889  25.022  193.503   58.306  121.657   27.703  11.768 2.5509 10.510 1.3180 1.258106       2.871271  
1 1 1 24 4  15 o 6.5387 1.5426 60.442   23.089  43.171    51.832  64.718    25.789  5.8868 2.5071 7.1905 1.7980 -1.303646      3.085202  
1 1 1 24 4  16 o 4.8707 1.4935 17.947   22.625  31.046    50.194  14.607    25.346  5.4641 2.3963 4.2774 1.7833 1.186645       2.987041  
1 1 1 24 4  17 o 5.3485 1.5586 33.799   22.943  49.579    52.545  30.082    25.503  5.7703 2.4919 4.9267 1.8730 0.8436813      3.117294  
1 1 1 24 4  18 o 5.4686 1.4675 49.946   24.219  12.631    54.389  59.175    27.048  4.6319 2.1951 6.3052 1.9482 -1.673328      2.934906  
1 1 1 24 4  19 o 6.4809 1.4475 77.608   24.583  35.217    54.421  88.474    27.554  4.9411 2.2943 8.0208 1.7655 -3.079703      2.894921  
1 1 1 24 4  20 o 4.7773 1.4729 36.984   23.755  49.636    54.350  33.996    26.411  4.8934 2.2790 4.6611 1.8664 0.2323098      2.945716  
1 1 1 24 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 4  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 5  0  o 4.2517 1.8508 26.916   30.604  24.947    45.362  28.562    41.461  4.2244 2.6352 4.2790 2.5995 -0.000000      0.000000  
1 1 1 24 5  1  o 4.0213 1.2784 -3.8010  21.813  -15.3969  31.288  7.1653    30.427  3.7200 1.7314 4.3227 1.8814 -0.6027453     2.556827  
1 1 1 24 5  2  o 5.6701 1.4732 38.098   22.528  24.566    31.801  51.731    31.920  5.0226 2.0350 6.3177 2.1308 -1.295150      2.946390  
1 1 1 24 5  3  o 3.2313 1.0963 -31.3340 20.509  -41.2790  28.676  -20.9194  29.345  3.0053 1.4658 3.4573 1.6305 -0.4519606     2.192505  
1 1 1 24 5  4  o 7.1418 1.4748 66.316   22.718  53.122    31.558  80.508    32.729  6.3822 2.1182 7.9015 2.0526 -1.519322      2.949565  
1 1 1 24 5  5  o 7.5357 1.4370 72.811   23.269  99.878    33.339  47.102    32.492  8.9939 1.9123 6.0775 2.1454 2.916447       2.873921  
1 1 1 24 5  6  o 7.1609 1.4371 64.444   23.149  36.358    32.447  93.556    33.035  5.6036 2.1169 8.7182 1.9441 -3.114661      2.874147  
1 1 1 24 5  7  o 7.9390 1.4711 79.166   23.946  64.295    33.662  94.400    34.071  7.0985 2.1700 8.7796 1.9867 -1.681106      2.942124  
1 1 1 24 5  8  f 5.2555 1.4495 28.591   19.183  18.156    46.601  30.719    21.049  5.3389 2.3260 5.1721 1.7304 0.1668248      2.899038  
1 1 1 24 5  9  o 6.1962 1.5592 43.681   20.454  55.148    49.189  41.283    22.491  6.5223 2.5678 5.8702 1.7693 0.6521854      3.118305  
1 1 1 24 5  10 o 6.8254 1.4720 61.373   20.518  44.217    47.965  65.215    22.700  6.1413 2.4953 7.5095 1.5623 -1.368236      2.944019  
1 1 1 24 5  11 o 4.3290 1.3104 10.219   19.815  -42.0351  47.430  21.267    21.809  4.0817 1.9652 4.5763 1.7339 -0.4946399     2.620775  
1 1 1 24 5  12 o 8.7674 1.4025 72.872   21.533  157.139   45.926  49.129    24.378  11.181 2.1315 6.3537 1.8232 4.827468       2.804932  
1 1 1 24 5  13 o 7.1933 1.5451 70.036   22.387  60.938    51.397  72.166    24.870  6.5890 2.6150 7.7976 1.6464 -1.208640      3.090110  
1 1 1 24 5  14 o 3.4418 1.1686 -18.7551 19.654  -65.8449  47.644  -9.0985   21.575  3.6899 1.8178 3.1937 1.4692 0.4962468      2.337244  
1 1 1 24 5  15 o 6.5412 1.4045 65.778   23.925  -0.0237   52.299  83.193    26.905  4.8327 2.2456 8.2498 1.6876 -3.417114      2.809041  
1 1 1 24 5  16 o 10.266 1.5268 166.183  26.102  113.517   56.985  180.167   29.364  7.7663 2.8287 12.765 1.1502 -4.998645      3.053621  
1 1 1 24 5  17 o 4.0938 1.3409 4.4526   22.887  -12.2552  52.004  8.4658    25.487  4.3115 2.0713 3.8760 1.7035 0.4354997      2.681830  
1 1 1 24 5  18 o 5.6877 1.6313 49.600   24.751  87.535    55.140  40.027    27.699  6.2083 2.6121 5.1670 1.9549 1.041309       3.262606  
1 1 1 24 5  19 o 4.4851 1.3828 28.085   24.459  -9.3846   53.076  38.187    27.559  4.0669 1.9859 4.9033 1.9247 -0.8363585     2.765514  
1 1 1 24 5  20 o 4.0919 1.2530 18.301   23.317  -76.8849  52.492  41.700    26.026  3.2601 1.6486 4.9237 1.8872 -1.663592      2.505915  
1 1 1 24 5  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 5  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  0  o 8.6090 1.8406 116.734  34.831  47.563    51.092  176.797   47.609  5.0675 2.9782 12.150 2.1636 -0.000000      0.000000  
1 1 1 24 6  1  o 5.7071 1.4805 37.721   23.016  20.911    32.446  54.749    32.655  4.9170 2.0311 6.4973 2.1546 -1.580307      2.961033  
1 1 1 24 6  2  o 5.4630 1.4608 33.946   22.074  40.814    30.772  26.667    31.682  5.7876 2.0830 5.1384 2.0487 0.6491423      2.921674  
1 1 1 24 6  3  o 6.5121 1.6636 52.287   26.572  68.734    45.979  44.040    32.560  7.0420 2.5446 5.9822 2.1438 1.059819       3.327248  
1 1 1 24 6  4  o 5.6178 1.4103 30.980   22.581  62.614    31.987  -0.4510   31.883  7.0291 2.1080 4.2064 1.8741 2.822658       2.820620  
1 1 1 24 6  5  o 6.0340 1.5023 44.068   22.549  41.427    32.002  46.673    31.776  5.8994 2.1241 6.1686 2.1252 -0.2692571     3.004695  
1 1 1 24 6  6  o 8.4720 1.5896 103.127  29.696  122.248   35.309  56.912    54.893  10.310 1.7124 6.6340 2.6786 3.675997       3.179163  
1 1 1 24 6  7  o 9.3666 1.4016 108.415  25.479  92.324    35.902  124.743   36.166  8.5169 2.1169 10.216 1.8376 -1.699420      2.803187  
1 1 1 24 6  8  o 3.6302 1.1941 -24.7880 21.682  2.8973    31.634  -49.3185  29.777  4.2855 1.8901 2.9749 1.4598 1.310630       2.388251  
1 1 1 24 6  9  o 5.5778 1.4458 29.292   23.554  63.492    34.326  -1.1411   32.380  6.9692 2.2012 4.1864 1.8752 2.782776       2.891641  
1 1 1 24 6  10 o 4.0437 1.1670 6.3352   17.417  -37.9672  31.469  25.899    20.912  3.2636 1.5786 4.8239 1.7192 -1.560333      2.333960  
1 1 1 24 6  11 o 4.9585 1.4424 21.964   20.546  3.7016    48.328  25.993    22.699  5.0201 2.2661 4.8970 1.7851 0.1230597      2.884703  
1 1 1 24 6  12 o 6.7912 1.6415 55.761   23.127  83.959    50.623  48.324    25.998  7.3964 2.6704 6.1860 1.9097 1.210471       3.283020  
1 1 1 24 6  13 o 6.9950 1.3390 75.004   22.244  8.6431    51.374  90.316    24.677  5.0312 2.2967 8.9589 1.3773 -3.927757      2.677964  
1 1 1 24 6  14 o 4.2397 1.3164 6.8567   22.023  -52.5101  49.621  21.420    24.577  3.9122 1.9124 4.5673 1.8096 -0.6550643     2.632881  
1 1 1 24 6  15 o 7.3210 1.5054 84.172   23.691  55.452    54.804  90.772    26.273  5.9900 2.5652 8.6519 1.5764 -2.661927      3.010845  
1 1 1 24 6  16 o 4.0037 1.3528 -11.4769 22.741  18.404    52.228  -18.4676  25.262  4.9002 2.2655 3.1073 1.4793 1.792922       2.705649  
1 1 1 24 6  17 o 4.4413 1.4065 17.487   21.954  36.607    46.928  12.131    24.839  4.9802 2.2419 3.9025 1.6992 1.077685       2.813098  
1 1 1 24 6  18 o 4.4099 1.4390 15.884   22.930  54.299    55.004  7.8041    25.227  5.1376 2.3569 3.6821 1.6518 1.455414       2.878069  
1 1 1 24 6  19 o 3.7280 1.2898 -9.1383  24.166  33.821    53.143  -20.3372  27.133  4.4825 2.1372 2.9735 1.4447 1.509008       2.579676  
1 1 1 24 6  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 6  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  0  o 8.4139 2.1846 107.055  34.230  132.419   52.345  88.107    45.244  9.5218 3.1045 7.3059 3.0744 -0.000000      0.000000  
1 1 1 24 7  1  o 10.026 1.2683 117.858  24.185  74.606    32.913  168.626   35.658  7.6920 2.0865 12.360 1.4425 -4.668151      2.536601  
1 1 1 24 7  2  o 11.533 1.1043 149.897  25.343  163.714   35.601  135.704   36.084  12.150 1.4651 10.917 1.6527 1.233284       2.208575  
1 1 1 24 7  3  o 4.7491 1.4066 14.926   22.859  25.946    31.924  3.3303    32.748  5.1449 2.0549 4.3533 1.9214 0.7916570      2.813247  
1 1 1 24 7  4  o 5.7546 1.3953 31.311   22.946  72.018    33.045  -6.5905   31.887  7.4979 2.1130 4.0114 1.8227 3.486506       2.790516  
1 1 1 24 7  5  f 4.8750 1.4096 15.586   23.100  37.600    32.752  -6.2050   32.586  5.6838 2.1311 4.0662 1.8457 1.617593       2.819202  
1 1 1 24 7  6  o 3.7459 1.2322 -19.8606 22.514  -2.4846   33.148  -34.7403  30.675  4.2021 1.8886 3.2897 1.5830 0.9124222      2.464315  
1 1 1 24 7  7  o 11.317 1.2069 150.447  26.131  126.612   37.923  171.994   36.058  10.198 1.9300 12.437 1.4497 -2.238948      2.413830  
1 1 1 24 7  8  o 5.8882 1.4416 37.178   24.481  -3.6899   35.690  73.493    33.643  4.2670 1.9348 7.5094 2.1376 -3.242412      2.883163  
1 1 1 24 7  9  o 3.7576 1.2424 -18.5392 23.239  -25.9988  34.756  -12.5081  31.252  3.7086 1.7567 3.8066 1.7573 -0.9804988E-01 2.484741  
1 1 1 24 7  10 o 7.2529 1.5917 70.354   26.134  55.268    38.668  83.040    35.458  6.4996 2.3355 8.0062 2.1632 -1.506571      3.183368  
1 1 1 24 7  11 o 4.2476 1.3568 -2.6631  24.989  -17.9368  35.536  12.276    35.145  3.8612 1.8126 4.6340 2.0194 -0.7728665     2.713594  
1 1 1 24 7  12 o 5.9132 1.6081 45.909   27.738  28.076    40.671  61.418    37.928  5.2585 2.2295 6.5679 2.3180 -1.309384      3.216164  
1 1 1 24 7  13 o 8.5379 1.4502 105.716  23.249  77.643    47.858  114.388   26.599  6.9784 2.5840 10.097 1.3171 -3.118839      2.900323  
1 1 1 24 7  14 o 6.2605 1.6573 44.662   23.114  101.632   52.838  31.181    25.704  7.5161 2.7260 5.0050 1.8857 2.511095       3.314601  
1 1 1 24 7  15 o 6.6073 1.5701 70.382   24.371  60.165    54.037  72.991    27.306  5.8723 2.5315 7.3423 1.8579 -1.470065      3.140112  
1 1 1 24 7  16 o 4.3223 1.3880 15.769   22.530  17.233    51.422  15.421    25.063  4.6134 2.1705 4.0311 1.7307 0.5822945      2.776041  
1 1 1 24 7  17 o 6.4289 1.5348 78.491   24.913  65.210    55.775  81.801    27.845  5.3940 2.4347 7.4637 1.8694 -2.069708      3.069577  
1 1 1 24 7  18 o 5.3793 1.4540 57.988   23.769  38.116    49.839  63.838    27.042  4.5931 2.1532 6.1656 1.9544 -1.572488      2.907907  
1 1 1 24 7  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 7  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  0  o 11.003 1.9531 155.461  37.000  202.973   57.930  122.727   48.085  12.770 2.5568 9.2360 2.9532 -0.000000      0.000000  
1 1 1 24 8  1  o 5.7196 1.4580 37.534   22.603  54.517    30.802  17.719    33.271  6.5713 2.0862 4.8679 2.0375 1.703436       2.916050  
1 1 1 24 8  2  o 7.4381 1.2910 64.253   24.231  6.3283    34.226  122.463   34.310  4.5197 1.9805 10.357 1.6565 -5.836813      2.581934  
1 1 1 24 8  3  o 9.3526 1.3373 104.845  24.572  124.073   35.562  87.278    33.992  10.372 1.7143 8.3330 2.0530 2.039138       2.674625  
1 1 1 24 8  4  o 15.137 0.9404 250.744  28.462  247.129   40.521  254.264   39.986  15.010 1.3498 15.264 1.3098 -0.2546368     1.880856  
1 1 1 24 8  5  o 5.9365 1.4543 40.691   23.825  68.586    32.401  7.8560    35.154  7.2915 2.1047 4.5815 2.0074 2.710004       2.908524  
1 1 1 24 8  6  o 4.9959 1.4583 20.247   23.795  34.357    35.577  8.8267    32.007  5.5315 2.1819 4.4603 1.9355 1.071197       2.916599  
1 1 1 24 8  7  o 8.4547 1.4952 90.213   25.346  111.527   37.963  73.072    34.045  9.4117 2.0728 7.4976 2.1555 1.914149       2.990429  
1 1 1 24 8  8  o 3.9000 1.2722 -13.5090 23.120  -4.7604   33.684  -21.3021  31.791  4.1616 1.8840 3.6384 1.7101 0.5232151      2.544358  
1 1 1 24 8  9  f 8.7947 1.5106 104.060  26.912  78.223    39.583  126.269   36.698  7.4593 2.3646 10.130 1.8806 -2.670812      3.021228  
1 1 1 24 8  10 o 10.710 1.3561 142.131  28.350  160.761   41.847  126.327   38.542  11.496 1.8201 9.9233 2.0109 1.572437       2.712287  
1 1 1 24 8  11 o 9.2048 1.5231 114.631  27.731  97.340    39.318  131.747   39.118  8.3050 2.2921 10.105 2.0064 -1.799610      3.046246  
1 1 1 24 8  12 o 5.4412 1.5857 34.758   28.233  49.021    40.694  21.521    39.203  5.9255 2.3347 4.9569 2.1465 0.9685373      3.171462  
1 1 1 24 8  13 o 7.0187 1.6963 77.482   29.123  97.396    42.571  59.966    39.927  7.8221 2.4486 6.2153 2.3482 1.606787       3.392563  
1 1 1 24 8  14 o 4.2254 1.3682 0.9996   26.666  -21.3431  37.046  25.022    38.414  3.6642 1.7571 4.7867 2.0979 -1.122457      2.736484  
1 1 1 24 8  15 o 5.9777 1.4187 63.962   23.733  13.161    55.448  75.355    26.260  4.6066 2.1927 7.3487 1.8008 -2.742119      2.837347  
1 1 1 24 8  16 o 6.9573 1.5887 88.595   25.008  93.782    54.804  87.231    28.104  6.1331 2.5935 7.7815 1.8356 -1.648402      3.177346  
1 1 1 24 8  17 o 6.3271 1.4334 84.345   25.264  41.908    57.763  94.383    28.094  4.6753 2.2288 7.9789 1.8029 -3.303666      2.866754  
1 1 1 24 8  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 8  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  0  o 3.3463 1.6030 -9.2107  31.313  -2.8240   48.196  -13.8755  41.190  3.5824 2.4020 3.1101 2.1234 -0.000000      0.000000  
1 1 1 24 9  1  o 4.8965 1.4167 16.593   22.749  -1.4334   30.374  39.622    34.331  4.0512 1.8153 5.7418 2.1755 -1.690671      2.833334  
1 1 1 24 9  2  o 5.3906 1.5933 24.302   27.498  45.101    46.829  13.356    33.972  6.0848 2.4680 4.6964 2.0156 1.388382       3.186524  
1 1 1 24 9  3  o 9.5164 1.4244 113.300  26.268  106.999   37.406  119.430   36.896  9.1768 2.0854 9.8560 1.9408 -0.6792269     2.848812  
1 1 1 24 9  4  o 5.7612 1.5199 37.347   24.202  56.216    35.400  20.787    33.164  6.5664 2.2437 4.9561 2.0508 1.610234       3.039788  
1 1 1 24 9  5  o 3.8570 1.2651 -17.1982 23.196  -3.2561   34.933  -28.1939  31.023  4.2722 1.9277 3.4419 1.6388 0.8302569      2.530154  
1 1 1 24 9  6  f 8.7312 1.5170 99.010   26.515  84.349    38.237  112.589   36.799  7.9401 2.2848 9.5224 1.9961 -1.582293      3.033922  
1 1 1 24 9  7  o 5.3594 1.5168 31.850   24.863  24.264    36.038  38.740    34.347  5.0877 2.1242 5.6312 2.1657 -0.5434580     3.033582  
1 1 1 24 9  8  o 4.5307 1.3998 6.2751   25.399  -20.1159  37.834  27.925    34.268  3.9228 1.8505 5.1386 2.1009 -1.215740      2.799669  
1 1 1 24 9  9  o 6.7721 1.6277 65.169   27.057  81.659    38.237  48.632    38.291  7.5572 2.3132 5.9870 2.2905 1.570204       3.255352  
1 1 1 24 9  10 o 5.1054 1.4890 16.799   27.123  58.304    39.668  -19.6407  37.169  6.3460 2.3520 3.8649 1.8265 2.481109       2.977902  
1 1 1 24 9  11 o 5.0129 1.4899 20.244   27.718  -14.9315  40.737  50.566    37.823  4.0801 1.9233 5.9457 2.2760 -1.865586      2.979831  
1 1 1 24 9  12 f 4.4919 1.3973 -4.7377  27.361  -54.2567  38.075  48.139    39.345  3.2703 1.6137 5.7134 2.2815 -2.443018      2.794505  
1 1 1 24 9  13 o 4.7362 1.4841 21.577   28.801  50.173    41.854  -4.1434   39.694  5.4541 2.2842 4.0184 1.8955 1.435680       2.968280  
1 1 1 24 9  14 o 4.4762 1.4460 17.798   28.847  19.515    41.719  16.226    39.931  4.5311 2.0689 4.4212 2.0208 0.1099472      2.892011  
1 1 1 24 9  15 o 4.0482 1.3299 3.6368   26.959  28.392    37.083  -24.1109  39.261  4.5647 2.0282 3.5318 1.7209 1.032862       2.659870  
1 1 1 24 9  16 o 5.1098 1.5564 55.002   28.765  57.977    42.852  52.562    38.807  5.1451 2.2361 5.0744 2.1654 0.7070160E-01  3.112731  
1 1 1 24 9  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 9  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 0  o 3.0969 1.4935 -46.9919 31.141  -124.5140 45.172  23.218    42.988  2.0543 1.5141 4.1395 2.5747 -0.000000      0.000000  
1 1 1 24 10 1  o 6.2049 1.5166 46.801   23.538  29.922    31.826  67.180    34.971  5.2809 2.0697 7.1289 2.2173 -1.848033      3.033127  
1 1 1 24 10 2  o 6.3587 1.5636 52.624   24.329  53.894    35.330  51.478    33.553  6.4115 2.2390 6.3060 2.1831 0.1055455      3.127163  
1 1 1 24 10 3  o 8.1597 1.5444 88.850   25.870  79.107    37.188  97.987    36.011  7.6171 2.2704 8.7023 2.0944 -1.085234      3.088841  
1 1 1 24 10 4  o 5.6801 1.5308 39.606   24.701  26.778    36.060  50.945    33.903  5.1688 2.1386 6.1914 2.1908 -1.022665      3.061616  
1 1 1 24 10 5  o 4.1329 1.3268 -2.5713  23.714  1.0367    35.295  -5.5400   32.016  4.3017 1.9396 3.9642 1.8110 0.3374279      2.653638  
1 1 1 24 10 6  o 5.7225 1.4941 37.986   23.902  65.401    35.513  15.284    32.317  6.8387 2.2460 4.6063 1.9711 2.232313       2.988265  
1 1 1 24 10 7  o 6.4656 1.5695 58.798   26.308  33.634    39.926  78.106    34.975  5.4189 2.2469 7.5123 2.1920 -2.093330      3.139024  
1 1 1 24 10 8  o 4.6586 1.4280 13.634   25.464  -6.9630   39.701  28.030    33.191  4.2500 1.9685 5.0671 2.0692 -0.8171077     2.855966  
1 1 1 24 10 9  o 4.7144 1.4597 12.741   26.316  33.035    40.031  -2.7034   34.923  5.3172 2.2308 4.1115 1.8831 1.205711       2.919349  
1 1 1 24 10 10 o 11.273 1.4200 175.464  29.930  105.961   42.983  240.878   41.700  8.2138 2.4392 14.332 1.4548 -6.118108      2.840084  
1 1 1 24 10 11 o 7.1182 1.6887 83.986   28.582  78.158    43.111  88.557    38.179  6.7424 2.4597 7.4939 2.3144 -0.7515049     3.377385  
1 1 1 24 10 12 o 3.3625 1.1680 -36.8097 26.905  -37.1120  40.780  -36.5767  35.804  3.4639 1.7015 3.2612 1.6004 0.2026970      2.335937  
1 1 1 24 10 13 o 5.0545 1.3235 4.9018   26.228  -91.9602  38.396  89.636    35.912  2.7832 1.4078 7.3259 2.2417 -4.542702      2.647071  
1 1 1 24 10 14 o 4.7607 1.4928 35.848   27.998  41.050    43.140  32.063    36.802  4.8830 2.1774 4.6385 2.0426 0.2445097      2.985516  
1 1 1 24 10 15 f 4.7282 1.4950 42.742   28.742  48.812    43.863  38.175    38.049  4.8402 2.1742 4.6161 2.0525 0.2241087      2.990017  
1 1 1 24 10 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 10 23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 0  o 7.1700 1.6690 54.992   35.489  174.051   52.941  -42.1657  47.825  11.474 2.6511 2.8663 2.0284 -0.000000      0.000000  
1 1 1 24 11 1  o 4.9689 1.4592 20.288   24.933  -0.6340   34.996  41.856    35.532  4.2277 1.9165 5.7101 2.2009 -1.482435      2.918415  
1 1 1 24 11 2  o 4.0224 1.2891 -8.2618  23.147  -30.2063  32.090  15.540    33.420  3.3970 1.6306 4.6479 1.9971 -1.250869      2.578276  
1 1 1 24 11 3  o 7.8888 1.5776 86.446   25.996  82.619    36.096  90.570    37.472  7.7105 2.2203 8.0671 2.2419 -0.3565755     3.155265  
1 1 1 24 11 4  o 5.0810 1.4985 25.998   25.241  32.362    37.513  20.733    34.120  5.3281 2.1905 4.8340 2.0454 0.4940891      2.996993  
1 1 1 24 11 5  o 4.8034 1.4640 18.361   25.461  21.048    37.691  16.105    34.530  4.9300 2.1197 4.6768 2.0198 0.2532306      2.927944  
1 1 1 24 11 6  o 6.1015 1.5709 48.064   25.852  77.707    39.210  25.269    34.384  7.2336 2.3592 4.9695 2.0749 2.264169       3.141802  
1 1 1 24 11 7  o 4.6199 1.4286 13.606   25.266  27.082    36.863  1.6662    34.699  5.0397 2.1289 4.2001 1.9057 0.8395967      2.857230  
1 1 1 24 11 8  o 5.1668 1.4739 28.859   25.809  -2.8187   37.547  57.234    35.536  4.1533 1.9204 6.1804 2.2364 -2.027054      2.947800  
1 1 1 24 11 9  o 4.7665 1.4767 21.246   27.424  6.4107    42.004  32.269    36.206  4.4639 2.0522 5.0692 2.1238 -0.6053252     2.953314  
1 1 1 24 11 10 o 7.4312 1.7079 97.406   29.082  119.277   44.223  80.740    38.603  8.1330 2.4874 6.7293 2.3410 1.403676       3.415760  
1 1 1 24 11 11 o 4.2789 1.3875 11.881   26.997  6.4065    38.982  16.928    37.425  4.1715 1.9385 4.3864 1.9858 -0.2149086     2.775094  
1 1 1 24 11 12 o 4.0888 1.3360 5.1388   26.457  -18.4769  38.163  26.991    36.710  3.6087 1.7438 4.5689 2.0246 -0.9602730     2.671993  
1 1 1 24 11 13 o 5.1480 1.5555 48.016   29.015  76.718    43.153  24.332    39.199  5.9008 2.3776 4.3953 2.0063 1.505527       3.110986  
1 1 1 24 11 14 o 4.4775 1.4080 10.820   28.338  83.637    42.541  -47.2664  37.995  5.8929 2.3655 3.0620 1.5279 2.830958       2.816043  
1 1 1 24 11 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 11 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 0  o 3.1384 1.5483 -25.9526 35.030  -20.4180  52.044  -30.5372  47.367  3.2908 2.2814 2.9861 2.0937 -0.000000      0.000000  
1 1 1 24 12 1  o 7.6180 1.7751 89.613   30.646  96.475    52.287  86.022    37.824  7.5289 2.7146 7.7071 2.2880 -0.1782341     3.550198  
1 1 1 24 12 2  o 5.1718 1.5022 28.520   25.520  46.215    36.883  12.268    35.347  5.7980 2.2403 4.5456 2.0018 1.252361       3.004320  
1 1 1 24 12 3  o 8.8280 1.5463 110.870  27.614  90.277    40.420  128.892   37.813  7.7305 2.3804 9.9255 1.9743 -2.195063      3.092594  
1 1 1 24 12 4  o 9.4004 1.7778 135.341  32.649  130.587   39.036  146.411   59.563  9.8567 2.0471 8.9442 2.9073 0.9124575      3.555682  
1 1 1 24 12 5  o 4.0983 1.3340 -1.8052  25.130  -6.5715   38.401  1.7647    33.234  4.1036 1.9126 4.0930 1.8602 0.1055861E-01  2.668043  
1 1 1 24 12 6  o 5.1538 1.5181 33.219   26.311  23.035    39.487  41.350    35.284  4.8605 2.1287 5.4471 2.1651 -0.5865803     3.036279  
1 1 1 24 12 7  f 5.0280 1.5197 27.205   27.549  55.420    41.926  5.7673    36.546  5.8213 2.3443 4.2346 1.9346 1.586754       3.039477  
1 1 1 24 12 8  o 4.6007 1.4452 18.004   27.335  51.647    41.093  -8.6995   36.610  5.4229 2.2666 3.7785 1.7936 1.644427       2.890412  
1 1 1 24 12 9  o 4.4869 1.4246 20.321   26.662  27.082    38.048  13.798    37.372  4.6704 2.0657 4.3035 1.9623 0.3669558      2.849185  
1 1 1 24 12 10 o 5.4142 1.5674 51.790   28.488  29.805    43.018  68.963    38.019  4.7294 2.1361 6.0989 2.2942 -1.369429      3.134722  
1 1 1 24 12 11 o 3.8887 1.3038 -0.4344  26.865  7.1131    40.949  -6.1373   35.595  4.0899 1.9280 3.6875 1.7556 0.4023695      2.607588  
1 1 1 24 12 12 o 4.1609 1.3698 10.487   27.809  47.916    42.360  -17.8652  36.867  4.8820 2.1685 3.4399 1.6742 1.442113       2.739578  
1 1 1 24 12 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 12 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 0  f 5.1726 2.1008 58.342   37.053  31.970    55.017  80.232    50.126  4.2946 2.7682 6.0506 3.1609 -0.000000      0.000000  
1 1 1 24 13 1  o 4.5340 1.4145 13.587   25.671  -3.4711   36.334  30.591    36.276  4.0496 1.8783 5.0185 2.1154 -0.9689579     2.828976  
1 1 1 24 13 2  f 4.2095 1.3523 4.8467   24.964  -3.9530   35.532  13.424    35.081  3.9919 1.8536 4.4271 1.9696 -0.4351606     2.704650  
1 1 1 24 13 3  o 3.5186 1.1965 -24.3052 24.644  -28.2646  36.611  -21.0249  33.324  3.5331 1.7074 3.5041 1.6767 0.2895331E-01  2.392994  
1 1 1 24 13 4  o 4.0852 1.3220 0.9882   25.631  -28.8558  38.728  24.250    34.191  3.5608 1.7291 4.6095 2.0003 -1.048649      2.644078  
1 1 1 24 13 5  o 4.6018 1.4275 25.403   25.337  35.922    36.540  15.661    35.165  4.9151 2.0994 4.2884 1.9347 0.6266570      2.854909  
1 1 1 24 13 6  o 4.7191 1.4218 24.472   25.885  -9.5646   37.546  55.300    35.733  3.7859 1.8026 5.6523 2.1992 -1.866469      2.843580  
1 1 1 24 13 7  o 5.6769 1.5724 55.668   26.896  38.700    39.016  71.033    37.127  5.0280 2.1591 6.3258 2.2864 -1.297822      3.144746  
1 1 1 24 13 8  o 5.8745 1.6464 66.670   28.658  74.301    42.673  60.402    38.677  6.0661 2.3906 5.6830 2.2643 0.3830748      3.292706  
1 1 1 24 13 9  o 3.4146 1.1777 -27.1940 26.562  -48.1067  39.569  -10.0394  35.838  3.2081 1.5940 3.6210 1.7342 -0.4128635     2.355456  
1 1 1 24 13 10 o 4.4070 1.4232 27.505   28.205  18.255    42.117  35.028    37.980  4.2218 1.9792 4.5922 2.0457 -0.3704972     2.846439  
1 1 1 24 13 11 o 4.8337 1.5018 47.984   27.929  51.157    41.229  45.294    37.967  4.8901 2.1573 4.7772 2.0898 0.1129742      3.003539  
1 1 1 24 13 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 13 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 0  o 3.3140 1.6033 -1.6308  34.301  -25.9923  54.811  14.052    43.977  3.0986 2.1887 3.5293 2.3434 -0.000000      0.000000  
1 1 1 24 14 1  o 5.0874 1.5002 40.169   25.369  40.973    36.491  39.416    35.293  5.1123 2.1362 5.0626 2.1069 0.4968691E-01  3.000457  
1 1 1 24 14 2  o 4.0444 1.2816 -13.9250 24.113  46.454    35.722  -64.4658  32.683  5.3254 2.1571 2.7634 1.3846 2.561927       2.563217  
1 1 1 24 14 3  o 5.0583 1.4762 36.273   25.165  59.838    36.594  15.133    34.661  5.8411 2.2381 4.2755 1.9255 1.565636       2.952387  
1 1 1 24 14 4  o 4.5649 1.4334 24.555   25.834  32.735    39.871  18.636    33.917  4.8023 2.1198 4.3274 1.9301 0.4749055      2.866876  
1 1 1 24 14 5  o 5.3680 1.5443 47.496   26.441  76.820    40.658  26.005    34.807  6.2282 2.3656 4.5078 1.9857 1.720378       3.088516  
1 1 1 24 14 6  o 5.5470 1.5524 58.518   26.930  39.743    41.266  72.447    35.542  4.8625 2.1510 6.2316 2.2391 -1.369065      3.104848  
1 1 1 24 14 7  o 4.7475 1.4747 37.760   27.522  25.310    41.393  47.627    36.847  4.4275 2.0361 5.0675 2.1339 -0.6400247     2.949400  
1 1 1 24 14 8  o 3.7576 1.2598 0.1910   25.836  -18.6108  37.329  17.479    35.795  3.4321 1.6736 4.0831 1.8834 -0.6510100     2.519543  
1 1 1 24 14 9  o 4.7753 1.4921 45.202   28.021  58.093    41.134  34.039    38.276  5.0908 2.2016 4.4597 2.0146 0.6311126      2.984213  
1 1 1 24 14 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 14 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 0  o 5.2997 3.0578 79.238   52.284  0.0000    0.0000  79.238    52.284  5.2997 3.0578 5.2997 3.0578 -0.000000      0.000000  
1 1 1 24 15 1  o 5.6196 1.6157 64.884   28.483  63.008    40.294  66.757    40.268  5.5513 2.2749 5.6879 2.2950 -0.1366062     3.231448  
1 1 1 24 15 2  o 4.1769 1.3623 13.056   26.886  34.373    38.719  -6.7931   37.363  4.6525 2.0695 3.7013 1.7722 0.9511342      2.724616  
1 1 1 24 15 3  o 6.0480 1.6509 77.948   28.877  94.408    41.191  62.039    40.495  6.6618 2.4082 5.4342 2.2589 1.227577       3.301826  
1 1 1 24 15 4  o 3.7003 1.2578 -5.4814  27.233  -10.2005  40.411  -1.5553   36.860  3.6743 1.7800 3.7262 1.7775 -0.5196691E-01 2.515571  
1 1 1 24 15 5  o 4.3665 1.4047 27.768   27.169  42.840    38.806  13.277    38.051  4.7298 2.0894 4.0031 1.8781 0.7266574      2.809437  
1 1 1 24 15 6  o 3.3080 1.1476 -23.5100 25.929  -23.6918  37.751  -23.3477  35.674  3.3414 1.6405 3.2746 1.6051 0.6674790E-01  2.295156  
1 1 1 24 15 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 15 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 16 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 17 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 18 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 19 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 20 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 24 21 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 1  0  o 1.8776 1.3197 -18.9109 19.170  0.0000    0.0000  -18.9109  19.170  1.8776 1.3197 1.8776 1.3197 -0.000000      0.000000  
1 1 1 25 1  1  f 8.4448 1.0979 84.664   17.616  63.004    26.181  102.582   23.813  7.1649 1.8227 9.7247 1.2244 -2.559781      2.195747  
1 1 1 25 1  2  o 6.1748 1.2266 44.910   16.626  26.908    22.772  65.464    24.332  4.9276 1.7892 7.4220 1.6785 -2.494416      2.453288  
1 1 1 25 1  3  o 5.3647 1.2687 33.798   16.059  37.289    22.704  30.304    22.718  5.5874 1.7929 5.1420 1.7954 0.4454370      2.537354  
1 1 1 25 1  4  o 4.9174 1.2707 25.754   16.122  21.962    21.146  31.018    24.914  4.6117 1.7156 5.2231 1.8748 -0.6113815     2.541350  
1 1 1 25 1  5  o 3.2839 1.0359 -9.5216  14.627  -26.4611  20.287  8.8187    21.109  2.6550 1.2801 3.9128 1.6290 -1.257765      2.071792  
1 1 1 25 1  6  o 9.8399 0.9245 105.100  17.928  83.548    24.502  129.938   26.303  8.6923 1.4094 10.988 1.1970 -2.295359      1.849081  
1 1 1 25 1  7  f 5.5112 1.2321 36.116   15.315  40.894    21.526  31.219    21.793  5.8387 1.7243 5.1836 1.7605 0.6550498      2.464252  
1 1 1 25 1  8  o 5.6842 1.3768 42.626   20.198  -4.5763   47.805  52.884    22.285  4.7389 2.1825 6.6296 1.6789 -1.890660      2.753610  
1 1 1 25 1  9  o 5.5399 1.2908 39.496   20.534  -32.0917  45.174  58.140    23.053  4.1146 1.9642 6.9652 1.6754 -2.850555      2.581625  
1 1 1 25 1  10 o 6.2704 1.5255 47.481   20.280  43.787    49.709  48.218    22.212  6.1727 2.5278 6.3680 1.7086 -0.1952658     3.051053  
1 1 1 25 1  11 o 9.7862 1.4320 105.373  21.960  138.965   51.751  97.996    24.252  10.057 2.5649 9.5155 1.2743 0.5414314      2.863996  
1 1 1 25 1  12 o 4.1463 1.3201 1.6742   20.117  -29.2784  47.548  8.4225    22.202  4.3277 2.0513 3.9649 1.6623 0.3627703      2.640282  
1 1 1 25 1  13 o 13.427 1.2191 198.699  25.597  225.390   58.812  192.462   28.431  13.378 2.1981 13.476 1.0548 -0.9860420E-01 2.438122  
1 1 1 25 1  14 o 4.7884 1.4772 14.090   21.208  7.1240    54.717  15.322    23.006  5.2628 2.3899 4.3140 1.7368 0.9488654      2.954346  
1 1 1 25 1  15 f 7.3949 1.4656 79.294   23.559  35.253    54.732  89.310    26.101  5.8732 2.5397 8.9167 1.4636 -3.043509      2.931269  
1 1 1 25 1  16 o 4.2836 1.4060 -10.1224 21.187  29.755    50.646  -18.5816  23.327  5.5082 2.4116 3.0590 1.4461 2.449176       2.811913  
1 1 1 25 1  17 o 4.6462 1.3863 17.670   23.213  -39.4141  51.819  32.001    25.964  4.1647 2.0172 5.1277 1.9023 -0.9629688     2.772690  
1 1 1 25 1  18 o 8.4411 1.4558 121.216  26.132  56.954    57.702  137.797   29.310  5.9306 2.5859 10.952 1.3382 -5.020888      2.911625  
1 1 1 25 1  19 o 5.6817 1.4810 58.487   25.302  9.2685    62.881  67.996    27.638  4.6241 2.2354 6.7394 1.9435 -2.115301      2.962085  
1 1 1 25 1  20 o 4.1840 1.3584 13.789   24.116  -10.1854  55.378  19.400    26.790  4.1913 2.0426 4.1767 1.7912 0.1451492E-01  2.716707  
1 1 1 25 1  21 o 4.3275 1.4250 11.264   23.979  76.942    51.529  -6.8905   27.091  5.3930 2.3937 3.2620 1.5469 2.130969       2.850047  
1 1 1 25 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  0  o 10.795 1.2721 125.904  26.463  0.0000    0.0000  125.904   26.463  10.795 1.2721 10.795 1.2721 -0.000000      0.000000  
1 1 1 25 2  1  o 8.8968 1.1174 92.047   18.809  130.927   27.193  56.385    26.044  11.009 1.2351 6.7848 1.8626 4.224011       2.234871  
1 1 1 25 2  2  o 4.7144 1.1412 19.482   15.490  43.830    21.342  -7.6192   22.517  6.0656 1.6942 3.3633 1.5295 2.702337       2.282465  
1 1 1 25 2  3  o 4.0764 1.1419 13.643   13.752  12.247    18.356  15.429    20.761  3.9272 1.5614 4.2256 1.6667 -0.2983882     2.283886  
1 1 1 25 2  4  o 12.464 1.2413 180.091  23.316  181.686   51.976  179.689   26.089  11.867 2.2728 13.061 0.9987 -1.194470      2.482536  
1 1 1 25 2  5  o 8.0107 1.3923 91.505   20.681  51.752    47.677  100.719   22.953  6.3497 2.5190 9.6717 1.1866 -3.321994      2.784516  
1 1 1 25 2  6  o 7.7866 1.4708 77.347   20.938  75.525    47.601  77.784    23.315  7.2041 2.5909 8.3691 1.3929 -1.164959      2.941617  
1 1 1 25 2  7  f 5.7315 1.5313 23.934   19.781  81.262    46.465  11.244    21.861  7.4274 2.5692 4.0356 1.6671 3.391788       3.062673  
1 1 1 25 2  8  o 8.5549 1.4168 107.139  21.388  60.551    50.154  117.495   23.646  6.6363 2.5989 10.473 1.1289 -3.837015      2.833516  
1 1 1 25 2  9  o 7.0216 1.5169 65.017   22.010  47.992    49.589  69.194    24.561  6.3347 2.5501 7.7085 1.6433 -1.373826      3.033714  
1 1 1 25 2  10 o 4.7483 1.4109 17.332   19.541  2.1246    47.170  20.483    21.470  4.9502 2.2363 4.5464 1.7209 0.4038382      2.821744  
1 1 1 25 2  11 o 6.3526 1.5780 46.530   21.214  59.496    49.186  43.567    23.513  6.6912 2.5866 6.0140 1.8082 0.6772342      3.155965  
1 1 1 25 2  12 o 5.1298 1.5050 21.843   20.787  29.292    49.556  20.253    22.898  5.6889 2.4378 4.5707 1.7654 1.118224       3.009947  
1 1 1 25 2  13 o 7.2508 1.5219 72.851   22.529  50.387    53.052  77.793    24.884  6.3212 2.6026 8.1804 1.5782 -1.859174      3.043738  
1 1 1 25 2  14 o 4.3207 1.3817 4.4503   20.537  -28.3249  55.469  9.6569    22.108  4.6414 2.2046 3.9999 1.6664 0.6415334      2.763483  
1 1 1 25 2  15 o 7.0788 1.6798 59.136   23.496  105.327   53.442  48.068    26.160  8.0407 2.7568 6.1169 1.9202 1.923797       3.359646  
1 1 1 25 2  16 o 10.569 1.5523 146.492  25.709  155.933   58.713  144.252   28.596  9.7304 2.8403 11.407 1.2535 -1.676273      3.104629  
1 1 1 25 2  17 f 7.4856 1.7226 73.957   24.961  123.943   56.865  62.027    27.781  8.2016 2.8419 6.7696 1.9474 1.432021       3.445118  
1 1 1 25 2  18 o 4.4223 1.3309 15.593   24.113  -65.8109  52.129  37.752    27.197  3.6590 1.8199 5.1857 1.9424 -1.526636      2.661759  
1 1 1 25 2  19 o 5.6517 1.4119 55.652   23.814  -2.5242   56.246  68.358    26.286  4.3992 2.1236 6.9042 1.8613 -2.504998      2.823863  
1 1 1 25 2  20 o 4.5933 1.4577 30.387   25.320  33.828    56.727  29.531    28.295  4.6890 2.2278 4.4977 1.8804 0.1913486      2.915332  
1 1 1 25 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 2  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  0  o 4.4980 1.9317 32.393   32.392  30.038    47.192  34.490    44.541  4.4383 2.7322 4.5576 2.7314 -0.000000      0.000000  
1 1 1 25 3  1  o 4.8096 1.3238 22.240   16.884  26.111    32.304  20.784    19.805  5.1329 2.0610 4.4863 1.6621 0.6465588      2.647695  
1 1 1 25 3  2  o 9.2382 1.3736 91.906   20.710  130.152   46.748  82.566    23.101  9.8047 2.4027 8.6717 1.3320 1.132947       2.747211  
1 1 1 25 3  3  o 5.6340 1.3994 40.597   21.007  -3.1965   46.617  51.755    23.531  4.7458 2.1744 6.5222 1.7622 -1.776412      2.798826  
1 1 1 25 3  4  o 6.3488 1.2345 58.958   20.770  -34.7044  50.599  77.938    22.778  4.3073 2.0623 8.3902 1.3574 -4.082878      2.468932  
1 1 1 25 3  5  o 8.2879 1.4883 87.089   21.121  90.627    50.187  86.327    23.283  7.7242 2.6702 8.8517 1.3152 -1.127535      2.976529  
1 1 1 25 3  6  o 4.1437 1.2923 5.1717   19.663  -28.3103  43.527  13.756    22.040  4.1098 1.9523 4.1776 1.6936 -0.6781864E-01 2.584527  
1 1 1 25 3  7  o 6.0802 1.5894 31.803   20.440  81.305    49.464  21.609    22.446  7.5235 2.6480 4.6370 1.7585 2.886522       3.178709  
1 1 1 25 3  8  o 5.2284 1.4233 29.260   19.724  1.0732    47.472  35.142    21.684  4.9688 2.2441 5.4880 1.7513 -0.5191646     2.846592  
1 1 1 25 3  9  o 9.6621 1.4846 123.381  23.065  103.677   52.403  128.116   25.686  8.3923 2.7269 10.932 1.1748 -2.539623      2.969209  
1 1 1 25 3  10 o 4.3068 1.3160 8.4060   19.952  -41.2739  47.533  19.031    21.982  4.1306 1.9833 4.4830 1.7303 -0.3523688     2.631946  
1 1 1 25 3  11 o 6.9221 1.6195 51.394   21.517  92.729    50.243  42.111    23.811  7.9494 2.6733 5.8948 1.8290 2.054586       3.239080  
1 1 1 25 3  12 o 4.1802 1.3545 -1.6625  21.200  -12.7316  48.628  0.9351    23.557  4.6375 2.1584 3.7229 1.6369 0.9145641      2.708924  
1 1 1 25 3  13 o 6.4073 1.5784 21.008   21.823  119.984   52.403  0.2411    24.004  9.0765 2.6927 3.7381 1.6477 5.338319       3.156867  
1 1 1 25 3  14 o 5.3532 1.5677 26.420   22.495  49.572    52.028  21.097    24.948  6.1037 2.5507 4.6027 1.8234 1.500984       3.135406  
1 1 1 25 3  15 o 7.8728 1.5725 91.414   24.702  75.179    55.141  95.490    27.629  6.8015 2.7056 8.9442 1.6034 -2.142706      3.145072  
1 1 1 25 3  16 o 4.9252 1.4496 26.211   23.071  -6.2464   52.503  33.979    25.684  4.6566 2.1915 5.1938 1.8980 -0.5371761     2.899137  
1 1 1 25 3  17 o 5.1889 1.5586 31.899   23.962  43.349    56.780  29.417    26.432  5.5264 2.4787 4.8515 1.8904 0.6749206      3.117268  
1 1 1 25 3  18 o 5.6113 1.3637 54.960   24.729  -42.1939  60.333  74.578    27.111  4.0125 1.9893 7.2100 1.8658 -3.197482      2.727324  
1 1 1 25 3  19 o 4.2103 1.3751 14.941   23.894  11.568    54.448  15.746    26.591  4.4174 2.1214 4.0033 1.7502 0.4140859      2.750176  
1 1 1 25 3  20 o 5.2604 1.4676 57.770   25.025  33.822    56.835  63.530    27.872  4.4852 2.1574 6.0355 1.9901 -1.550321      2.935120  
1 1 1 25 3  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 3  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  0  o 5.1529 2.0652 46.571   33.877  72.184    50.604  25.770    45.604  6.0687 3.1744 4.2371 2.6427 -0.000000      0.000000  
1 1 1 25 4  1  o 3.8357 1.2541 -12.1360 22.574  -8.4496   33.125  -15.3324  30.845  3.9875 1.8292 3.6839 1.7161 0.3035293      2.508131  
1 1 1 25 4  2  o 10.094 1.3178 125.746  25.522  148.824   35.054  99.714    37.230  11.443 1.5317 8.7452 2.1449 2.697728       2.635671  
1 1 1 25 4  3  o 4.2565 1.3219 1.4727   22.236  -14.4872  30.986  18.419    31.929  3.7226 1.7294 4.7903 1.9997 -1.067681      2.643776  
1 1 1 25 4  4  o 5.5999 1.2390 40.334   16.967  9.5972    32.478  51.871    19.898  4.5177 1.9550 6.6821 1.5228 -2.164443      2.478095  
1 1 1 25 4  5  o 6.1391 1.3818 51.137   20.764  -0.0403   48.339  62.716    22.993  4.9428 2.2452 7.3354 1.6113 -2.392620      2.763601  
1 1 1 25 4  6  o 7.8406 1.5327 76.118   21.914  80.597    48.720  74.982    24.536  7.5954 2.6306 8.0857 1.5739 -0.4903078     3.065468  
1 1 1 25 4  7  o 8.2968 1.5641 77.840   21.674  111.230   52.057  70.838    23.839  8.7620 2.7019 7.8315 1.5766 0.9305005      3.128242  
1 1 1 25 4  8  o 7.2396 1.6020 59.184   21.214  89.822    50.968  52.764    23.331  7.8434 2.6921 6.6358 1.7375 1.207665       3.204080  
1 1 1 25 4  9  o 7.2441 1.5612 67.683   22.321  64.216    50.868  68.510    24.840  6.8574 2.6360 7.6307 1.6737 -0.7733307     3.122475  
1 1 1 25 4  10 o 6.5013 1.6223 45.901   21.553  78.631    50.972  38.775    23.784  7.3319 2.6746 5.6708 1.8367 1.661130       3.244512  
1 1 1 25 4  11 o 5.5308 1.5177 34.192   21.423  24.190    50.510  36.386    23.656  5.5453 2.4186 5.5162 1.8341 0.2907801E-01  3.035358  
1 1 1 25 4  12 o 6.6011 1.6202 52.267   22.530  66.827    51.633  48.843    25.039  6.8945 2.6544 6.3077 1.8588 0.5868473      3.240472  
1 1 1 25 4  13 o 3.4372 1.1691 -22.8642 20.844  -75.4694  48.003  -10.6411  23.139  3.6054 1.7851 3.2690 1.5101 0.3364682      2.338161  
1 1 1 25 4  14 o 9.8192 1.5230 113.589  24.874  160.061   54.963  101.620   27.894  10.237 2.6603 9.4015 1.4835 0.8352566      3.045928  
1 1 1 25 4  15 o 5.3664 1.5987 22.172   24.474  72.391    53.158  8.6633    27.570  6.6139 2.6481 4.1189 1.7918 2.494997       3.197316  
1 1 1 25 4  16 o 5.8201 1.4649 52.044   24.128  4.9570    53.075  64.310    27.089  4.7561 2.2272 6.8842 1.9036 -2.128029      2.929872  
1 1 1 25 4  17 o 3.7595 1.3033 -19.6199 23.064  20.878    53.997  -28.6572  25.508  4.6804 2.2087 2.8386 1.3840 1.841757       2.606512  
1 1 1 25 4  18 o 5.2163 1.3768 44.081   25.523  -43.2659  54.216  68.951    28.930  3.7993 1.8839 6.6333 2.0082 -2.833990      2.753583  
1 1 1 25 4  19 o 3.4480 1.1841 -14.3815 24.658  -56.4259  51.709  -2.0070   28.053  3.4591 1.7343 3.4370 1.6125 0.2211046E-01  2.368146  
1 1 1 25 4  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 4  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  0  o 4.2813 1.9099 22.513   34.726  23.857    49.456  21.205    48.770  4.3272 2.7217 4.2355 2.6801 -0.000000      0.000000  
1 1 1 25 5  1  o 5.4933 1.5067 32.363   23.685  37.094    34.211  28.007    32.823  5.7067 2.1694 5.2799 2.0915 0.4268150      3.013399  
1 1 1 25 5  2  o 14.046 0.9795 216.553  27.401  231.905   38.204  200.291   39.322  14.628 1.3059 13.465 1.4602 1.163230       1.958946  
1 1 1 25 5  3  o 6.1516 1.4864 44.605   27.887  -32.8280  51.314  77.058    33.221  4.4652 2.1207 7.8380 2.0834 -3.372824      2.972895  
1 1 1 25 5  4  o 8.8429 1.3939 95.820   24.043  88.942    34.061  102.651   33.943  8.4602 2.0374 9.2257 1.9028 -0.7655306     2.787741  
1 1 1 25 5  5  o 6.6593 1.5044 54.985   24.574  27.021    34.793  82.820    34.712  5.2674 2.1305 8.0513 2.1247 -2.783958      3.008900  
1 1 1 25 5  6  o 8.6755 1.7611 89.118   30.100  64.233    35.447  153.453   56.994  7.0029 2.2395 10.348 2.7186 -3.345284      3.522235  
1 1 1 25 5  7  o 5.1299 1.3902 26.150   18.552  34.113    34.461  22.901    22.015  5.5583 2.1605 4.7016 1.7502 0.8566747      2.780469  
1 1 1 25 5  8  o 4.8886 1.4200 21.527   20.842  -10.0388  49.262  28.409    23.002  4.7418 2.1950 5.0354 1.8021 -0.2935867     2.840025  
1 1 1 25 5  9  o 4.3076 1.3470 7.3222   20.077  -23.1040  48.606  13.582    22.046  4.4399 2.0953 4.1753 1.6934 0.2645946      2.694080  
1 1 1 25 5  10 o 6.4044 1.3954 57.659   21.450  1.4902    51.138  69.652    23.629  5.0573 2.3019 7.7514 1.5778 -2.694090      2.790772  
1 1 1 25 5  11 o 5.9671 1.6172 31.084   22.073  80.678    51.238  19.782    24.460  7.3544 2.6818 4.5798 1.8083 2.774628       3.234442  
1 1 1 25 5  12 o 6.0959 1.5430 48.984   22.075  42.035    50.282  50.643    24.569  5.8610 2.4816 6.3307 1.8343 -0.4696984     3.085989  
1 1 1 25 5  13 o 4.6149 1.4649 9.1162   23.491  16.150    52.162  7.3267    26.310  5.1834 2.3457 4.0465 1.7553 1.136947       2.929749  
1 1 1 25 5  14 o 6.2097 1.4824 57.690   23.660  16.780    52.905  67.918    26.452  5.1378 2.3396 7.2816 1.8211 -2.143775      2.964825  
1 1 1 25 5  15 o 5.8365 1.4115 51.777   23.222  0.5563    48.549  66.974    26.444  4.5698 2.1368 7.1032 1.8449 -2.533421      2.823017  
1 1 1 25 5  16 o 3.7428 1.2586 -5.9607  23.612  -42.9772  53.154  3.1398    26.356  3.8284 1.8924 3.6572 1.6600 0.1712368      2.517273  
1 1 1 25 5  17 o 3.8688 1.2727 2.6920   22.736  -26.9900  48.426  11.084    25.750  3.8585 1.8868 3.8791 1.7084 -0.2067614E-01 2.545309  
1 1 1 25 5  18 o 4.4320 1.4344 24.772   25.253  30.472    58.396  23.460    28.008  4.6181 2.2123 4.2458 1.8264 0.3723755      2.868790  
1 1 1 25 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 5  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  0  o 4.1623 1.8438 14.495   32.733  45.578    48.923  -10.6962  44.042  5.0273 2.9328 3.2973 2.2356 -0.000000      0.000000  
1 1 1 25 6  1  o 5.6462 1.4318 29.746   24.062  -8.6625   34.223  67.293    33.837  4.0864 1.8689 7.2059 2.1697 -3.119539      2.863665  
1 1 1 25 6  2  o 6.3794 1.5601 51.830   24.300  46.747    34.283  56.961    34.447  6.1227 2.1992 6.6361 2.2136 -0.5133462     3.120286  
1 1 1 25 6  3  o 5.4306 1.5162 30.771   24.438  23.692    34.051  38.289    35.094  5.1165 2.0933 5.7447 2.1940 -0.6282806     3.032414  
1 1 1 25 6  4  o 6.7932 1.4729 55.764   23.781  88.310    34.799  27.245    32.575  8.3642 2.0870 5.2223 2.0789 3.141908       2.945754  
1 1 1 25 6  5  o 4.7131 1.3803 2.1836   24.151  43.493    34.856  -35.9569  33.493  5.9769 2.2068 3.4494 1.6584 2.527517       2.760501  
1 1 1 25 6  6  o 4.6017 1.4039 10.688   23.547  8.4393    34.324  12.688    32.363  4.5730 1.9941 4.6304 1.9768 -0.5744267E-01 2.807889  
1 1 1 25 6  7  o 7.3610 1.5953 72.659   25.763  68.966    37.477  75.967    35.474  7.1439 2.3047 7.5782 2.2066 -0.4342728     3.190672  
1 1 1 25 6  8  o 4.9202 1.4104 14.559   23.621  44.134    33.709  -13.9710  33.109  5.9647 2.1752 3.8758 1.7961 2.088833       2.820835  
1 1 1 25 6  9  o 5.7377 1.5567 37.092   25.748  22.236    37.179  50.784    35.692  5.1558 2.1555 6.3196 2.2466 -1.163741      3.113481  
1 1 1 25 6  10 o 4.8300 1.4572 17.467   20.471  23.134    48.122  16.215    22.620  5.3609 2.3488 4.2990 1.7252 1.061872       2.914312  
1 1 1 25 6  11 o 5.0440 1.4471 0.3004   20.283  76.003    44.947  -19.0569  22.728  7.0856 2.5209 3.0023 1.4217 4.083301       2.894173  
1 1 1 25 6  12 o 4.5261 1.3866 13.808   22.752  -32.7112  52.146  24.746    25.286  4.2933 2.0655 4.7590 1.8504 -0.4657359     2.773119  
1 1 1 25 6  13 o 5.8222 1.6372 41.050   24.517  67.030    53.534  34.155    27.579  6.4245 2.6262 5.2200 1.9559 1.204486       3.274491  
1 1 1 25 6  14 o 7.6752 1.6456 60.215   24.169  173.210   55.276  33.507    26.874  10.258 2.6688 5.0924 1.9259 5.165645       3.291139  
1 1 1 25 6  15 o 3.9418 1.3364 -6.7922  22.836  21.050    52.681  -13.2344  25.340  4.7181 2.2124 3.1655 1.4996 1.552587       2.672751  
1 1 1 25 6  16 o 3.8578 1.2651 2.1317   22.698  -54.4258  54.090  14.220    25.007  3.7326 1.8560 3.9830 1.7195 -0.2504001     2.530153  
1 1 1 25 6  17 o 3.6815 1.2495 -5.0746  24.377  -40.3001  55.594  3.3100    27.124  3.7721 1.8767 3.5909 1.6502 0.1811583      2.498999  
1 1 1 25 6  18 o 5.5296 1.5106 65.127   24.908  58.290    52.702  67.093    28.264  4.8780 2.2624 6.1811 2.0022 -1.303118      3.021164  
1 1 1 25 6  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 6  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  0  o 4.3290 1.9174 23.797   33.965  36.865    52.035  14.096    44.832  4.7421 2.8954 3.9159 2.5143 -0.000000      0.000000  
1 1 1 25 7  1  o 6.2633 1.5677 49.770   24.627  54.252    34.599  45.167    35.062  6.4856 2.2182 6.0409 2.2160 0.4447279      3.135494  
1 1 1 25 7  2  o 5.3527 1.4176 21.689   23.973  -17.0630  33.709  61.346    34.101  3.8458 1.7923 6.8596 2.1969 -3.013808      2.835263  
1 1 1 25 7  3  o 9.7006 1.3938 116.526  26.519  88.441    37.531  144.531   37.478  8.1977 2.2299 11.203 1.6726 -3.005699      2.787514  
1 1 1 25 7  4  o 17.666 0.8930 339.809  31.444  372.709   44.783  307.815   44.162  18.573 1.2056 16.758 1.3176 1.815063       1.785909  
1 1 1 25 7  5  o 6.1432 1.5836 48.020   25.287  52.941    36.438  43.450    35.120  6.3642 2.2692 5.9222 2.2095 0.4420152      3.167170  
1 1 1 25 7  6  o 5.9882 1.5597 44.006   25.150  31.543    37.144  54.558    34.176  5.4801 2.2067 6.4963 2.2047 -1.016225      3.119311  
1 1 1 25 7  7  o 5.0572 1.4628 17.851   25.473  -11.7419  38.001  42.000    34.328  4.2131 1.9424 5.9014 2.1878 -1.688257      2.925639  
1 1 1 25 7  8  o 8.9360 1.5686 106.566  28.023  96.142    40.458  116.178   38.851  8.3670 2.3310 9.5049 2.0997 -1.137888      3.137264  
1 1 1 25 7  9  o 7.2629 1.6734 75.808   27.900  75.844    40.156  75.774    38.793  7.2413 2.3887 7.2845 2.3443 -0.4323387E-01 3.346881  
1 1 1 25 7  10 o 6.4871 1.6473 58.036   27.781  79.783    41.187  39.882    37.631  7.3442 2.4191 5.6300 2.2366 1.714133       3.294537  
1 1 1 25 7  11 o 5.2195 1.5527 28.021   28.205  12.248    41.505  41.554    38.446  4.7795 2.1332 5.6595 2.2567 -0.8800282     3.105362  
1 1 1 25 7  12 o 5.0928 1.4187 31.129   19.666  24.762    42.488  32.865    22.185  5.0660 2.2136 5.1196 1.7750 -0.5367708E-01 2.837397  
1 1 1 25 7  13 o 5.3240 1.5916 25.486   23.675  77.564    53.673  12.906    26.380  6.5007 2.6403 4.1473 1.7780 2.353367       3.183137  
1 1 1 25 7  14 o 7.6377 1.6027 97.451   25.118  107.761   50.940  94.139    28.871  7.0215 2.6524 8.2538 1.7997 -1.232325      3.205353  
1 1 1 25 7  15 o 5.7282 1.6026 56.074   25.333  66.791    56.427  53.369    28.350  5.6175 2.4986 5.8388 2.0076 -0.2213397     3.205202  
1 1 1 25 7  16 o 6.5206 1.3074 84.615   25.806  -14.0774  57.037  110.016   28.937  4.0819 2.0066 8.9594 1.6765 -4.877495      2.614782  
1 1 1 25 7  17 f 4.3466 1.4331 21.908   24.271  64.614    57.285  12.564    26.795  4.9444 2.3148 3.7488 1.6902 1.195577       2.866231  
1 1 1 25 7  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 7  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  0  o 2.7870 1.4003 -49.7329 33.353  -66.7277  51.690  -37.6096  43.658  2.7638 1.9819 2.8103 1.9786 -0.000000      0.000000  
1 1 1 25 8  1  o 4.2923 1.3554 0.2457   23.787  -5.3514   33.412  5.9982    33.873  4.1160 1.8685 4.4686 1.9639 -0.3526816     2.710772  
1 1 1 25 8  2  o 3.4104 1.1894 -61.8677 26.614  -41.1385  43.956  -73.8649  33.440  3.9421 1.8965 2.8787 1.4359 1.063400       2.378734  
1 1 1 25 8  3  o 6.7340 1.5310 56.135   25.365  86.160    36.303  27.494    35.456  8.1657 2.1815 5.3023 2.1486 2.863361       3.061914  
1 1 1 25 8  4  o 7.4904 1.3300 67.779   26.387  -1.5755   38.994  126.363   35.839  4.5113 2.0361 10.469 1.7116 -5.958145      2.659904  
1 1 1 25 8  5  o 3.6572 1.2219 -30.7692 23.951  -3.4263   34.804  -55.3677  33.011  4.2295 1.9149 3.0849 1.5185 1.144600       2.443844  
1 1 1 25 8  6  f 6.4000 1.5311 53.058   25.196  26.347    35.966  78.803    35.309  5.1598 2.1355 7.6403 2.1948 -2.480513      3.062208  
1 1 1 25 8  7  o 4.3049 1.3679 -9.5061  25.426  28.096    38.804  -37.7969  33.659  5.2466 2.1985 3.3632 1.6282 1.883357       2.735731  
1 1 1 25 8  8  o 12.436 1.2020 184.505  29.833  182.734   43.358  186.096   41.111  12.305 1.7618 12.567 1.6357 -0.2623081     2.404057  
1 1 1 25 8  9  o 5.9130 1.6226 45.228   27.493  63.921    42.014  31.230    36.359  6.5673 2.4232 5.2587 2.1586 1.308654       3.245252  
1 1 1 25 8  10 o 5.0880 1.4320 7.8508   28.014  -63.4432  41.309  68.561    38.120  3.3735 1.6677 6.8025 2.3283 -3.429025      2.863958  
1 1 1 25 8  11 o 7.6962 1.7407 95.883   30.745  83.786    44.950  106.519   42.147  7.0827 2.5209 8.3096 2.4010 -1.226896      3.481316  
1 1 1 25 8  12 f 7.0353 1.6834 83.029   30.492  51.817    44.300  111.129   42.034  5.7162 2.3682 8.3545 2.3931 -2.638293      3.366803  
1 1 1 25 8  13 o 4.0010 1.3465 -5.3657  29.776  -17.9389  43.264  5.9497    41.043  3.8219 1.8492 4.1802 1.9578 -0.3582795     2.693028  
1 1 1 25 8  14 o 4.8564 1.5215 32.132   29.852  51.551    42.604  13.401    41.842  5.3566 2.2769 4.3561 2.0188 1.000421       3.043020  
1 1 1 25 8  15 f 3.7106 1.2764 -17.8104 22.773  34.045    48.140  -32.7600  25.848  4.6811 2.1680 2.7401 1.3477 1.941017       2.552741  
1 1 1 25 8  16 o 6.3000 1.5388 88.020   26.443  76.014    59.516  90.973    29.517  5.1067 2.3805 7.4933 1.9506 -2.386512      3.077575  
1 1 1 25 8  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 8  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  0  f 3.3782 1.6305 -12.2052 34.223  -10.8146  49.897  -13.4405  47.028  3.4491 2.3500 3.3073 2.2608 -0.000000      0.000000  
1 1 1 25 9  1  o 3.9446 1.2939 -14.0815 24.614  -1.7948   34.826  -26.3445  34.792  4.2294 1.9150 3.6598 1.7405 0.5695863      2.587824  
1 1 1 25 9  2  o 6.2948 1.4947 46.424   25.873  89.010    37.084  6.0345    36.115  8.0954 2.2227 4.4941 1.9989 3.601343       2.989304  
1 1 1 25 9  3  o 5.1894 1.4732 26.935   24.485  45.631    33.977  6.7358    35.316  5.9105 2.1795 4.4683 1.9826 1.442151       2.946302  
1 1 1 25 9  4  o 6.0420 1.4816 42.168   26.320  -4.5461   38.457  83.329    36.099  4.2944 1.9703 7.7895 2.2131 -3.495078      2.963108  
1 1 1 25 9  5  o 4.2940 1.3757 -0.1583  25.568  -8.1205   38.088  6.3726    34.495  4.1847 1.9347 4.4032 1.9563 -0.2185078     2.751354  
1 1 1 25 9  6  o 6.3510 1.5274 45.662   27.061  99.184    40.533  2.6200    36.349  8.3393 2.3367 4.3628 1.9677 3.976576       3.054811  
1 1 1 25 9  7  o 6.6829 1.4978 55.280   26.704  107.200   38.990  9.4063    36.649  8.8201 2.2137 4.5458 2.0182 4.274208       2.995605  
1 1 1 25 9  8  o 4.3850 1.4092 -2.4152  27.441  21.507    40.179  -23.3276  37.566  4.9745 2.1636 3.7956 1.8061 1.178892       2.818343  
1 1 1 25 9  9  o 6.2592 1.6337 59.167   28.660  35.366    42.785  78.540    38.600  5.3558 2.2793 7.1626 2.3410 -1.806782      3.267352  
1 1 1 25 9  10 o 6.2569 1.4727 45.401   28.294  111.306   40.178  -19.4410  39.852  8.6281 2.2902 3.8857 1.8521 4.742469       2.945372  
1 1 1 25 9  11 o 4.8781 1.4900 26.488   29.019  -10.6268  43.219  56.957    39.160  4.0127 1.9171 5.7435 2.2816 -1.730743      2.980074  
1 1 1 25 9  12 o 4.4345 1.4210 10.196   29.173  -28.6449  42.573  44.579    40.056  3.6647 1.7871 5.2044 2.2099 -1.539634      2.842055  
1 1 1 25 9  13 o 4.5339 1.4520 23.434   28.458  35.688    41.015  12.058    39.519  4.8347 2.1413 4.2331 1.9618 0.6016574      2.904086  
1 1 1 25 9  14 f 5.5026 1.6157 63.968   30.518  42.211    44.469  83.337    41.958  4.8220 2.1755 6.1832 2.3893 -1.361141      3.231333  
1 1 1 25 9  15 o 5.1903 1.5210 52.386   30.219  -0.1305   44.412  97.661    41.236  3.8536 1.8667 6.5271 2.4019 -2.673418      3.041995  
1 1 1 25 9  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 9  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 0  o 3.9155 1.8084 12.065   35.631  -8.5812   53.984  28.002    47.431  3.5692 2.4352 4.2617 2.6742 -0.000000      0.000000  
1 1 1 25 10 1  o 3.8505 1.2783 -17.0201 25.070  -24.0890  35.905  -10.2953  35.020  3.7256 1.7707 3.9755 1.8440 -0.2499733     2.556524  
1 1 1 25 10 2  o 5.0642 1.4926 24.762   25.617  11.012    36.556  38.029    35.909  4.6009 2.0304 5.5275 2.1883 -0.9265604     2.985157  
1 1 1 25 10 3  o 5.5256 1.5391 38.088   25.180  44.687    35.174  31.151    36.063  5.7989 2.2008 5.2524 2.1522 0.5464754      3.078250  
1 1 1 25 10 4  o 7.1717 1.4759 68.518   26.234  23.413    36.663  115.844   37.555  4.9760 2.1136 9.3673 2.0606 -4.391294      2.951847  
1 1 1 25 10 5  o 7.0190 1.6685 73.244   27.619  74.328    41.092  72.352    37.301  7.0002 2.4164 7.0378 2.3013 -0.3752756E-01 3.336929  
1 1 1 25 10 6  o 7.6460 1.5792 82.557   28.125  128.701   41.679  43.979    38.110  9.6109 2.2139 5.6810 2.2527 3.929901       3.158487  
1 1 1 25 10 7  o 5.8895 1.6136 51.187   28.175  33.219    42.600  65.160    37.564  5.2610 2.2575 6.5181 2.3061 -1.257113      3.227164  
1 1 1 25 10 8  o 4.9100 1.4855 22.659   27.431  -3.6447   40.095  45.803    37.611  4.2059 1.9583 5.6141 2.2342 -1.408128      2.970948  
1 1 1 25 10 9  o 7.8121 1.7589 105.499  30.960  126.320   46.719  89.196    41.340  8.4800 2.5486 7.1441 2.4248 1.335845       3.517822  
1 1 1 25 10 10 o 5.4549 1.5167 44.019   29.114  -9.7232   43.169  88.856    39.431  3.9520 1.8955 6.9579 2.3681 -3.005945      3.033303  
1 1 1 25 10 11 o 11.086 1.5021 184.957  32.349  180.470   48.176  188.642   43.655  10.540 2.3459 11.631 1.8766 -1.091762      3.004114  
1 1 1 25 10 12 o 4.3568 1.3981 12.436   28.039  49.970    39.961  -23.9616  39.352  5.1865 2.2049 3.5270 1.7195 1.659511       2.796148  
1 1 1 25 10 13 o 4.4594 1.4401 16.482   29.754  70.936    45.036  -25.6979  39.636  5.4926 2.3381 3.4261 1.6819 2.066510       2.880145  
1 1 1 25 10 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 10 22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 0  o 3.2640 1.6001 -18.9263 36.021  -21.0668  54.002  -17.2106  48.347  3.3190 2.3064 3.2091 2.2186 -0.000000      0.000000  
1 1 1 25 11 1  o 6.2623 1.6689 60.264   31.220  25.569    52.011  79.807    39.035  5.2686 2.3671 7.2560 2.3533 -1.987339      3.337795  
1 1 1 25 11 2  o 5.1689 1.4640 18.617   25.672  68.188    39.182  -18.6702  33.982  6.6646 2.3555 3.6732 1.7391 2.991388       2.927981  
1 1 1 25 11 3  o 4.8782 1.4640 16.529   26.628  50.788    38.669  -14.3670  36.722  5.8767 2.2874 3.8796 1.8280 1.997045       2.928081  
1 1 1 25 11 4  o 7.4065 1.8726 89.660   33.499  70.380    40.925  128.807   58.316  6.6222 2.3995 8.1907 2.8757 -1.568515      3.745266  
1 1 1 25 11 5  o 6.3685 1.6374 63.381   27.183  73.341    38.900  53.877    38.000  6.7924 2.3507 5.9446 2.2800 0.8477240      3.274762  
1 1 1 25 11 6  o 5.1507 1.4704 29.164   27.219  -17.2222  41.675  63.671    35.944  3.9563 1.8880 6.3451 2.2547 -2.388817      2.940789  
1 1 1 25 11 7  o 5.5112 1.4800 41.283   27.945  -16.0293  41.806  87.573    37.571  3.8580 1.8544 7.1644 2.3072 -3.306379      2.960048  
1 1 1 25 11 8  o 4.7658 1.4473 24.669   28.028  -20.0828  42.415  59.359    37.343  3.7695 1.8256 5.7621 2.2464 -1.992576      2.894679  
1 1 1 25 11 9  o 3.4067 1.1750 -33.0025 26.375  -52.7342  38.820  -16.0835  35.947  3.1988 1.5875 3.6145 1.7326 -0.4157555     2.349921  
1 1 1 25 11 10 o 6.9003 1.6467 91.964   29.730  57.141    42.627  124.945   41.484  5.4130 2.2881 8.3877 2.3688 -2.974734      3.293366  
1 1 1 25 11 11 o 3.9371 1.3272 -1.2811  28.690  21.005    43.047  -19.0916  38.482  4.3489 2.0263 3.5254 1.7146 0.8235414      2.654410  
1 1 1 25 11 12 o 4.6027 1.4718 37.508   30.144  12.899    44.491  58.392    40.986  4.0766 1.9469 5.1289 2.2079 -1.052340      2.943656  
1 1 1 25 11 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 11 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 0  o 3.8302 1.7977 11.019   35.228  42.607    56.591  -8.9658   45.013  4.4972 2.8627 3.1633 2.1752 -0.000000      0.000000  
1 1 1 25 12 1  o 7.7033 1.6501 95.875   27.710  86.405    38.437  106.123   39.985  7.2560 2.3333 8.1506 2.3339 -0.8946133     3.300187  
1 1 1 25 12 2  o 4.2221 1.3715 5.8897   26.655  -3.8769   38.364  15.004    37.061  4.0185 1.8855 4.4256 1.9923 -0.4070411     2.743054  
1 1 1 25 12 3  o 4.0398 1.3266 1.4659   26.036  -11.0118  38.230  12.258    35.555  3.8238 1.8202 4.2559 1.9303 -0.4321077     2.653157  
1 1 1 25 12 4  o 5.6802 1.3876 33.245   27.635  -52.3479  40.490  107.885   37.810  3.2656 1.6208 8.0948 2.2528 -4.829258      2.775285  
1 1 1 25 12 5  o 4.5730 1.4418 18.735   27.302  49.260    40.917  -5.7629   36.655  5.3206 2.2449 3.8254 1.8097 1.495190       2.883520  
1 1 1 25 12 6  o 3.8892 1.3035 -8.6910  26.972  9.2983    40.243  -23.3636  36.344  4.2697 1.9791 3.5086 1.6969 0.7610896      2.607009  
1 1 1 25 12 7  o 3.9851 1.3240 0.7590   26.873  2.1149    39.044  -0.4616   37.043  4.0409 1.8980 3.9292 1.8465 0.1117625      2.648019  
1 1 1 25 12 8  o 4.4934 1.4379 19.911   28.230  50.008    41.898  -5.1101   38.203  5.1767 2.2303 3.8101 1.8153 1.366587       2.875728  
1 1 1 25 12 9  o 6.8061 1.7149 99.036   30.122  87.808    44.790  108.306   40.700  6.2015 2.4475 7.4107 2.4029 -1.209126      3.429869  
1 1 1 25 12 10 o 4.5625 1.4686 30.348   29.947  68.086    44.953  0.2379    40.154  5.3243 2.3020 3.8007 1.8243 1.523542       2.937288  
1 1 1 25 12 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 12 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 0  o 5.4490 2.0041 55.164   39.141  -28.4332  58.124  124.524   52.944  3.1463 2.2285 7.7516 3.3316 -0.000000      0.000000  
1 1 1 25 13 1  o 4.0624 1.3442 1.4606   27.447  -9.1390   39.731  11.137    37.961  3.8771 1.8484 4.2476 1.9521 -0.3705270     2.688302  
1 1 1 25 13 2  o 4.7320 1.4685 27.255   27.763  4.2662    39.899  48.832    38.656  4.1288 1.9327 5.3353 2.2114 -1.206460      2.936946  
1 1 1 25 13 3  o 3.1823 1.1101 -47.7648 25.442  -14.0600  36.061  -81.1713  35.901  3.6228 1.7362 2.7419 1.3838 0.8808367      2.220249  
1 1 1 25 13 4  o 3.7683 1.2584 -21.6595 26.350  30.684    37.896  -70.6484  36.662  4.6700 2.0638 2.8666 1.4404 1.803382       2.516737  
1 1 1 25 13 5  o 3.8859 1.3058 -3.1573  27.922  -18.5901  41.058  10.121    38.085  3.6652 1.7800 4.1067 1.9109 -0.4414184     2.611511  
1 1 1 25 13 6  o 3.8826 1.3055 -0.9491  27.908  -13.3297  41.137  9.6075    37.987  3.7139 1.7984 4.0514 1.8930 -0.3374670     2.611074  
1 1 1 25 13 7  o 5.0325 1.5528 51.518   29.402  59.589    43.222  44.566    40.114  5.2216 2.2575 4.8434 2.1327 0.3781953      3.105584  
1 1 1 25 13 8  o 3.6915 1.2569 -3.5152  27.452  -4.3782   38.977  -2.6658   38.671  3.6808 1.7746 3.7021 1.7804 -0.2122688E-01 2.513784  
1 1 1 25 13 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 13 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 0  o 2.8179 2.0026 -27.0508 48.343  0.0000    0.0000  -27.0508  48.343  2.8179 2.0026 2.8179 2.0026 -0.000000      0.000000  
1 1 1 25 14 1  o 3.0808 1.0835 -50.7165 26.256  -82.1838  37.976  -21.9008  36.340  2.7695 1.4007 3.3921 1.6535 -0.6226256     2.167023  
1 1 1 25 14 2  o 3.1285 1.1008 -49.3384 26.296  -15.9232  38.696  -78.0064  35.842  3.5534 1.7262 2.7036 1.3666 0.8497140      2.201690  
1 1 1 25 14 3  o 3.7117 1.2477 -15.0205 27.046  -67.1421  39.330  31.737    37.252  2.9411 1.4797 4.4823 2.0092 -1.541223      2.495319  
1 1 1 25 14 4  o 4.8627 1.5168 48.395   28.886  46.007    42.876  50.379    39.088  4.7733 2.1464 4.9521 2.1439 -0.1788125     3.033679  
1 1 1 25 14 5  o 5.8396 1.6445 80.017   29.118  72.260    42.036  87.172    40.372  5.5140 2.2975 6.1651 2.3535 -0.6510887     3.288996  
1 1 1 25 14 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 14 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 15 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 16 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 17 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 18 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 19 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 25 20 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  0  o 3.3960 2.0091 16.417   23.524  0.0000    0.0000  16.417    23.524  3.3960 2.0091 3.3960 2.0091 -0.000000      0.000000  
1 1 1 26 1  1  f 12.782 0.8137 175.218  20.724  157.960   29.150  192.856   29.469  12.104 1.2041 13.459 1.0948 -1.355216      1.627399  
1 1 1 26 1  2  o 3.9569 1.1777 7.1753   16.212  15.497    22.320  -2.1170   23.586  4.2934 1.7170 3.6204 1.6125 0.6730115      2.355470  
1 1 1 26 1  3  o 7.7253 1.1657 70.393   17.463  69.268    24.599  71.536    24.796  7.6572 1.6545 7.7933 1.6427 -0.1360993     2.331494  
1 1 1 26 1  4  o 7.6375 1.6192 71.648   23.387  96.031    50.499  64.991    26.387  7.9952 2.6802 7.2798 1.8178 0.7154388      3.238480  
1 1 1 26 1  5  f 5.9685 1.2332 40.268   17.036  18.167    22.743  68.520    25.714  4.4189 1.7440 7.5181 1.7439 -3.099237      2.466314  
1 1 1 26 1  6  o 5.8210 1.2658 40.995   17.201  57.373    23.994  23.681    24.670  6.8690 1.7436 4.7729 1.8355 2.096110       2.531615  
1 1 1 26 1  7  o 5.3665 1.2861 33.834   17.092  43.607    22.887  21.510    25.701  6.0051 1.7791 4.7279 1.8578 1.277193       2.572273  
1 1 1 26 1  8  o 13.407 0.7489 189.570  20.016  190.227   29.516  189.011   27.235  13.400 1.1014 13.414 1.0152 -0.1379967E-01 1.497887  
1 1 1 26 1  9  f 11.633 1.5211 186.483  24.673  138.357   59.545  196.458   27.110  9.5908 2.8761 13.675 0.9912 -4.084064      3.042149  
1 1 1 26 1  10 o 10.359 1.5209 145.173  24.963  115.216   55.730  152.692   27.921  8.7758 2.8083 11.942 1.1691 -3.165975      3.041873  
1 1 1 26 1  11 o 5.8413 1.5297 39.438   20.815  37.041    49.109  39.962    22.982  5.9135 2.4752 5.7690 1.7980 0.1444497      3.059331  
1 1 1 26 1  12 o 4.9416 1.3713 24.154   21.629  -44.6553  51.472  38.910    23.836  4.2168 2.0346 5.6664 1.8390 -1.449540      2.742521  
1 1 1 26 1  13 o 6.1691 1.6273 41.056   22.030  61.862    53.572  36.821    24.168  6.7689 2.6750 5.5694 1.8539 1.199537       3.254645  
1 1 1 26 1  14 o 5.3848 1.4740 35.168   22.427  0.9839    52.173  42.917    24.839  4.9314 2.2744 5.8383 1.8755 -0.9069180     2.947932  
1 1 1 26 1  15 o 4.2447 1.3676 2.2636   23.270  -33.8970  53.293  10.782    25.866  4.3290 2.0840 4.1603 1.7714 0.1687102      2.735176  
1 1 1 26 1  16 o 7.1528 1.5491 79.620   25.010  49.001    56.887  86.956    27.845  5.9310 2.5770 8.3745 1.7201 -2.443542      3.098295  
1 1 1 26 1  17 o 8.0375 1.7043 98.195   26.856  118.003   59.498  93.127    30.097  7.6454 2.8712 8.4295 1.8371 -0.7840848     3.408599  
1 1 1 26 1  18 o 3.8139 1.2955 -6.0799  24.340  -20.7726  56.025  -2.6613   27.024  4.1240 2.0193 3.5039 1.6233 0.6200719      2.590918  
1 1 1 26 1  19 o 5.0597 1.4284 43.466   24.636  -8.1435   57.806  54.922    27.234  4.2396 2.0707 5.8797 1.9682 -1.640081      2.856859  
1 1 1 26 1  20 o 4.2778 1.4052 23.170   25.837  28.575    58.617  21.867    28.784  4.4464 2.1516 4.1093 1.8081 0.3371334      2.810436  
1 1 1 26 1  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 1  27 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  0  o 2.4097 1.6392 -9.5967  24.082  0.0000    0.0000  -9.5967   24.082  2.4097 1.6392 2.4097 1.6392 -0.000000      0.000000  
1 1 1 26 2  1  o 4.9491 1.1825 20.849   16.823  -9.0287   23.433  52.626    24.166  3.3618 1.5408 6.5363 1.7941 -3.174482      2.364956  
1 1 1 26 2  2  o 16.410 0.7409 286.640  24.310  296.580   34.646  277.000   34.120  16.700 1.0373 16.120 1.0583 0.5803337      1.481881  
1 1 1 26 2  3  o 6.3551 1.2847 50.220   17.237  54.543    23.417  45.109    25.464  6.6956 1.7347 6.0145 1.8955 0.6810579      2.569418  
1 1 1 26 2  4  o 5.9717 1.5475 38.581   19.733  59.621    47.932  34.287    21.653  6.5783 2.5505 5.3652 1.7533 1.213051       3.095020  
1 1 1 26 2  5  o 9.4189 1.4382 133.437  23.292  68.892    51.434  150.087   26.124  6.9698 2.6574 11.868 1.1006 -4.898219      2.876338  
1 1 1 26 2  6  o 7.1103 1.5841 54.891   20.437  87.821    49.790  48.219    22.412  7.8498 2.6611 6.3708 1.7191 1.478991       3.168119  
1 1 1 26 2  7  o 5.1738 1.5151 21.582   21.210  28.431    49.622  20.051    23.461  5.7374 2.4485 4.6102 1.7852 1.127186       3.030222  
1 1 1 26 2  8  o 9.0230 1.4762 117.620  22.972  72.277    53.601  127.822   25.425  7.1211 2.7134 10.925 1.1636 -3.803885      2.952367  
1 1 1 26 2  9  o 9.8386 1.5080 139.708  24.713  88.504    55.029  152.644   27.659  7.7275 2.7851 11.950 1.1573 -4.222295      3.015939  
1 1 1 26 2  10 o 6.6900 1.5238 60.535   22.499  35.117    52.899  66.148    24.860  5.9191 2.5271 7.4609 1.7034 -1.541839      3.047614  
1 1 1 26 2  11 o 6.2057 1.5119 51.198   22.436  23.113    52.198  57.562    24.848  5.5422 2.4368 6.8692 1.7904 -1.327007      3.023836  
1 1 1 26 2  12 o 4.2667 1.3208 4.3782   21.559  -61.0127  50.501  18.951    23.840  3.9850 1.9439 4.5484 1.7886 -0.5634217     2.641574  
1 1 1 26 2  13 o 11.145 1.5546 180.796  26.145  131.981   59.777  192.343   29.073  8.9071 2.9134 13.383 1.0862 -4.475616      3.109261  
1 1 1 26 2  14 o 4.5968 1.4646 7.0062   22.274  23.179    52.887  3.5191    24.558  5.3751 2.4028 3.8185 1.6754 1.556528       2.929222  
1 1 1 26 2  15 o 5.2878 1.6000 23.914   24.341  56.568    56.231  16.384    27.002  6.1674 2.6186 4.4081 1.8394 1.759377       3.200083  
1 1 1 26 2  16 o 4.7520 1.4895 18.835   24.166  19.406    55.173  18.700    26.882  5.0900 2.3444 4.4139 1.8381 0.6760635      2.979059  
1 1 1 26 2  17 o 3.6762 1.2458 -7.7965  22.370  -48.8217  56.458  -0.1562   24.364  3.8789 1.9232 3.4736 1.5841 0.4052675      2.491617  
1 1 1 26 2  18 o 5.8811 1.7294 48.316   26.680  133.468   63.066  29.754    29.445  7.0987 2.8694 4.6634 1.9313 2.435321       3.458801  
1 1 1 26 2  19 o 4.5295 1.3923 31.095   25.412  -19.7360  58.737  42.800    28.187  4.0035 1.9808 5.0555 1.9570 -1.051929      2.784536  
1 1 1 26 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 2  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  0  o 3.4332 1.5875 7.2775   20.477  11.076    50.772  6.5396    22.378  3.9854 2.6017 2.8810 1.8199 -0.000000      0.000000  
1 1 1 26 3  1  o 6.9962 1.2984 72.423   21.185  0.9701    48.501  89.270    23.550  4.9446 2.2472 9.0479 1.3014 -4.103337      2.596826  
1 1 1 26 3  2  o 4.6610 1.4434 10.930   19.633  12.478    51.144  10.663    21.261  5.3111 2.3694 4.0109 1.6491 1.300230       2.886761  
1 1 1 26 3  3  o 5.4964 1.4721 34.091   20.607  14.529    48.147  38.479    22.801  5.2992 2.3348 5.6936 1.7935 -0.3943686     2.944167  
1 1 1 26 3  4  o 4.4411 1.3323 11.720   19.840  -51.9852  51.610  22.767    21.491  4.1862 2.0241 4.6959 1.7330 -0.5096927     2.664623  
1 1 1 26 3  5  o 5.2392 1.5128 22.010   19.930  38.111    48.744  18.778    21.839  6.0028 2.4853 4.4757 1.7254 1.527115       3.025522  
1 1 1 26 3  6  o 6.7669 1.6117 46.177   21.306  93.775    49.502  35.354    23.605  8.0577 2.6519 5.4761 1.8324 2.581586       3.223399  
1 1 1 26 3  7  o 9.3513 1.5400 112.240  23.835  108.017   54.958  113.218   26.452  8.4977 2.7941 10.205 1.2961 -1.707120      3.080083  
1 1 1 26 3  8  o 6.4296 1.5391 52.525   21.721  41.459    50.382  55.052    24.073  6.0897 2.5245 6.7695 1.7612 -0.6798635     3.078115  
1 1 1 26 3  9  o 6.6346 1.4537 61.157   21.359  23.735    51.976  68.761    23.429  5.5800 2.4430 7.6891 1.5764 -2.109155      2.907480  
1 1 1 26 3  10 o 10.742 1.4686 138.109  25.183  154.731   55.167  133.734   28.304  10.409 2.6446 11.074 1.2780 -0.6643982     2.937181  
1 1 1 26 3  11 o 5.8388 1.6077 34.355   22.154  54.572    52.610  29.998    24.425  6.5178 2.6256 5.1599 1.8559 1.357957       3.215307  
1 1 1 26 3  12 o 4.6490 1.4507 12.273   23.713  -4.1576   51.792  16.631    26.673  4.8271 2.2402 4.4708 1.8436 0.3563929      2.901320  
1 1 1 26 3  13 o 4.7611 1.4592 17.856   22.306  1.4221    53.755  21.275    24.517  4.9418 2.2895 4.5803 1.8098 0.3615646      2.918402  
1 1 1 26 3  14 o 6.6671 1.5973 65.532   24.833  49.859    55.997  69.369    27.707  6.0031 2.5825 7.3310 1.8805 -1.327890      3.194607  
1 1 1 26 3  15 f 6.0839 1.5931 55.793   25.192  43.235    55.159  59.102    28.318  5.6321 2.4893 6.5358 1.9887 -0.9037309     3.186203  
1 1 1 26 3  16 o 5.9174 1.6107 56.390   25.158  60.804    57.089  55.326    28.026  5.7182 2.5297 6.1165 1.9945 -0.3982606     3.221443  
1 1 1 26 3  17 o 4.8783 1.5342 26.731   24.551  61.970    56.520  18.535    27.257  5.5387 2.4794 4.2179 1.8077 1.320865       3.068443  
1 1 1 26 3  18 o 6.5661 1.6694 83.802   26.711  105.927   58.881  78.069    29.972  6.1737 2.6518 6.9584 2.0288 -0.7847404     3.338867  
1 1 1 26 3  19 o 3.8109 1.2373 6.3985   24.641  -90.6177  56.057  29.633    27.433  3.2642 1.6565 4.3576 1.8384 -1.093404      2.474587  
1 1 1 26 3  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 3  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  0  o 7.3511 2.3519 94.545   37.447  112.716   56.101  79.942    50.292  8.1027 3.4247 6.5996 3.2246 -0.000000      0.000000  
1 1 1 26 4  1  o 5.4906 1.3886 17.321   24.377  71.876    35.159  -33.1809  33.827  7.4511 2.2045 3.5301 1.6891 3.920962       2.777260  
1 1 1 26 4  2  o 5.4779 1.5183 31.967   24.447  39.195    33.951  24.184    35.231  5.7780 2.1691 5.1778 2.1251 0.6002231      3.036606  
1 1 1 26 4  3  o 5.9296 1.5456 27.882   19.715  79.927    46.685  16.586    21.750  7.5217 2.5767 4.3375 1.7075 3.184192       3.091103  
1 1 1 26 4  4  f 10.411 1.4628 137.743  23.504  126.382   53.112  140.510   26.210  9.3548 2.6931 11.467 1.1428 -2.112377      2.925541  
1 1 1 26 4  5  o 12.877 1.1359 151.552  24.794  268.912   56.353  123.380   27.610  15.098 1.8662 10.656 1.2955 4.442191       2.271819  
1 1 1 26 4  6  o 3.9653 1.3133 -10.4175 19.823  -7.6395   47.135  -11.0144  21.849  4.7241 2.1726 3.2064 1.4763 1.517630       2.626679  
1 1 1 26 4  7  o 8.3131 1.6036 65.957   22.858  152.166   54.083  47.208    25.222  10.423 2.6023 6.2029 1.8745 4.220393       3.207173  
1 1 1 26 4  8  o 3.6909 1.2524 -18.8068 20.600  -35.9090  49.053  -15.1448  22.698  4.2442 2.0317 3.1377 1.4651 1.106427       2.504852  
1 1 1 26 4  9  o 4.6725 1.3086 16.826   21.254  -75.4464  50.785  36.419    23.402  3.8115 1.8775 5.5334 1.8235 -1.721891      2.617260  
1 1 1 26 4  10 o 4.4797 1.4335 2.8679   21.727  7.0457    51.787  1.9754    23.936  5.1696 2.3385 3.7899 1.6586 1.379674       2.867003  
1 1 1 26 4  11 f 4.2555 1.3079 7.5788   21.234  -58.5347  50.251  21.949    23.428  3.9084 1.9135 4.6026 1.7835 -0.6942449     2.615783  
1 1 1 26 4  12 o 7.5961 1.4964 87.418   24.442  47.610    57.483  96.203    27.004  6.0290 2.6050 9.1632 1.4735 -3.134151      2.992843  
1 1 1 26 4  13 o 7.9278 1.3612 104.452  25.994  10.893    55.483  130.763   29.423  5.1114 2.3530 10.744 1.3692 -5.632960      2.722432  
1 1 1 26 4  14 o 8.6044 1.5927 116.354  26.843  96.718    60.397  121.187   29.965  7.0537 2.8232 10.155 1.4754 -3.101358      3.185424  
1 1 1 26 4  15 o 6.2158 1.6742 32.984   24.963  144.546   57.302  6.8526    27.732  8.5009 2.8549 3.9307 1.7498 4.570199       3.348497  
1 1 1 26 4  16 o 5.6280 1.6158 53.090   25.959  68.550    57.250  49.088    29.125  5.6672 2.5189 5.5889 2.0243 0.7825184E-01  3.231525  
1 1 1 26 4  17 o 4.8261 1.4962 33.372   24.454  54.902    51.210  27.012    27.832  5.2004 2.3414 4.4518 1.8634 0.7485476      2.992426  
1 1 1 26 4  18 o 3.1272 1.1021 -33.8916 24.393  -99.4205  57.841  -19.7154  26.903  3.2746 1.6639 2.9797 1.4456 0.2948391      2.204147  
1 1 1 26 4  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 4  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  0  o 9.9070 2.1826 139.106  38.499  182.227   59.423  107.913   50.541  11.666 2.9452 8.1484 3.2221 -0.000000      0.000000  
1 1 1 26 5  1  o 4.9955 1.4068 11.539   24.083  -25.0959  33.548  50.493    34.594  3.6701 1.7347 6.3208 2.2151 -2.650661      2.813536  
1 1 1 26 5  2  o 4.6736 1.4163 7.5451   24.634  28.578    34.984  -13.1400  34.694  5.3396 2.1446 4.0077 1.8506 1.331880       2.832626  
1 1 1 26 5  3  o 5.3131 1.5078 27.996   24.659  35.300    33.975  19.865    35.847  5.5942 2.1533 5.0321 2.1110 0.5621600      3.015513  
1 1 1 26 5  4  o 7.3445 1.6016 71.531   25.958  65.575    36.891  77.370    36.531  7.0287 2.2882 7.6603 2.2417 -0.6316161     3.203255  
1 1 1 26 5  5  o 5.0957 1.4568 16.015   24.879  49.832    36.716  -12.6950  33.830  6.2412 2.2710 3.9501 1.8252 2.291123       2.913533  
1 1 1 26 5  6  o 3.3814 1.1177 -13.6190 17.783  -43.5688  35.639  -3.6904   20.520  3.4291 1.6637 3.3336 1.4930 0.9554529E-01  2.235374  
1 1 1 26 5  7  f 4.6466 1.4566 9.0451   21.274  10.090    52.294  8.8378    23.289  5.2617 2.3678 4.0314 1.6969 1.230316       2.913114  
1 1 1 26 5  8  o 5.3385 1.2914 31.571   22.280  -86.9290  52.974  57.037    24.557  3.7942 1.8780 6.8828 1.7730 -3.088625      2.582729  
1 1 1 26 5  9  o 5.6114 1.3486 41.343   21.936  -37.5431  51.288  59.004    24.268  4.2743 2.0543 6.9484 1.7479 -2.674145      2.697277  
1 1 1 26 5  10 o 5.7873 1.5200 44.440   22.964  14.656    55.427  50.611    25.231  5.2717 2.3983 6.3028 1.8681 -1.031062      3.040066  
1 1 1 26 5  11 o 10.479 1.5493 162.232  26.595  120.246   57.528  173.643   29.992  8.3739 2.8603 12.585 1.1916 -4.210786      3.098600  
1 1 1 26 5  12 o 5.9730 1.6111 18.707   23.226  117.629   54.057  -3.6891   25.721  8.3269 2.7727 3.6191 1.6416 4.707715       3.222249  
1 1 1 26 5  13 o 5.9326 1.6438 44.344   23.784  78.119    54.294  36.324    26.458  6.5999 2.6643 5.2653 1.9260 1.334526       3.287513  
1 1 1 26 5  14 o 4.5360 1.4653 -13.9553 22.456  77.284    53.077  -33.8477  24.783  6.3177 2.6025 2.7544 1.3475 3.563293       2.930614  
1 1 1 26 5  15 o 4.1494 1.3857 3.8216   24.163  19.958    55.701  0.0809    26.818  4.7143 2.2304 3.5845 1.6449 1.129791       2.771322  
1 1 1 26 5  16 o 4.0130 1.3590 -1.1644  25.684  19.989    54.689  -7.1501   29.091  4.5772 2.1784 3.4488 1.6256 1.128388       2.718043  
1 1 1 26 5  17 o 3.4415 1.2133 -25.3085 25.117  -12.6849  56.827  -28.3733  28.001  3.9837 1.9668 2.8993 1.4213 1.084376       2.426629  
1 1 1 26 5  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 5  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  0  o 3.7023 1.7549 -2.1422  36.189  3.4595    53.257  -6.9477   49.327  3.8671 2.5713 3.5375 2.3891 -0.000000      0.000000  
1 1 1 26 6  1  o 8.9081 1.5259 102.633  26.896  103.781   37.621  101.432   38.467  8.9938 2.1252 8.8224 2.1902 0.1714554      3.051793  
1 1 1 26 6  2  o 4.7656 1.4357 6.9415   25.822  37.508    36.778  -22.7751  36.263  5.6815 2.2254 3.8498 1.8147 1.831712       2.871497  
1 1 1 26 6  3  o 7.6832 1.6139 79.733   26.721  73.422    38.584  85.549    37.042  7.3358 2.3355 8.0306 2.2280 -0.6947799     3.227793  
1 1 1 26 6  4  o 5.3061 1.5362 27.679   25.966  25.767    37.362  29.466    36.111  5.2531 2.1755 5.3591 2.1695 -0.1059585     3.072379  
1 1 1 26 6  5  o 5.8936 1.5998 41.052   26.454  44.383    38.481  38.068    36.425  6.0388 2.2995 5.7484 2.2249 0.2904220      3.199663  
1 1 1 26 6  6  o 6.6478 1.6183 57.790   25.998  57.867    38.789  57.727    35.030  6.6317 2.3437 6.6639 2.2322 -0.3216171E-01 3.236658  
1 1 1 26 6  7  o 4.4708 1.3896 -5.8022  25.734  33.554    37.956  -39.2818  35.008  5.4964 2.2245 3.4452 1.6661 2.051182       2.779273  
1 1 1 26 6  8  o 3.8945 1.2920 -17.0934 25.238  -13.8903  38.052  -19.6089  33.722  4.0689 1.8990 3.7201 1.7525 0.3488669      2.584023  
1 1 1 26 6  9  o 5.8133 1.3003 45.650   20.535  -2.4819   37.821  65.770    24.453  4.3022 1.9665 7.3244 1.7018 -3.022159      2.600599  
1 1 1 26 6  10 o 4.9319 1.5311 9.2508   23.191  54.683    52.668  -1.6766   25.830  6.1614 2.5699 3.7023 1.6653 2.459046       3.062243  
1 1 1 26 6  11 o 8.1340 1.7046 81.633   24.776  141.571   57.273  67.834    27.481  9.0584 2.8408 7.2097 1.8847 1.848699       3.409159  
1 1 1 26 6  12 o 7.6749 1.7347 79.658   25.538  133.176   57.547  66.534    28.498  8.3908 2.8608 6.9590 1.9626 1.431753       3.469307  
1 1 1 26 6  13 o 10.556 1.5845 187.923  28.511  139.788   61.601  201.046   32.164  7.8609 2.9275 13.252 1.2135 -5.391022      3.169037  
1 1 1 26 6  14 o 4.3806 1.4127 13.564   23.227  36.653    48.984  6.8661    26.382  4.9860 2.2631 3.7751 1.6917 1.210848       2.825437  
1 1 1 26 6  15 o 4.3506 1.3373 20.576   24.640  -64.1926  59.046  38.451    27.114  3.7091 1.8587 4.9922 1.9231 -1.283144      2.674533  
1 1 1 26 6  16 o 4.7535 1.4971 37.495   25.478  57.147    57.937  32.784    28.368  4.9486 2.3204 4.5583 1.8923 0.3903055      2.994165  
1 1 1 26 6  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 6  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  0  o 4.5984 2.0258 29.825   38.146  16.438    53.428  43.746    54.480  4.1969 2.7136 4.9998 3.0085 -0.000000      0.000000  
1 1 1 26 7  1  o 6.1178 1.5706 42.707   26.648  15.733    37.242  71.008    38.147  4.9406 2.1151 7.2951 2.3222 -2.354476      3.141115  
1 1 1 26 7  2  o 5.6745 1.6505 32.816   29.258  37.129    48.826  30.400    36.546  5.9147 2.4713 5.4343 2.1886 0.4803858      3.301087  
1 1 1 26 7  3  o 5.1176 1.5147 22.351   25.940  20.080    35.301  25.016    38.244  4.9862 2.0935 5.2489 2.1896 -0.2626953     3.029401  
1 1 1 26 7  4  o 9.0250 1.5426 107.415  27.564  101.131   39.987  113.104   38.049  8.6536 2.2789 9.3964 2.0797 -0.7428255     3.085202  
1 1 1 26 7  5  o 5.5182 1.6994 26.478   32.654  18.380    39.115  45.099    59.316  4.9637 2.1467 6.0728 2.6350 -1.109069      3.398767  
1 1 1 26 7  6  o 6.1224 1.6290 51.135   27.413  42.591    41.159  57.945    36.749  5.7916 2.3261 6.4531 2.2812 -0.6614642     3.258025  
1 1 1 26 7  7  o 5.0686 1.5162 23.200   27.115  8.0539    39.950  36.138    36.922  4.6545 2.0840 5.4827 2.2028 -0.8281555     3.032340  
1 1 1 26 7  8  o 4.0831 1.3500 -13.0661 27.148  -9.4874   41.132  -15.8284  36.137  4.2652 1.9851 3.9010 1.8303 0.3641136      2.700082  
1 1 1 26 7  9  f 4.1120 1.3553 -14.6995 28.146  -41.3281  41.783  7.4203    38.082  3.7031 1.7977 4.5209 2.0287 -0.8177683     2.710593  
1 1 1 26 7  10 o 5.4582 1.5933 33.620   29.547  65.116    43.362  6.3226    40.369  6.4130 2.4413 4.5035 2.0480 1.909545       3.186565  
1 1 1 26 7  11 o 11.550 1.5489 193.292  34.060  145.396   50.563  233.083   46.086  9.3954 2.6018 13.704 1.6815 -4.308385      3.097847  
1 1 1 26 7  12 o 5.8363 1.5226 59.898   25.166  32.556    56.457  66.678    28.113  4.9868 2.3226 6.6858 1.9694 -1.698972      3.045118  
1 1 1 26 7  13 o 4.3418 1.4469 4.9969   24.814  43.970    58.256  -3.6408   27.426  5.1666 2.3900 3.5171 1.6315 1.649520       2.893806  
1 1 1 26 7  14 o 4.9481 1.5523 32.148   25.048  79.000    56.671  20.773    27.923  5.6777 2.5157 4.2186 1.8192 1.459109       3.104507  
1 1 1 26 7  15 o 5.4357 1.4972 60.073   25.079  43.614    54.160  64.566    28.295  4.7267 2.2249 6.1446 2.0041 -1.417900      2.994455  
1 1 1 26 7  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 7  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  0  o 2.9315 1.4641 -41.0938 34.715  -49.7533  50.979  -33.6061  47.404  2.8898 2.0542 2.9732 2.0868 -0.000000      0.000000  
1 1 1 26 8  1  o 4.2364 1.3418 -10.3184 25.506  -48.3070  36.366  26.461    35.783  3.3525 1.6385 5.1204 2.1255 -1.767886      2.683681  
1 1 1 26 8  2  o 5.1896 1.5274 27.022   26.544  16.460    38.072  37.013    37.029  4.8442 2.1065 5.5351 2.2123 -0.6909795     3.054706  
1 1 1 26 8  3  o 4.6974 1.4317 4.8198   26.727  -31.5817  37.858  40.990    37.737  3.7018 1.7754 5.6930 2.2466 -1.991211      2.863448  
1 1 1 26 8  4  o 3.5292 1.2049 -36.3132 25.611  -31.9690  36.727  -40.4250  35.731  3.6287 1.7426 3.4296 1.6644 0.1990714      2.409712  
1 1 1 26 8  5  o 9.4191 1.5671 120.323  29.165  143.219   42.851  100.562   39.809  10.393 2.1330 8.4450 2.2964 1.948152       3.134163  
1 1 1 26 8  6  o 8.7338 1.6566 108.436  29.373  116.827   44.386  101.898   39.178  8.9430 2.4219 8.5246 2.2609 0.4183855      3.313205  
1 1 1 26 8  7  o 5.1563 1.5448 27.580   27.776  35.492    38.804  19.269    39.775  5.4100 2.2265 4.9026 2.1420 0.5074053      3.089586  
1 1 1 26 8  8  o 3.7691 1.2834 -30.4188 28.463  -30.0249  42.444  -30.7406  38.368  3.8691 1.8619 3.6690 1.7668 0.2001352      2.566767  
1 1 1 26 8  9  o 10.549 1.5857 163.223  33.121  125.491   48.304  196.701   45.501  8.7100 2.5856 12.389 1.8364 -3.678599      3.171375  
1 1 1 26 8  10 o 4.3934 1.3525 -22.2273 28.504  -118.4042 42.171  58.667    38.676  2.8076 1.4260 5.9793 2.2985 -3.171731      2.704907  
1 1 1 26 8  11 o 4.1716 1.3951 2.2844   30.577  7.9242    45.664  -2.3001   41.170  4.3201 2.0364 4.0231 1.9075 0.2969842      2.790237  
1 1 1 26 8  12 o 5.5285 1.6068 52.086   31.506  13.236    46.490  85.082    42.844  4.4556 2.0858 6.6013 2.4448 -2.145651      3.213653  
1 1 1 26 8  13 o 3.4697 1.2079 -34.1973 29.631  -41.1002  43.269  -28.1019  40.660  3.4324 1.6986 3.5070 1.7179 -0.7463527E-01 2.415851  
1 1 1 26 8  14 o 4.2167 1.3706 22.065   24.044  13.341    58.337  23.850    26.390  4.2656 2.0827 4.1678 1.7823 0.9779310E-01  2.741210  
1 1 1 26 8  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 8  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  0  o 2.6823 1.3627 -72.5098 35.883  -135.5606 55.240  -26.4841  47.196  2.3124 1.7017 3.0522 2.1290 -0.000000      0.000000  
1 1 1 26 9  1  o 5.3564 1.5138 29.454   26.796  -1.9399   38.784  58.127    37.066  4.3296 1.9836 6.3833 2.2873 -2.053664      3.027607  
1 1 1 26 9  2  o 7.0090 1.6347 69.696   27.904  99.112    40.910  44.102    38.159  8.2596 2.3592 5.7583 2.2633 2.501272       3.269347  
1 1 1 26 9  3  o 6.5562 1.5534 56.050   28.323  9.6012    40.109  102.248   40.000  4.6543 2.0857 8.4580 2.3027 -3.803740      3.106871  
1 1 1 26 9  4  o 4.7163 1.4442 4.1305   27.296  46.824    39.906  -33.4099  37.420  5.8277 2.3069 3.6049 1.7382 2.222736       2.888448  
1 1 1 26 9  5  o 5.7254 1.6259 45.379   28.547  40.154    41.583  50.036    39.261  5.5437 2.2954 5.9071 2.3033 -0.3633313     3.251765  
1 1 1 26 9  6  o 7.5150 1.4559 83.541   29.291  11.450    43.867  141.541   39.347  4.7039 2.1375 10.326 1.9772 -5.622340      2.911769  
1 1 1 26 9  7  o 3.4416 1.1958 -55.1421 27.516  -14.6464  41.718  -86.3255  36.608  4.0531 1.9212 2.8301 1.4244 1.222914       2.391666  
1 1 1 26 9  8  o 5.1361 1.5388 33.529   27.780  52.547    40.694  16.931    38.016  5.7144 2.3066 4.5579 2.0374 1.156415       3.077590  
1 1 1 26 9  9  o 4.1876 1.3937 3.9239   30.126  -3.0447   43.924  10.114    41.398  4.0917 1.9487 4.2836 1.9930 -0.1919484     2.787323  
1 1 1 26 9  10 o 4.0812 1.3605 -7.4535  30.004  -42.4833  43.556  24.180    41.391  3.5224 1.7358 4.6400 2.0956 -1.117596      2.721093  
1 1 1 26 9  11 o 5.0887 1.5597 44.560   29.712  56.179    41.393  32.211    42.674  5.4384 2.2741 4.7389 2.1352 0.6995120      3.119377  
1 1 1 26 9  12 o 3.5997 1.2477 -24.7777 30.465  -28.2542  44.783  -21.7831  41.564  3.6058 1.7736 3.5937 1.7554 0.1205063E-01  2.495390  
1 1 1 26 9  13 o 3.7933 1.2967 -7.0710  30.357  -37.0028  43.069  22.482    42.796  3.3541 1.6659 4.2325 1.9877 -0.8783801     2.593453  
1 1 1 26 9  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 9  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 0  o 4.4546 2.0076 35.758   39.231  39.596    59.449  32.796    52.215  4.5735 2.9202 4.3356 2.7559 -0.000000      0.000000  
1 1 1 26 10 1  o 7.1454 1.7293 87.754   32.483  56.345    55.067  104.516   40.228  5.9524 2.5608 8.3385 2.3248 -2.386098      3.458682  
1 1 1 26 10 2  o 3.8064 1.2701 -25.6207 26.530  -64.0295  38.165  10.291    36.904  3.1586 1.5687 4.4543 1.9980 -1.295604      2.540257  
1 1 1 26 10 3  o 4.8382 1.5016 19.998   28.160  35.734    41.040  5.9976    38.710  5.2844 2.2400 4.3920 2.0005 0.8924532      3.003270  
1 1 1 26 10 4  o 5.9979 1.7787 37.924   34.262  2.0353    40.798  123.800   63.110  4.3472 2.0072 7.6486 2.9371 -3.301332      3.557416  
1 1 1 26 10 5  o 6.0626 1.6239 57.708   28.105  81.111    40.546  36.063    38.992  6.9503 2.4002 5.1750 2.1879 1.775318       3.247779  
1 1 1 26 10 6  o 4.0137 1.3219 -6.8706  26.872  -38.1147  37.790  25.086    38.219  3.3651 1.6500 4.6623 2.0658 -1.297233      2.643878  
1 1 1 26 10 7  o 3.7925 1.2874 -13.1159 28.223  -17.0446  42.410  -9.9931   37.811  3.8094 1.8402 3.7757 1.8009 0.3372931E-01  2.574747  
1 1 1 26 10 8  o 5.0565 1.5497 39.165   29.378  27.166    43.046  49.628    40.194  4.7324 2.1372 5.3805 2.2446 -0.6481524     3.099362  
1 1 1 26 10 9  o 5.3825 1.5001 33.263   29.195  101.137   42.280  -28.5955  40.363  7.2264 2.4522 3.5386 1.7287 3.687849       3.000301  
1 1 1 26 10 10 o 3.9090 1.3163 -1.0587  28.334  -1.8115   40.679  -0.3493   39.489  3.9110 1.8661 3.9069 1.8570 0.4037142E-02  2.632624  
1 1 1 26 10 11 o 4.9979 1.5414 42.734   30.574  91.013    45.862  4.1149    41.018  6.0787 2.4505 3.9172 1.8704 2.161537       3.082734  
1 1 1 26 10 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 10 21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 0  o 3.6000 1.7338 7.9969   38.051  13.996    56.881  3.1380    51.192  3.7463 2.5402 3.4537 2.3604 -0.000000      0.000000  
1 1 1 26 11 1  o 4.6112 1.4395 21.760   27.213  44.888    37.790  -3.1520   39.221  5.2413 2.1807 3.9810 1.8798 1.260293       2.879076  
1 1 1 26 11 2  o 8.5569 1.6456 124.081  29.295  138.925   40.986  108.577   41.888  9.3772 2.2198 7.7365 2.4300 1.640638       3.291277  
1 1 1 26 11 3  o 3.4300 1.1865 -32.4759 27.169  -38.5253  40.042  -27.3154  36.984  3.4121 1.6781 3.4479 1.6778 -0.3571796E-01 2.373036  
1 1 1 26 11 4  o 4.7626 1.4913 26.312   28.799  52.025    41.967  3.4251    39.594  5.4128 2.2781 4.1125 1.9251 1.300357       2.982596  
1 1 1 26 11 5  o 3.8631 1.2973 -14.6130 27.240  17.761    40.541  -41.2602  36.780  4.4694 2.0402 3.2568 1.6030 1.212613       2.594638  
1 1 1 26 11 6  o 4.2150 1.3894 7.5972   28.396  16.453    42.936  0.7126    37.858  4.4414 2.0536 3.9885 1.8719 0.4529085      2.778755  
1 1 1 26 11 7  o 3.4545 1.1894 -32.3639 27.008  -68.6886  38.976  1.1879    37.459  2.9843 1.4976 3.9246 1.8483 -0.9403658     2.378826  
1 1 1 26 11 8  o 3.4381 1.1952 -31.4422 28.616  -39.8386  43.145  -24.8480  38.236  3.4261 1.6956 3.4501 1.6848 -0.2394629E-01 2.390347  
1 1 1 26 11 9  o 4.2951 1.4054 21.168   29.400  -1.6454   43.725  39.993    39.719  3.8850 1.8747 4.7052 2.0943 -0.8202078     2.810802  
1 1 1 26 11 10 o 3.7459 1.2871 -6.0806  30.629  -17.2892  45.551  3.1693    41.380  3.6434 1.7915 3.8484 1.8485 -0.2050593     2.574162  
1 1 1 26 11 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 11 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 0  o 3.1900 1.5847 -18.1309 39.396  -41.6729  60.856  -1.1469   51.689  3.0360 2.1728 3.3440 2.3074 -0.000000      0.000000  
1 1 1 26 12 1  o 4.3968 1.4188 16.666   28.303  -2.2188   40.714  34.328    39.373  3.9844 1.8914 4.8093 2.1154 -0.8248703     2.837662  
1 1 1 26 12 2  o 5.8809 1.5958 61.130   29.126  101.992   42.083  23.564    40.351  7.2522 2.4466 4.5097 2.0496 2.742507       3.191635  
1 1 1 26 12 3  o 4.2650 1.4040 13.407   29.188  8.2906    42.355  18.034    40.279  4.1814 1.9680 4.3487 2.0030 -0.1672816     2.808074  
1 1 1 26 12 4  f 4.5946 1.4595 29.728   27.913  32.034    40.627  27.665    38.416  4.6580 2.0924 4.5312 2.0351 0.1268296      2.918906  
1 1 1 26 12 5  o 3.7240 1.2721 -27.1801 28.456  29.815    42.933  -71.8350  38.002  4.5667 2.0903 2.8814 1.4503 1.685321       2.544158  
1 1 1 26 12 6  o 3.8099 1.2653 -20.6331 27.866  -97.3366  41.503  42.328    37.601  2.7914 1.4174 4.8284 2.0965 -2.036959      2.530688  
1 1 1 26 12 7  o 4.7877 1.5217 44.930   30.179  63.555    45.880  30.725    40.066  5.1659 2.2775 4.4095 2.0187 0.7563772      3.043351  
1 1 1 26 12 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 12 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 0  o 4.7952 2.0245 63.031   41.059  1.4905    64.027  106.017   53.511  3.4303 2.4112 6.1601 3.2528 -0.000000      0.000000  
1 1 1 26 13 1  o 3.8202 1.2935 -0.1871  28.166  10.618    40.510  -10.2990  39.189  4.0174 1.9011 3.6231 1.7547 0.3943224      2.587092  
1 1 1 26 13 2  o 3.5720 1.2259 -11.9015 27.306  -10.0638  40.458  -13.4390  37.007  3.6480 1.7705 3.4960 1.6960 0.1520300      2.451736  
1 1 1 26 13 3  o 3.9760 1.3238 10.807   27.736  -7.6242   42.507  24.473    36.602  3.7189 1.8072 4.2332 1.9348 -0.5142233     2.647523  
1 1 1 26 13 4  o 3.3431 1.1536 -33.0785 27.010  -98.4463  42.115  12.591    35.202  2.7684 1.4079 3.9178 1.8278 -1.149454      2.307181  
1 1 1 26 13 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 13 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 14 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 15 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 16 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 17 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 18 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 19 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 19 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 19 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 19 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 19 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 26 19 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  0  o 4.4430 2.2286 33.112   24.290  0.0000    0.0000  33.112    24.290  4.4430 2.2286 4.4430 2.2286 -0.000000      0.000000  
1 1 1 27 1  1  o 7.1866 1.3060 63.675   18.963  56.649    27.108  70.409    26.538  6.7374 1.9191 7.6357 1.7719 -0.8982511     2.612010  
1 1 1 27 1  2  o 12.840 0.8436 178.037  21.593  190.977   30.281  164.651   30.799  13.361 1.1332 12.319 1.2501 1.041884       1.687233  
1 1 1 27 1  3  o 7.0749 1.3150 61.194   18.849  61.882    26.404  60.480    26.918  7.1292 1.8395 7.0206 1.8797 0.1086092      2.630010  
1 1 1 27 1  4  o 5.6135 1.2333 31.936   17.673  4.6109    24.083  63.824    26.016  3.9288 1.6918 7.2982 1.7949 -3.369419      2.466537  
1 1 1 27 1  5  f 4.9993 1.3296 26.046   18.022  25.651    24.507  26.511    26.594  4.9480 1.8457 5.0506 1.9144 -0.1025362     2.659254  
1 1 1 27 1  6  o 11.949 0.8700 154.316  20.715  165.559   28.966  142.548   29.636  12.441 1.1641 11.457 1.2933 0.9839706      1.740079  
1 1 1 27 1  7  o 4.5255 1.2846 17.102   17.804  22.375    25.721  12.252    24.670  4.7849 1.8647 4.2660 1.7673 0.5189190      2.569140  
1 1 1 27 1  8  o 8.4619 1.1447 82.030   18.814  60.150    25.709  107.257   27.605  7.0528 1.8127 9.8710 1.3983 -2.818222      2.289389  
1 1 1 27 1  9  o 12.070 0.8429 155.532  20.267  173.788   30.246  140.656   27.302  12.709 1.1899 11.431 1.1942 1.278386       1.685860  
1 1 1 27 1  10 o 7.4588 1.2017 65.577   18.675  97.819    27.354  37.430    25.558  9.3463 1.4634 5.5714 1.9065 3.774888       2.403364  
1 1 1 27 1  11 o 7.9748 1.5492 83.418   22.962  73.299    55.067  85.547    25.263  7.1596 2.7449 8.7900 1.4370 -1.630425      3.098331  
1 1 1 27 1  12 o 5.9696 1.6108 11.422   23.274  114.755   55.161  -10.9577  25.671  8.4858 2.7997 3.4534 1.5936 5.032478       3.221516  
1 1 1 27 1  13 o 4.2811 1.3815 3.8894   21.715  -20.7203  54.711  8.4910    23.658  4.5947 2.1844 3.9675 1.6918 0.6272719      2.762989  
1 1 1 27 1  14 o 8.9768 1.5846 120.007  26.010  98.697    59.580  125.024   28.911  7.4456 2.8550 10.508 1.3756 -3.062529      3.169179  
1 1 1 27 1  15 o 7.6837 1.6077 95.413   26.765  71.937    60.729  101.072   29.817  6.3810 2.7156 8.9864 1.7217 -2.605464      3.215367  
1 1 1 27 1  16 o 5.8833 1.6947 50.349   26.397  80.380    64.846  44.384    28.900  6.2159 2.7249 5.5507 2.0156 0.6651597      3.389344  
1 1 1 27 1  17 o 4.9164 1.4086 33.782   26.715  -60.7155  60.295  56.866    29.800  3.8547 1.9236 5.9781 2.0581 -2.123372      2.817108  
1 1 1 27 1  18 o 5.6314 1.6162 61.207   27.177  71.822    60.025  58.470    30.479  5.4201 2.4774 5.8427 2.0762 -0.4226270     3.232382  
1 1 1 27 1  19 o 5.4875 1.5606 67.183   27.207  64.685    61.198  67.799    30.374  4.9139 2.3286 6.0610 2.0783 -1.147034      3.121218  
1 1 1 27 1  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 1  26 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  0  o 2.7628 1.7895 2.0461   23.378  0.0000    0.0000  2.0461    23.378  2.7628 1.7895 2.7628 1.7895 -0.000000      0.000000  
1 1 1 27 2  1  o 7.8315 1.1990 73.088   18.709  92.462    25.734  51.366    27.249  9.1848 1.4009 6.4782 1.9463 2.706564       2.398037  
1 1 1 27 2  2  o 9.3028 1.0831 98.180   19.448  111.481   27.165  84.196    27.855  10.118 1.3424 8.4875 1.7002 1.630610       2.166257  
1 1 1 27 2  3  o 7.7045 1.2312 71.498   18.567  81.134    25.201  60.059    27.459  8.4143 1.5548 6.9948 1.9094 1.419500       2.462341  
1 1 1 27 2  4  o 4.4071 1.2160 12.125   16.876  -7.2315   23.243  33.707    24.543  3.4330 1.5585 5.3813 1.8669 -1.948247      2.431905  
1 1 1 27 2  5  o 5.4208 1.1745 29.045   16.849  61.661    24.190  -1.6893   23.482  7.2037 1.7054 3.6379 1.6153 3.565752       2.348954  
1 1 1 27 2  6  f 7.8134 1.6368 60.641   21.839  126.234   54.258  47.960    23.857  9.3242 2.7329 6.3025 1.8021 3.021666       3.273619  
1 1 1 27 2  7  o 6.5755 1.5973 25.844   21.931  122.553   53.048  5.9082    24.085  9.1854 2.7051 3.9655 1.6994 5.219946       3.194656  
1 1 1 27 2  8  o 11.813 1.3931 152.179  25.794  204.031   58.900  139.874   28.692  12.287 2.4823 11.339 1.2651 0.9472132      2.786150  
1 1 1 27 2  9  o 7.3075 1.5156 77.103   23.797  39.040    55.293  85.756    26.363  6.0264 2.5786 8.5886 1.5935 -2.562218      3.031180  
1 1 1 27 2  10 o 5.3527 1.5727 23.541   22.243  38.655    53.996  20.452    24.410  6.0601 2.5691 4.6452 1.8148 1.414872       3.145443  
1 1 1 27 2  11 o 9.1174 1.6147 102.856  24.818  132.135   58.074  96.314    27.451  9.0334 2.8642 9.2015 1.4917 -0.1680241     3.229343  
1 1 1 27 2  12 o 5.0422 1.4664 26.830   22.332  -4.1784   54.130  33.191    24.516  4.8576 2.2663 5.2269 1.8616 -0.3692966     2.932840  
1 1 1 27 2  13 o 10.006 1.5691 158.403  27.119  102.132   61.492  171.990   30.217  7.5173 2.8960 12.495 1.2091 -4.977795      3.138272  
1 1 1 27 2  14 o 3.3256 1.1347 -30.2791 22.429  -138.3760 53.374  -7.0963   24.718  3.2233 1.6336 3.4278 1.5753 -0.2045350     2.269413  
1 1 1 27 2  15 o 5.2421 1.5717 34.208   24.999  39.926    58.110  32.909    27.693  5.4566 2.4720 5.0275 1.9416 0.4290795      3.143321  
1 1 1 27 2  16 o 3.3568 1.1711 -27.8334 23.773  -66.4378  55.026  -18.9745  26.360  3.6325 1.8165 3.0810 1.4787 0.5514686      2.342275  
1 1 1 27 2  17 f 4.7493 1.5297 24.550   25.142  68.732    60.550  15.345    27.637  5.4552 2.4914 4.0435 1.7756 1.411697       3.059406  
1 1 1 27 2  18 o 3.3143 1.1831 -38.1364 25.234  -19.4139  57.955  -42.5162  28.031  3.9382 1.9519 2.6904 1.3375 1.247784       2.366219  
1 1 1 27 2  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 2  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  0  o 5.6932 2.2568 48.711   24.771  0.0000    0.0000  48.711    24.771  5.6932 2.2568 5.6932 2.2568 -0.000000      0.000000  
1 1 1 27 3  1  o 5.0444 1.1655 27.259   15.626  46.694    20.870  2.4636    23.573  6.2895 1.6416 3.7993 1.6548 2.490144       2.330921  
1 1 1 27 3  2  o 4.9798 1.5254 -3.0400  20.037  64.416    53.732  -13.9349  21.594  6.8617 2.6893 3.0978 1.4407 3.763881       3.050840  
1 1 1 27 3  3  o 6.9846 1.6317 56.603   22.230  80.280    52.301  51.382    24.559  7.4561 2.7109 6.5131 1.8167 0.9430356      3.263320  
1 1 1 27 3  4  o 4.7969 1.4597 -16.1219 20.577  64.604    49.168  -33.2623  22.656  6.8782 2.6040 2.7156 1.3196 4.162597       2.919301  
1 1 1 27 3  5  o 10.481 1.5316 139.663  25.111  135.831   57.190  140.579   27.949  9.5486 2.8078 11.412 1.2245 -1.863825      3.063230  
1 1 1 27 3  6  o 8.2876 1.6252 66.135   22.778  151.415   55.309  48.717    24.996  10.280 2.6672 6.2950 1.8578 3.985204       3.250403  
1 1 1 27 3  7  o 4.7408 1.4810 6.5570   20.555  34.202    51.576  1.3372    22.411  5.8212 2.4906 3.6603 1.6033 2.160877       2.962033  
1 1 1 27 3  8  o 6.5087 1.5792 55.057   23.213  39.820    54.187  58.482    25.690  6.0848 2.5763 6.9326 1.8271 -0.8477798     3.158394  
1 1 1 27 3  9  o 8.7525 1.5550 106.715  24.278  83.479    57.477  111.761   26.784  7.4093 2.8130 10.096 1.3265 -2.686333      3.110092  
1 1 1 27 3  10 o 10.109 1.5832 142.423  26.971  126.083   58.230  146.886   30.432  8.7214 2.8765 11.498 1.3234 -2.776151      3.166339  
1 1 1 27 3  11 o 8.9641 1.5843 118.854  26.186  94.634    59.389  124.700   29.175  7.4141 2.8487 10.514 1.3874 -3.099965      3.168597  
1 1 1 27 3  12 o 4.3760 1.4527 -17.3353 23.565  39.808    55.288  -30.0214  26.050  5.7620 2.5213 2.9899 1.4438 2.772115       2.905397  
1 1 1 27 3  13 o 9.0171 1.5523 133.380  27.758  82.592    61.048  146.616   31.166  6.7224 2.7822 11.312 1.3776 -4.589271      3.104535  
1 1 1 27 3  14 o 6.4000 1.4931 68.394   25.921  9.5173    60.231  81.777    28.717  4.9564 2.3371 7.8436 1.8590 -2.887163      2.986252  
1 1 1 27 3  15 o 5.3229 1.5772 47.157   26.057  49.753    64.581  46.652    28.478  5.1987 2.4415 5.4471 1.9973 -0.2484317     3.154409  
1 1 1 27 3  16 o 4.6819 1.5057 25.498   26.633  41.390    59.713  21.551    29.757  5.0303 2.3577 4.3334 1.8733 0.6968608      3.011317  
1 1 1 27 3  17 o 4.2349 1.4370 9.3155   26.524  50.431    65.305  1.1933    29.025  4.8872 2.3407 3.5826 1.6675 1.304552       2.873916  
1 1 1 27 3  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 3  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  0  o 5.2726 2.0072 35.341   35.840  93.010    51.578  -18.5011  49.837  7.1947 3.2899 3.3506 2.3002 -0.000000      0.000000  
1 1 1 27 4  1  o 3.3887 1.1626 -45.6775 24.661  -60.4088  34.423  -30.1432  35.348  3.1126 1.5356 3.6647 1.7461 -0.5520329     2.325291  
1 1 1 27 4  2  o 8.0720 1.5809 85.388   27.023  64.157    37.229  109.031   39.286  6.9358 2.3006 9.2082 2.1689 -2.272389      3.161807  
1 1 1 27 4  3  o 6.1178 1.5218 47.433   21.196  29.759    53.072  50.787    23.120  5.7515 2.4940 6.4842 1.7446 -0.7326703     3.043616  
1 1 1 27 4  4  o 5.7714 1.5938 37.014   21.987  35.740    58.449  37.224    23.729  5.9811 2.6054 5.5618 1.8364 0.4193497      3.187502  
1 1 1 27 4  5  o 6.9810 1.5062 69.223   22.888  32.782    55.605  76.656    25.114  5.8641 2.5478 8.0978 1.6074 -2.233729      3.012494  
1 1 1 27 4  6  o 6.8857 1.5603 64.627   23.436  39.118    56.048  70.032    25.800  6.0956 2.6018 7.6758 1.7229 -1.580231      3.120535  
1 1 1 27 4  7  o 7.6750 1.5112 83.028   23.614  47.055    57.164  90.430    25.930  6.3207 2.6595 9.0293 1.4359 -2.708630      3.022335  
1 1 1 27 4  8  o 12.383 1.4777 188.084  27.627  201.197   62.183  184.859   30.838  11.709 2.7091 13.056 1.1810 -1.346622      2.955303  
1 1 1 27 4  9  f 6.4116 1.4601 61.029   23.640  4.8323    56.087  73.169    26.069  5.0949 2.3527 7.7283 1.7297 -2.633432      2.920141  
1 1 1 27 4  10 o 7.2258 1.4761 82.163   24.866  25.959    57.270  95.219    27.603  5.5115 2.4793 8.9401 1.6027 -3.428624      2.952184  
1 1 1 27 4  11 o 10.007 1.5979 154.036  27.942  113.591   61.267  164.658   31.397  7.8779 2.9223 12.135 1.2937 -4.257290      3.195868  
1 1 1 27 4  12 o 7.4110 1.5546 89.264   26.212  53.254    58.176  98.436    29.362  5.9409 2.5932 8.8811 1.7151 -2.940231      3.109119  
1 1 1 27 4  13 f 5.1487 1.4245 33.436   26.042  -50.4725  56.228  56.350    29.383  4.0379 1.9864 6.2596 2.0423 -2.221775      2.848990  
1 1 1 27 4  14 o 4.8028 1.3892 29.948   26.687  -64.1654  56.907  56.480    30.215  3.7078 1.8531 5.8979 2.0700 -2.190096      2.778299  
1 1 1 27 4  15 o 5.2849 1.5356 47.410   26.060  31.008    59.023  51.382    29.044  4.8909 2.3084 5.6788 2.0258 -0.7878485     3.071267  
1 1 1 27 4  16 o 4.2531 1.3742 18.700   26.797  -26.3965  58.662  30.591    30.123  3.9652 1.9650 4.5410 1.9217 -0.5757663     2.748486  
1 1 1 27 4  17 o 3.2272 1.1524 -35.9376 24.500  -27.5075  57.434  -37.8129  27.088  3.7757 1.8831 2.6787 1.3288 1.097036       2.304742  
1 1 1 27 4  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 4  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  0  o 3.8851 1.8137 6.3289   36.296  2.4184    54.866  9.3721    48.401  3.8945 2.5959 3.8757 2.5337 -0.000000      0.000000  
1 1 1 27 5  1  o 6.5499 1.6592 56.446   27.663  63.879    39.785  49.489    38.489  6.8727 2.3774 6.2271 2.3150 0.6456146      3.318301  
1 1 1 27 5  2  o 10.043 1.4670 126.320  28.488  127.707   39.928  124.881   40.658  10.135 2.0404 9.9514 2.1084 0.1833973      2.934055  
1 1 1 27 5  3  o 8.2945 1.4035 84.929   28.371  152.834   40.297  18.187    39.950  11.475 1.7559 5.1142 2.1901 6.360765       2.807086  
1 1 1 27 5  4  o 5.8536 1.5652 33.626   27.605  69.244    39.783  0.5521    38.335  7.1703 2.3782 4.5369 2.0356 2.633429       3.130456  
1 1 1 27 5  5  o 6.6693 1.6050 57.115   27.223  84.025    38.904  31.297    38.107  7.8743 2.3159 5.4642 2.2226 2.410152       3.209926  
1 1 1 27 5  6  o 4.8962 1.4714 20.666   21.558  2.1974    54.598  24.077    23.465  5.0564 2.3301 4.7360 1.7975 0.3203354      2.942890  
1 1 1 27 5  7  o 5.8037 1.6001 40.359   23.035  45.539    55.420  39.278    25.326  6.0094 2.5767 5.5980 1.8979 0.4114571      3.200208  
1 1 1 27 5  8  o 9.2316 1.6483 102.618  24.798  154.481   59.744  91.824    27.256  9.6884 2.8754 8.7748 1.6125 0.9136086      3.296676  
1 1 1 27 5  9  o 6.0428 1.5884 50.085   24.190  36.375    56.509  53.161    26.766  5.7095 2.5218 6.3761 1.9320 -0.6666212     3.176780  
1 1 1 27 5  10 o 5.1779 1.5130 30.780   24.232  6.9880    55.032  36.502    26.989  4.9988 2.3161 5.3570 1.9474 -0.3581762     3.026036  
1 1 1 27 5  11 o 5.3490 1.5412 37.560   24.637  18.384    57.425  41.886    27.274  5.1349 2.3745 5.5631 1.9654 -0.4282122     3.082381  
1 1 1 27 5  12 o 4.0326 1.2825 2.1876   23.270  -91.8627  56.205  21.644    25.564  3.6115 1.8104 4.4537 1.8170 -0.8421471     2.564968  
1 1 1 27 5  13 o 4.1592 1.3074 11.069   24.617  -74.7644  55.810  31.803    27.430  3.5806 1.7961 4.7378 1.9003 -1.157188      2.614829  
1 1 1 27 5  14 o 3.9934 1.3139 4.3341   24.834  -25.5063  50.399  13.903    28.539  3.9283 1.9218 4.0585 1.7924 -0.1301937     2.627894  
1 1 1 27 5  15 o 3.3872 1.1840 -26.5462 25.514  -61.0845  56.940  -17.8697  28.539  3.6185 1.8150 3.1559 1.5207 0.4626160      2.367914  
1 1 1 27 5  16 o 4.5091 1.4493 33.662   26.260  45.876    54.630  29.991    29.946  4.6533 2.2037 4.3648 1.8831 0.2884517      2.898639  
1 1 1 27 5  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 5  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  0  o 4.9116 1.9976 31.203   39.132  -41.8015  61.663  80.430    50.635  3.3586 2.3619 6.4646 3.2223 -0.000000      0.000000  
1 1 1 27 6  1  o 4.6894 1.4503 10.221   26.120  20.139    36.330  -0.3908   37.581  4.9714 2.1075 4.4073 1.9931 0.5641136      2.900637  
1 1 1 27 6  2  o 10.454 1.6830 138.643  33.183  198.175   57.528  108.960   40.622  11.929 2.4917 8.9786 2.2629 2.949871       3.365948  
1 1 1 27 6  3  o 8.2567 1.6508 95.648   28.620  104.635   40.322  86.524    40.631  8.7308 2.2832 7.7826 2.3849 0.9481554      3.301676  
1 1 1 27 6  4  o 5.7938 1.6077 42.847   27.338  36.836    39.993  48.120    37.456  5.5785 2.2739 6.0092 2.2734 -0.4306440     3.215422  
1 1 1 27 6  5  o 5.1171 1.6145 -21.9089 32.028  -63.5218  37.934  81.398    59.770  3.2274 1.5959 7.0068 2.8070 -3.779383      3.228989  
1 1 1 27 6  6  o 5.3672 1.5752 29.713   27.964  48.377    42.050  14.916    37.443  5.9768 2.3674 4.7576 2.0785 1.219160       3.150368  
1 1 1 27 6  7  o 5.4926 1.5880 30.028   28.849  63.056    43.321  3.7103    38.671  6.5129 2.4491 4.4723 2.0222 2.040580       3.176087  
1 1 1 27 6  8  o 5.5930 1.2972 42.899   21.043  -23.0603  43.928  62.544    23.973  4.0971 1.9506 7.0888 1.7105 -2.991677      2.594348  
1 1 1 27 6  9  o 4.5126 1.4207 13.283   23.129  -10.1675  54.355  18.468    25.559  4.6206 2.1911 4.4045 1.8092 0.2160950      2.841453  
1 1 1 27 6  10 o 4.6301 1.5018 4.1347   24.698  46.782    55.977  -6.1746   27.522  5.6722 2.5074 3.5880 1.6538 2.084155       3.003662  
1 1 1 27 6  11 o 8.2125 1.6648 110.455  26.804  123.122   60.110  107.312   29.946  7.3545 2.8548 9.0705 1.7135 -1.715990      3.329619  
1 1 1 27 6  12 o 4.7039 1.3286 28.120   23.731  -55.2180  50.937  51.224    26.820  3.6232 1.8015 5.7846 1.9531 -2.161420      2.657119  
1 1 1 27 6  13 f 5.4831 1.5971 52.249   26.006  64.600    60.167  49.412    28.839  5.4247 2.4799 5.5414 2.0133 -0.1167650     3.194189  
1 1 1 27 6  14 o 5.3508 1.5275 55.792   26.069  41.285    59.910  59.181    28.954  4.8028 2.2841 5.8989 2.0288 -1.096184      3.054995  
1 1 1 27 6  15 o 8.7224 1.6580 155.961  29.878  176.740   65.723  150.549   33.544  7.0416 2.8978 10.403 1.6122 -3.361518      3.316060  
1 1 1 27 6  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 6  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  0  o 3.3122 1.6285 -29.3894 37.155  3.2713    56.180  -54.7799  49.534  3.8513 2.5856 2.7730 1.9805 -0.000000      0.000000  
1 1 1 27 7  1  o 4.7898 1.4743 13.600   27.050  29.960    37.967  -3.2657   38.549  5.2673 2.1881 4.3124 1.9764 0.9549294      2.948574  
1 1 1 27 7  2  o 5.9881 1.5940 44.405   27.978  75.298    40.083  15.052    39.071  7.1639 2.3877 4.8124 2.1123 2.351512       3.187909  
1 1 1 27 7  3  o 5.4641 1.5848 34.118   28.185  48.077    39.776  20.040    39.944  5.9511 2.3189 4.9771 2.1609 0.9739785      3.169698  
1 1 1 27 7  4  o 6.6752 1.6741 64.995   28.122  57.084    39.186  73.396    40.382  6.3168 2.3383 7.0336 2.3965 -0.7167616     3.348285  
1 1 1 27 7  5  o 5.7785 1.6322 44.058   28.300  50.115    42.881  39.384    37.670  5.9897 2.3849 5.5673 2.2291 0.4223614      3.264481  
1 1 1 27 7  6  o 6.3854 1.7027 61.196   29.637  61.724    43.386  60.734    40.580  6.3844 2.4392 6.3863 2.3765 -0.1965523E-02 3.405466  
1 1 1 27 7  7  o 5.9032 1.6795 50.864   30.287  57.373    44.977  45.464    40.968  6.1085 2.4393 5.6978 2.3093 0.4106894      3.359046  
1 1 1 27 7  8  o 5.3293 1.6013 35.981   30.498  19.717    45.799  48.939    40.880  4.9169 2.2140 5.7418 2.3139 -0.8248768     3.202506  
1 1 1 27 7  9  o 8.2243 1.7920 114.347  32.250  123.437   48.289  107.028   43.330  8.4185 2.6034 8.0301 2.4632 0.3884287      3.584001  
1 1 1 27 7  10 o 6.2106 1.7219 77.248   32.579  53.342    46.849  99.634    45.335  5.3773 2.3375 7.0438 2.5290 -1.666460      3.443808  
1 1 1 27 7  11 o 3.9317 1.3474 -8.5447  22.212  22.638    57.490  -14.0167  24.083  4.7931 2.2671 3.0703 1.4567 1.722764       2.694763  
1 1 1 27 7  12 o 4.1743 1.3757 12.168   24.607  0.8831    58.636  14.581    27.110  4.3577 2.1188 3.9909 1.7554 0.3667996      2.751467  
1 1 1 27 7  13 o 3.0205 1.0679 -40.7885 23.352  -82.5700  50.451  -29.3963  26.344  3.2316 1.6321 2.8094 1.3775 0.4222860      2.135714  
1 1 1 27 7  14 o 4.6498 1.5166 33.396   26.957  86.916    60.562  20.172    30.104  5.2633 2.4355 4.0363 1.8080 1.226974       3.033219  
1 1 1 27 7  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 7  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  0  o 3.6838 1.7472 -6.3103  38.266  -51.5648  57.602  29.437    51.195  3.0537 2.1729 4.3140 2.7366 -0.000000      0.000000  
1 1 1 27 8  1  o 7.0145 1.5295 64.098   29.247  124.789   41.887  6.3552    40.857  9.4499 2.2488 4.5791 2.0737 4.870884       3.059003  
1 1 1 27 8  2  o 4.8132 1.4861 15.371   27.882  -4.8570   40.052  34.391    38.837  4.2772 1.9797 5.3492 2.2169 -1.072003      2.972168  
1 1 1 27 8  3  o 3.9761 1.3280 -17.8086 27.931  -30.5678  40.835  -6.5900   38.290  3.8018 1.8287 4.1504 1.9262 -0.3485987     2.656019  
1 1 1 27 8  4  o 4.7526 1.4948 15.943   28.608  12.079    41.458  19.455    39.528  4.6789 2.1067 4.8263 2.1213 -0.1474094     2.989657  
1 1 1 27 8  5  o 7.3734 1.7211 87.676   29.778  97.137    41.491  77.626    42.763  7.8645 2.4100 6.8824 2.4578 0.9820914      3.442239  
1 1 1 27 8  6  o 5.8328 1.6629 50.760   29.700  66.713    45.349  38.779    39.301  6.3106 2.4713 5.3551 2.2256 0.9555421      3.325754  
1 1 1 27 8  7  o 5.7442 1.5958 49.383   30.319  7.9505    45.606  82.197    40.586  4.5298 2.1022 6.9586 2.4015 -2.428752      3.191647  
1 1 1 27 8  8  o 3.3895 1.1806 -43.0266 28.272  -24.7013  40.647  -60.2013  39.350  3.6464 1.7709 3.1326 1.5618 0.5138011      2.361155  
1 1 1 27 8  9  o 3.7451 1.2696 -29.7088 29.419  -90.6782  44.742  16.725    39.046  3.0773 1.5520 4.4129 2.0097 -1.335614      2.539237  
1 1 1 27 8  10 o 4.4951 1.4715 19.169   31.233  20.306    46.149  18.209    42.425  4.5439 2.1108 4.4464 2.0508 0.9746122E-01  2.942979  
1 1 1 27 8  11 o 3.6815 1.2673 -19.3651 29.978  -26.4298  43.708  -13.0897  41.194  3.6235 1.7762 3.7396 1.8082 -0.1161146     2.534635  
1 1 1 27 8  12 o 4.5199 1.4769 32.936   31.203  42.581    46.064  24.758    42.418  4.7120 2.1599 4.3277 2.0148 0.3842750      2.953705  
1 1 1 27 8  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 8  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  0  o 5.9794 2.3694 86.289   42.536  88.123    65.315  84.938    56.053  5.9047 3.4129 6.0541 3.2877 -0.000000      0.000000  
1 1 1 27 9  1  o 6.2019 1.5220 49.746   33.158  -61.5476  55.799  110.500   41.227  3.9155 1.9361 8.4883 2.3489 -4.572835      3.043975  
1 1 1 27 9  2  o 5.5652 1.4769 26.689   29.343  -48.0323  43.126  91.103    40.041  3.5740 1.7545 7.5564 2.3762 -3.982344      2.953730  
1 1 1 27 9  3  o 4.9074 1.5270 25.496   29.245  16.573    42.073  33.837    40.680  4.6800 2.1133 5.1349 2.2048 -0.4549537     3.054033  
1 1 1 27 9  4  o 4.7439 1.5650 15.296   36.236  23.825    44.351  -1.8254   62.842  4.8117 2.1715 4.6762 2.2542 0.1354399      3.129969  
1 1 1 27 9  5  o 4.8057 1.5120 26.818   30.043  51.759    43.085  3.2142    41.914  5.4228 2.2967 4.1886 1.9671 1.234202       3.023945  
1 1 1 27 9  6  o 5.5084 1.5915 49.314   29.877  14.875    41.201  87.512    43.390  4.3775 2.0197 6.6393 2.4600 -2.261824      3.182911  
1 1 1 27 9  7  f 5.0864 1.5652 40.554   30.034  32.499    44.995  47.028    40.335  4.8796 2.1961 5.2933 2.2309 -0.4137330     3.130455  
1 1 1 27 9  8  o 4.6663 1.4870 18.086   30.317  62.476    45.518  -17.3063  40.643  5.6036 2.3663 3.7291 1.8014 1.874461       2.973906  
1 1 1 27 9  9  o 4.3748 1.4401 12.299   30.623  47.417    46.481  -14.6363  40.707  5.0374 2.2522 3.7121 1.7955 1.325249       2.880298  
1 1 1 27 9  10 o 4.9793 1.5174 24.989   31.481  104.750   47.086  -39.4835  42.334  6.5960 2.5360 3.3626 1.6669 3.233379       3.034784  
1 1 1 27 9  11 o 4.0294 1.3641 10.795   31.198  12.925    46.274  9.0199    42.242  4.0897 1.9618 3.9692 1.8960 0.1205208      2.728293  
1 1 1 27 9  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 9  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 0  o 4.8475 2.1384 64.188   42.240  63.243    63.843  64.924    56.333  4.7777 3.0410 4.9172 3.0072 -0.000000      0.000000  
1 1 1 27 10 1  o 6.7561 1.6490 82.500   30.847  129.505   44.206  37.895    43.064  8.5342 2.4570 4.9781 2.2000 3.556067       3.297963  
1 1 1 27 10 2  o 4.3859 1.4211 13.916   28.662  -2.2276   42.064  27.908    39.160  4.0735 1.9304 4.6983 2.0860 -0.6248093     2.842172  
1 1 1 27 10 3  o 4.8167 1.5138 31.082   29.248  29.198    42.689  32.749    40.153  4.7786 2.1458 4.8548 2.1358 -0.7621431E-01 3.027608  
1 1 1 27 10 4  f 4.7477 1.5053 28.503   29.518  29.046    43.877  28.055    39.896  4.7794 2.1582 4.7160 2.0991 0.6341553E-01  3.010629  
1 1 1 27 10 5  o 4.5394 1.4778 20.914   30.930  28.587    44.788  13.917    42.766  4.7136 2.1489 4.3651 2.0291 0.3484564      2.955507  
1 1 1 27 10 6  o 3.5006 1.7176 -84.1362 27.639  -31.6716  41.177  -127.1556 37.287  3.5006 1.7176 ?      ?      ?              ?         
1 1 1 27 10 7  o 3.7601 1.2766 -20.3239 28.588  25.465    41.062  -63.3931  39.824  4.4719 2.0459 3.0484 1.5275 1.423531       2.553219  
1 1 1 27 10 8  o 4.9072 1.5536 46.404   31.389  64.604    46.492  31.159    42.552  5.3030 2.3164 4.5114 2.0709 0.7915888      3.107154  
1 1 1 27 10 9  o 6.6610 1.7218 102.428  32.383  152.674   48.249  61.239    43.684  8.1885 2.6122 5.1336 2.2438 3.054889       3.443601  
1 1 1 27 10 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 10 20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 0  o 3.9296 1.8678 15.218   41.081  71.384    63.622  -24.9448  53.800  4.8370 3.0609 3.0222 2.1412 -0.000000      0.000000  
1 1 1 27 11 1  o 4.1608 1.3814 7.6680   29.184  24.035    42.732  -6.6382   39.952  4.4929 2.0671 3.8287 1.8330 0.6642072      2.762754  
1 1 1 27 11 2  f 3.8187 1.2949 -10.0500 28.662  11.172    40.907  -30.5141  40.170  4.1788 1.9563 3.4586 1.6969 0.7201607      2.589728  
1 1 1 27 11 3  o 4.3567 1.4252 20.020   29.372  15.075    43.063  24.321    40.165  4.2748 2.0032 4.4386 2.0279 -0.1637907     2.850458  
1 1 1 27 11 4  o 5.9619 1.6437 75.719   29.466  57.919    43.713  90.544    39.892  5.2669 2.2737 6.6569 2.3742 -1.389988      3.287317  
1 1 1 27 11 5  o 3.9704 1.3409 4.0566   30.009  -7.0973   46.159  12.222    39.495  3.8726 1.8822 4.0683 1.9102 -0.1957006     2.681711  
1 1 1 27 11 6  o 3.3878 1.1851 -31.6222 29.554  -37.7766  45.183  -27.0203  39.070  3.4177 1.6990 3.3578 1.6526 0.5988002E-01  2.370150  
1 1 1 27 11 7  o 3.4794 1.2132 -24.6053 29.567  -10.7226  45.197  -34.9913  39.092  3.7195 1.8197 3.2393 1.6051 0.4802423      2.426414  
1 1 1 27 11 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 11 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 0  o 3.3344 2.2780 12.219   47.589  0.0000    0.0000  12.219    47.589  3.3344 2.2780 3.3344 2.2780 -0.000000      0.000000  
1 1 1 27 12 1  o 3.6836 1.2601 -5.6063  28.284  -8.7397   42.919  -3.2007   37.605  3.7042 1.8037 3.6630 1.7602 0.4118967E-01  2.520209  
1 1 1 27 12 2  o 3.7679 1.2881 -2.4776  29.479  0.3960    42.909  -5.0464   40.569  3.8354 1.8523 3.7003 1.7904 0.1350815      2.576166  
1 1 1 27 12 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 12 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 13 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 14 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 15 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 16 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 17 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 18 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 18 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 18 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 18 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 18 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 27 18 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  0  o 5.1186 2.2984 42.045   25.137  0.0000    0.0000  42.045    25.137  5.1186 2.2984 5.1186 2.2984 -0.000000      0.000000  
1 1 1 28 1  1  o 9.5188 1.0923 105.325  19.579  78.446    28.396  129.684   27.032  8.0789 1.8031 10.959 1.2333 -2.879880      2.184569  
1 1 1 28 1  2  o 14.829 0.8054 235.206  23.775  239.182   32.323  230.520   35.094  15.017 1.0762 14.642 1.1984 0.3745403      1.610710  
1 1 1 28 1  3  o 4.2884 1.2369 13.464   16.864  18.014    23.347  8.5013    24.384  4.4828 1.7677 4.0940 1.7305 0.3888650      2.473765  
1 1 1 28 1  4  o 4.7562 1.3366 20.760   19.031  22.826    26.180  18.444    27.714  4.8304 1.8816 4.6821 1.8988 0.1482806      2.673125  
1 1 1 28 1  5  o 4.3945 1.2608 15.077   17.284  12.069    23.765  18.456    25.185  4.2130 1.7391 4.5760 1.8259 -0.3629999     2.521615  
1 1 1 28 1  6  o 9.2485 1.2146 101.015  21.778  114.782   30.240  86.182    31.389  10.124 1.4936 8.3734 1.9158 1.750222       2.429234  
1 1 1 28 1  7  o 4.1748 1.2370 10.780   17.366  10.672    24.105  10.897    25.040  4.1458 1.7346 4.2037 1.7640 -0.5795622E-01 2.474010  
1 1 1 28 1  8  o 4.6911 1.3178 18.707   19.019  31.171    27.043  6.5102    26.752  5.2523 1.9429 4.1300 1.7808 1.122252       2.635525  
1 1 1 28 1  9  o 16.961 0.7761 305.733  26.302  310.078   38.126  301.787   36.333  17.057 1.1176 16.865 1.0772 0.1926098      1.552196  
1 1 1 28 1  10 o 4.3116 1.2508 4.0868   19.001  -21.2688  25.401  36.302    28.631  3.1624 1.4991 5.4608 2.0026 -2.298380      2.501546  
1 1 1 28 1  11 o 19.648 0.7190 416.486  27.807  381.653   41.992  443.690   37.109  18.778 1.1181 20.518 0.9043 -1.740648      1.438046  
1 1 1 28 1  12 o 5.2591 1.6010 23.162   24.249  49.961    58.221  17.537    26.673  6.0548 2.6189 4.4634 1.8425 1.591374       3.202043  
1 1 1 28 1  13 o 11.080 1.6245 167.898  27.825  178.995   64.480  165.359   30.844  10.012 2.9908 12.148 1.2696 -2.135212      3.249079  
1 1 1 28 1  14 o 3.9029 1.3564 -31.4698 24.123  14.978    57.657  -41.3256  26.559  5.0297 2.3441 2.7760 1.3655 2.253718       2.712809  
1 1 1 28 1  15 o 5.6343 1.6242 55.504   27.174  62.101    61.276  53.889    30.319  5.4798 2.5041 5.7888 2.0693 -0.3090353     3.248440  
1 1 1 28 1  16 o 5.4989 1.6027 51.486   26.389  59.866    60.802  49.541    29.292  5.4133 2.4814 5.5846 2.0290 -0.1712270     3.205314  
1 1 1 28 1  17 o 6.1032 1.6225 81.227   29.264  67.637    66.287  84.517    32.615  5.1796 2.4452 7.0268 2.1334 -1.847233      3.245059  
1 1 1 28 1  18 o 3.9632 1.3989 -12.3303 28.364  75.381    70.190  -29.4483  31.008  4.9299 2.3779 2.9965 1.4743 1.933423       2.797857  
1 1 1 28 1  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 1  25 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  0  o 7.1812 2.1949 69.098   27.544  0.0000    0.0000  69.098    27.544  7.1812 2.1949 7.1812 2.1949 -0.000000      0.000000  
1 1 1 28 2  1  o 13.008 0.8615 184.509  21.980  147.865   31.399  219.719   30.779  11.617 1.3514 14.399 1.0688 -2.781323      1.722962  
1 1 1 28 2  2  o 5.4494 1.2861 33.128   17.880  52.406    25.092  13.245    25.483  6.5521 1.8394 4.3466 1.7981 2.205497       2.572286  
1 1 1 28 2  3  o 12.419 0.8769 166.880  21.706  149.895   30.293  184.800   31.117  11.730 1.2912 13.108 1.1869 -1.377966      1.753862  
1 1 1 28 2  4  o 4.1413 1.1866 4.1125   17.811  -27.7391  26.478  30.438    24.071  3.1223 1.4941 5.1603 1.8439 -2.037996      2.373244  
1 1 1 28 2  5  o 4.3055 1.2534 13.174   17.590  19.610    24.639  6.4830    25.120  4.5834 1.8132 4.0275 1.7310 0.5558457      2.506855  
1 1 1 28 2  6  f 5.1302 1.3346 29.475   18.013  31.591    25.822  27.470    25.139  5.2489 1.9053 5.0114 1.8694 0.2374611      2.669241  
1 1 1 28 2  7  f 5.7484 1.4745 41.258   22.623  -10.8293  55.647  51.571    24.762  4.9809 2.3151 6.5159 1.8266 -1.535004      2.948925  
1 1 1 28 2  8  o 5.0242 1.5490 16.932   23.800  18.096    57.942  16.695    26.103  5.5495 2.4953 4.4989 1.8358 1.050678       3.097910  
1 1 1 28 2  9  o 11.463 1.6493 193.860  27.869  152.935   67.721  202.204   30.578  9.2415 3.1037 13.685 1.1172 -4.443050      3.298620  
1 1 1 28 2  10 o 6.3941 1.5986 57.870   24.476  38.435    59.413  61.843    26.861  5.8400 2.5823 6.9483 1.8851 -1.108272      3.197137  
1 1 1 28 2  11 o 13.030 1.6921 267.413  31.017  182.393   72.818  286.258   34.282  9.7543 3.2167 16.306 1.0512 -6.551435      3.384105  
1 1 1 28 2  12 f 5.1296 1.5194 29.832   24.671  1.1218    59.159  35.876    27.145  4.9590 2.3315 5.3001 1.9490 -0.3410606     3.038806  
1 1 1 28 2  13 o 5.8021 1.5634 51.327   26.021  18.797    59.478  59.027    28.937  5.1338 2.3886 6.4703 2.0177 -1.336562      3.126733  
1 1 1 28 2  14 o 3.7241 1.2897 -17.6125 24.692  -20.6431  59.000  -16.9689  27.187  4.2535 2.0805 3.1947 1.5247 1.058792       2.579375  
1 1 1 28 2  15 o 5.1764 1.6243 31.280   26.986  91.637    61.154  16.685    30.072  6.1356 2.6689 4.2172 1.8520 1.918387       3.248527  
1 1 1 28 2  16 o 4.2793 1.3552 19.309   25.708  -53.4471  62.105  34.353    28.241  3.8247 1.9151 4.7340 1.9178 -0.9093287     2.710307  
1 1 1 28 2  17 o 6.0841 1.4432 84.694   28.350  8.8563    65.131  102.422   31.490  4.2322 2.0925 7.9359 1.9881 -3.703682      2.886415  
1 1 1 28 2  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 2  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  0  o 4.0211 2.1951 27.002   25.109  0.0000    0.0000  27.002    25.109  4.0211 2.1951 4.0211 2.1951 -0.000000      0.000000  
1 1 1 28 3  1  o 4.7696 1.2936 20.492   18.248  4.5965    25.458  37.286    26.168  3.9746 1.7254 5.5646 1.9279 -1.589954      2.587243  
1 1 1 28 3  2  o 3.6177 1.1247 0.1019   15.516  -3.2218   20.301  4.7715    24.063  3.3349 1.4899 3.9004 1.6853 -0.5654912     2.249484  
1 1 1 28 3  3  o 5.7199 1.6307 30.224   22.597  57.603    56.233  24.952    24.677  6.5739 2.6899 4.8659 1.8442 1.708046       3.261397  
1 1 1 28 3  4  o 5.9061 1.4290 45.745   22.899  -17.3889  52.894  60.308    25.403  4.7501 2.2240 7.0621 1.7948 -2.311993      2.857918  
1 1 1 28 3  5  o 5.1562 1.4772 26.310   21.844  -12.8058  56.284  33.246    23.702  4.9657 2.3148 5.3466 1.8358 -0.3809514     2.954393  
1 1 1 28 3  6  o 7.9105 1.4328 97.921   24.400  21.043    60.117  113.084   26.699  5.6690 2.5460 10.152 1.3149 -4.483008      2.865532  
1 1 1 28 3  7  o 4.9380 1.4850 21.530   22.801  -1.1541   55.438  26.149    25.015  5.0012 2.3198 4.8749 1.8546 0.1263242      2.970030  
1 1 1 28 3  8  o 8.2972 1.6977 86.817   24.270  125.585   61.162  79.572    26.441  8.4912 2.9470 8.1032 1.6864 0.3879652      3.395417  
1 1 1 28 3  9  o 8.6473 1.5473 116.276  26.566  72.961    59.573  127.028   29.681  6.7051 2.7590 10.589 1.4014 -3.884322      3.094534  
1 1 1 28 3  10 o 5.6669 1.4879 44.190   24.797  -15.8028  58.438  57.363    27.384  4.7355 2.2532 6.5983 1.9437 -1.862747      2.975722  
1 1 1 28 3  11 f 8.6853 1.5610 125.462  28.556  73.135    63.036  138.974   32.032  6.4490 2.7561 10.922 1.4664 -4.472584      3.121975  
1 1 1 28 3  12 o 4.7473 1.5230 14.291   25.259  33.030    59.183  10.118    27.930  5.3839 2.4605 4.1108 1.7955 1.273081       3.046007  
1 1 1 28 3  13 o 5.6268 1.6276 53.063   26.709  64.763    60.730  50.257    29.740  5.5952 2.5316 5.6585 2.0462 -0.6320095E-01 3.255163  
1 1 1 28 3  14 o 5.2388 1.5385 44.797   26.168  27.316    60.998  48.740    28.969  4.8963 2.3216 5.5813 2.0193 -0.6849246     3.076919  
1 1 1 28 3  15 o 4.1577 1.4323 -18.8875 25.248  78.947    60.445  -39.5638  27.788  5.5541 2.5182 2.7612 1.3655 2.792897       2.864609  
1 1 1 28 3  16 o 4.5523 1.4849 31.253   26.650  61.389    62.679  24.603    29.444  4.8948 2.3302 4.2099 1.8411 0.6849270      2.969770  
1 1 1 28 3  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 3  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  0  o 5.0214 2.1293 41.586   40.255  14.557    59.007  65.118    55.056  4.2710 2.7940 5.7719 3.2140 -0.000000      0.000000  
1 1 1 28 4  1  o 6.7204 1.6797 59.779   28.147  54.017    38.432  66.446    41.340  6.4488 2.3270 6.9921 2.4231 -0.5433164     3.359495  
1 1 1 28 4  2  o 5.1407 1.3776 29.163   21.398  -44.4518  53.574  43.136    23.341  4.3215 2.0827 5.9600 1.8038 -1.638494      2.755194  
1 1 1 28 4  3  o 6.3041 1.6650 45.655   22.969  66.287    57.883  41.799    25.023  6.7813 2.7462 5.8270 1.8836 0.9542489      3.330076  
1 1 1 28 4  4  f 10.042 1.5114 161.353  25.533  81.521    59.315  179.510   28.288  7.1493 2.8181 12.936 1.0934 -5.786363      3.022781  
1 1 1 28 4  5  o 5.4296 1.5792 30.902   23.018  35.767    56.565  29.937    25.199  5.7902 2.5415 5.0690 1.8754 0.7211680      3.158498  
1 1 1 28 4  6  o 6.3697 1.7124 35.432   23.317  113.941   59.155  20.991    25.370  8.1374 2.8924 4.6020 1.8338 3.535400       3.424706  
1 1 1 28 4  7  o 7.5987 1.6765 77.172   24.205  98.525    58.627  72.784    26.576  7.5456 2.8467 7.6518 1.7716 -0.1061959     3.352923  
1 1 1 28 4  8  o 8.6686 1.5944 116.288  26.758  84.494    63.830  123.066   29.473  6.9432 2.8563 10.394 1.4178 -3.450800      3.188814  
1 1 1 28 4  9  o 7.0163 1.6628 34.254   24.973  166.071   58.845  5.2996    27.579  10.025 2.8178 4.0079 1.7664 6.016817       3.325668  
1 1 1 28 4  10 o 6.3948 1.7282 52.859   25.580  101.201   58.628  41.493    28.429  7.2531 2.8184 5.5365 2.0008 1.716617       3.456349  
1 1 1 28 4  11 o 8.5757 1.6946 109.908  26.322  135.976   62.786  104.349   28.993  8.0191 2.9616 9.1323 1.6480 -1.113222      3.389241  
1 1 1 28 4  12 o 4.5536 1.3995 23.883   26.042  -39.5031  57.864  39.983    29.162  3.9825 1.9696 5.1247 1.9887 -1.142216      2.799001  
1 1 1 28 4  13 o 5.1029 1.4161 39.907   26.726  -61.5098  63.128  62.055    29.501  3.9204 1.9582 6.2855 2.0462 -2.365085      2.832234  
1 1 1 28 4  14 o 3.7965 1.2706 -5.1426  26.824  -79.9201  57.642  15.527    30.306  3.5193 1.7733 4.0737 1.8201 -0.5544343     2.541149  
1 1 1 28 4  15 o 3.9286 1.3019 8.7360   26.657  -63.3452  63.594  24.101    29.361  3.6548 1.8442 4.2023 1.8381 -0.5474713     2.603787  
1 1 1 28 4  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 4  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  0  o 4.3124 1.9749 22.481   40.198  32.219    58.528  13.786    55.305  4.5600 2.9060 4.0648 2.6752 -0.000000      0.000000  
1 1 1 28 5  1  o 4.6352 1.4574 8.4117   27.144  2.8361    37.573  14.498    39.257  4.4425 2.0024 4.8279 2.1182 -0.3853807     2.914864  
1 1 1 28 5  2  o 8.6593 1.8323 119.391  35.654  94.451    58.464  134.159   44.988  7.4633 2.8362 9.8552 2.3208 -2.391973      3.664695  
1 1 1 28 5  3  o 9.6839 1.5438 124.210  30.386  169.227   45.144  86.924    41.085  11.646 1.9382 7.7217 2.4036 3.924479       3.087645  
1 1 1 28 5  4  o 6.1024 1.6267 49.010   28.458  25.348    40.197  72.787    40.295  5.1602 2.2030 7.0447 2.3939 -1.884537      3.253318  
1 1 1 28 5  5  o 4.7430 1.4551 17.787   23.460  -15.9888  56.629  24.784    25.776  4.7084 2.2338 4.7775 1.8653 -0.6909609E-01 2.910188  
1 1 1 28 5  6  o 5.0817 1.4676 28.756   23.715  -29.1263  60.813  39.136    25.753  4.6245 2.2262 5.5389 1.9129 -0.9144115     2.935190  
1 1 1 28 5  7  o 8.9907 1.5294 131.306  26.396  75.722    61.383  143.917   29.238  6.6468 2.7735 11.335 1.2897 -4.687820      3.058714  
1 1 1 28 5  8  o 5.1763 1.5495 30.581   24.641  16.583    60.962  33.315    26.940  5.2146 2.4236 5.1380 1.9315 0.7662487E-01  3.099088  
1 1 1 28 5  9  o 5.1584 1.5855 25.755   24.195  54.970    58.904  19.825    26.537  5.8711 2.5848 4.4458 1.8367 1.425361       3.170919  
1 1 1 28 5  10 o 3.6072 1.2403 -21.6144 24.500  -55.3048  54.927  -13.2471  27.373  3.8716 1.9156 3.3427 1.5760 0.5288801      2.480546  
1 1 1 28 5  11 o 6.1841 1.6426 69.986   26.366  80.240    62.758  67.789    29.054  5.7649 2.5941 6.6032 2.0156 -0.8382573     3.285128  
1 1 1 28 5  12 o 6.0584 1.5322 69.885   27.392  25.182    60.642  81.344    30.703  4.8239 2.2952 7.2929 2.0302 -2.468971      3.064311  
1 1 1 28 5  13 o 6.5562 1.6896 85.394   27.549  109.812   63.319  79.692    30.597  6.1084 2.6848 7.0040 2.0521 -0.8955092     3.379284  
1 1 1 28 5  14 o 4.0142 1.4025 -19.8982 25.497  87.591    61.585  -42.1338  28.010  5.3452 2.4673 2.6832 1.3344 2.662029       2.805019  
1 1 1 28 5  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 5  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  0  o 4.1838 1.9113 14.278   39.737  -25.1124  58.351  48.344    54.264  3.4240 2.3835 4.9437 2.9886 -0.000000      0.000000  
1 1 1 28 6  1  o 4.2130 1.3503 -26.0583 27.771  -85.4166  39.203  33.735    39.346  3.0332 1.5192 5.3927 2.2328 -2.359496      2.700685  
1 1 1 28 6  2  o 7.9636 1.6894 94.006   29.942  72.238    42.428  115.605   42.263  6.9041 2.4500 9.0230 2.3269 -2.118858      3.378869  
1 1 1 28 6  3  o 4.7339 1.4765 1.8244   29.570  42.844    41.987  -38.5438  41.653  5.7211 2.3308 3.7466 1.8132 1.974519       2.952956  
1 1 1 28 6  4  o 7.9954 1.7106 95.800   29.784  105.509   42.821  86.702    41.453  8.4232 2.4162 7.5676 2.4220 0.8555670      3.421131  
1 1 1 28 6  5  o 4.5069 1.4498 3.1490   29.082  -12.9102  42.245  17.616    40.096  4.1850 1.9684 4.8288 2.1290 -0.6437778     2.899504  
1 1 1 28 6  6  o 5.7690 1.6037 33.832   30.923  92.691    46.048  -14.5106  41.732  7.4470 2.5587 4.0911 1.9340 3.355881       3.207386  
1 1 1 28 6  7  o 5.4251 1.6289 39.657   30.769  38.441    45.068  40.718    42.109  5.3989 2.3195 5.4514 2.2876 -0.5258036E-01 3.257745  
1 1 1 28 6  8  o 4.2466 1.4174 -0.3788  23.103  18.974    58.309  -3.9828   25.162  5.0108 2.3426 3.4825 1.5963 1.528306       2.834760  
1 1 1 28 6  9  o 4.2508 1.4388 -4.9694  24.313  55.456    59.318  -17.1708  26.655  5.3568 2.4538 3.1449 1.5033 2.211848       2.877692  
1 1 1 28 6  10 o 4.1777 1.3757 7.7392   24.413  11.034    51.917  6.8038    27.662  4.5294 2.1460 3.8259 1.7219 0.7035248      2.751365  
1 1 1 28 6  11 o 3.6440 1.2545 -14.1897 24.985  -41.8209  58.181  -7.9422   27.666  3.9094 1.9407 3.3787 1.5903 0.5307460      2.509099  
1 1 1 28 6  12 f 3.8129 1.2641 2.5554   24.373  -65.3385  58.768  16.659    26.785  3.6270 1.8226 3.9989 1.7522 -0.3719428     2.528292  
1 1 1 28 6  13 o 5.7899 1.5466 73.240   26.168  65.650    56.179  75.343    29.572  5.0068 2.3268 6.5730 2.0381 -1.566124      3.093203  
1 1 1 28 6  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 6  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  0  o 3.7884 1.8142 2.1733   40.739  13.341    58.798  -8.1379   56.498  4.0065 2.6758 3.5704 2.4506 -0.000000      0.000000  
1 1 1 28 7  1  f 5.0286 1.5409 24.095   29.202  40.674    41.087  7.1718    41.512  5.5065 2.2810 4.5506 2.0723 0.9559574      3.081777  
1 1 1 28 7  2  o 4.7935 1.5165 16.144   29.810  24.273    43.606  9.0130    40.844  5.0244 2.2174 4.5625 2.0692 0.4618902      3.032907  
1 1 1 28 7  3  o 8.5921 1.6937 116.924  31.910  83.384    45.947  148.170   44.349  7.0041 2.5417 10.180 2.2391 -3.176063      3.387313  
1 1 1 28 7  4  o 4.3495 1.4017 -2.1497  28.678  -38.9045  42.856  27.653    38.591  3.7065 1.8042 4.9926 2.1457 -1.286137      2.803432  
1 1 1 28 7  5  o 5.5531 1.5994 40.488   29.592  11.198    40.832  72.892    42.947  4.5426 2.0635 6.5636 2.4444 -2.021065      3.198887  
1 1 1 28 7  6  o 5.5919 1.5247 37.335   30.196  -27.8479  44.497  92.978    41.112  3.8336 1.8597 7.3501 2.4166 -3.516576      3.049368  
1 1 1 28 7  7  o 5.2680 1.5960 40.168   31.621  84.318    47.153  4.0901    42.625  6.3433 2.5088 4.1927 1.9736 2.150634       3.192025  
1 1 1 28 7  8  o 3.7934 1.2953 -19.0973 29.644  -27.1024  41.489  -10.7484  42.371  3.6493 1.7762 3.9376 1.8858 -0.2882547     2.590532  
1 1 1 28 7  9  o 4.7444 1.5214 26.018   32.337  -0.9749   46.884  50.510    44.660  4.1902 2.0004 5.2986 2.2927 -1.108434      3.042758  
1 1 1 28 7  10 o 3.1481 1.1051 -27.2916 20.131  -27.8181  45.023  -27.1601  22.506  3.6587 1.7953 2.6376 1.2890 1.021076       2.210184  
1 1 1 28 7  11 o 5.4035 1.5901 55.148   25.578  86.097    53.858  46.134    29.066  5.6556 2.4812 5.1513 1.9892 0.5043554      3.180151  
1 1 1 28 7  12 o 4.8702 1.5659 42.043   27.496  100.245   63.143  28.423    30.545  5.4370 2.5057 4.3034 1.8787 1.133667       3.131767  
1 1 1 28 7  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 7  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  0  o 6.9940 2.3236 111.014  43.927  57.718    64.258  157.767   60.185  4.8383 3.0678 9.1496 3.4907 -0.000000      0.000000  
1 1 1 28 8  1  o 5.3803 1.6687 34.217   33.115  88.338    56.524  5.9332    40.862  6.4458 2.6731 4.3148 1.9980 2.131039       3.337314  
1 1 1 28 8  2  o 3.8254 1.2830 -22.4949 27.698  18.975    38.841  -65.4033  39.509  4.5326 2.0401 3.1182 1.5563 1.414361       2.565914  
1 1 1 28 8  3  o 3.4717 1.2043 -40.6687 28.894  -66.3597  41.863  -17.2931  39.932  3.1880 1.5927 3.7555 1.8069 -0.5675497     2.408686  
1 1 1 28 8  4  o 4.8027 1.5960 15.204   36.188  -16.0594  44.331  77.645    62.650  3.8866 1.8784 5.7188 2.5809 -1.832180      3.192076  
1 1 1 28 8  5  o 4.7348 1.5079 21.632   30.588  57.038    45.989  -6.4569   40.962  5.5101 2.3545 3.9595 1.8846 1.550622       3.015876  
1 1 1 28 8  6  o 3.7632 1.2817 -17.8635 28.667  -25.2124  41.144  -10.9306  39.963  3.6671 1.7811 3.8593 1.8437 -0.1921806     2.563500  
1 1 1 28 8  7  o 3.3171 1.1651 -55.5050 30.111  -85.7824  44.098  -29.0573  41.215  3.0641 1.5448 3.5700 1.7447 -0.5059710     2.330294  
1 1 1 28 8  8  o 4.7856 1.5337 36.559   31.701  34.444    46.628  38.376    43.228  4.7411 2.1732 4.8300 2.1648 -0.8885431E-01 3.067409  
1 1 1 28 8  9  o 4.0549 1.3675 4.1634   30.937  21.038    44.225  -12.0081  43.294  4.3456 2.0343 3.7643 1.8280 0.5813200      2.734963  
1 1 1 28 8  10 o 3.1657 1.1251 -61.9280 31.647  -55.3229  45.464  -68.1373  44.080  3.2459 1.6273 3.0855 1.5542 0.1604388      2.250206  
1 1 1 28 8  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 8  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  0  o 3.5730 1.7469 0.7650   42.440  -5.1441   63.026  5.6673    57.406  3.5419 2.4682 3.6040 2.4727 -0.000000      0.000000  
1 1 1 28 9  1  o 7.6703 1.7471 112.440  32.341  84.393    47.066  137.529   44.515  6.3968 2.5139 8.9438 2.4268 -2.547041      3.494113  
1 1 1 28 9  2  o 5.0609 1.5426 34.459   30.558  -1.9849   43.491  69.994    42.945  4.1115 1.9526 6.0103 2.3888 -1.898833      3.085264  
1 1 1 28 9  3  o 4.6806 1.4605 14.857   29.706  -34.7407  41.633  66.300    42.400  3.5203 1.7272 5.8409 2.3556 -2.320608      2.921018  
1 1 1 28 9  4  o 4.4027 1.4471 14.842   30.924  32.907    44.644  -1.8215   42.877  4.7711 2.1636 4.0343 1.9224 0.7368169      2.894282  
1 1 1 28 9  5  o 3.8078 1.3046 -22.0741 30.291  19.309    45.459  -55.1208  40.624  4.4301 2.0702 3.1855 1.5880 1.244566       2.609111  
1 1 1 28 9  6  o 4.1824 1.3950 6.8764   30.773  33.630    44.285  -18.1062  42.794  4.6677 2.1314 3.6972 1.8004 0.9704940      2.790019  
1 1 1 28 9  7  o 4.3071 1.4122 10.144   30.865  58.555    43.886  -37.2424  43.418  5.1973 2.2608 3.4170 1.6928 1.780331       2.824353  
1 1 1 28 9  8  o 3.7656 1.2958 -9.6663  31.736  -36.1246  46.827  12.810    43.160  3.4725 1.7267 4.0587 1.9326 -0.5862014     2.591619  
1 1 1 28 9  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 9  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 0  o 3.0259 1.5314 -34.0173 41.937  -29.6653  64.675  -37.1747  55.088  3.1648 2.2607 2.8871 2.0664 -0.000000      0.000000  
1 1 1 28 10 1  o 3.5761 1.2382 -30.9081 30.156  -67.7659  43.090  4.4705    42.216  3.1217 1.5676 4.0304 1.9169 -0.9086907     2.476313  
1 1 1 28 10 2  o 4.7471 1.5166 37.997   30.755  52.013    44.764  25.466    42.327  5.0643 2.2403 4.4299 2.0450 0.6343517      3.033297  
1 1 1 28 10 3  o 3.9667 1.3432 2.4100   30.437  -2.8785   44.283  7.1456    41.904  3.9068 1.8855 4.0267 1.9136 -0.1199267     2.686467  
1 1 1 28 10 4  o 3.7769 1.2886 -7.6126  29.545  15.763    41.541  -31.5421  42.030  4.1376 1.9479 3.4162 1.6875 0.7213938      2.577228  
1 1 1 28 10 5  o 5.7557 1.7028 84.747   32.732  95.248    48.574  76.012    44.300  5.9505 2.4737 5.5610 2.3406 0.3895092      3.405528  
1 1 1 28 10 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 10 18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 11 17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 12 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 13 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 14 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 15 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 16 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 17 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 17 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 17 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 17 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 28 17 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  0  o 14.550 1.2132 224.494  34.740  0.0000    0.0000  224.494   34.740  14.550 1.2132 14.550 1.2132 -0.000000      0.000000  
1 1 1 29 1  1  o 12.145 0.9297 162.837  22.197  195.080   31.467  130.902   31.317  13.464 1.1686 10.827 1.4462 2.636677       1.859368  
1 1 1 29 1  2  o 4.4639 1.3049 14.946   18.906  12.806    25.655  17.490    27.968  4.3141 1.7960 4.6137 1.8935 -0.2995954     2.609751  
1 1 1 29 1  3  f 4.1356 1.2863 -2.1902  22.802  -110.0535 54.254  20.950    25.130  3.6029 1.8020 4.6683 1.8361 -1.065328      2.572684  
1 1 1 29 1  4  o 5.9075 1.3557 38.677   19.588  17.470    25.999  66.516    29.788  4.5472 1.8408 7.2678 1.9907 -2.720558      2.711364  
1 1 1 29 1  5  o 4.4485 1.2937 12.712   18.752  24.892    27.868  2.6356    25.348  4.9783 1.9407 3.9188 1.7111 1.059511       2.587332  
1 1 1 29 1  6  o 4.2429 1.2157 -1.5346  18.569  -32.5102  24.951  36.919    27.800  2.9105 1.4073 5.5753 1.9827 -2.664860      2.431329  
1 1 1 29 1  7  o 4.3008 1.2937 10.649   19.537  16.195    28.162  5.5046    27.125  4.5303 1.8835 4.0712 1.7741 0.4590259      2.587456  
1 1 1 29 1  8  o 3.6336 1.1298 -15.3767 18.290  21.812    25.828  -52.7871  25.905  4.6618 1.8526 2.6054 1.2937 2.056358       2.259579  
1 1 1 29 1  9  o 5.1658 1.4131 31.106   21.026  23.441    31.487  37.275    28.246  4.8742 2.0057 5.4573 1.9910 -0.5831575     2.826129  
1 1 1 29 1  10 o 3.6304 1.1935 -12.1777 20.535  -5.6881   31.976  -16.7332  26.790  3.9234 1.7988 3.3373 1.5690 0.5861230      2.386938  
1 1 1 29 1  11 o 6.1014 1.3902 47.713   22.052  15.360    31.258  79.767    31.113  4.4927 1.9310 7.7102 2.0005 -3.217429      2.780404  
1 1 1 29 1  12 o 4.2823 1.2852 7.0695   20.466  36.298    30.497  -16.8768  27.605  5.2402 2.0337 3.3244 1.5720 1.915769       2.570407  
1 1 1 29 1  13 o 3.4686 1.1494 -9.1197  20.104  -4.7366   27.939  -13.8263  28.952  3.5530 1.6476 3.3842 1.6031 0.1687300      2.298861  
1 1 1 29 1  14 o 3.7905 1.3360 -31.3948 24.893  24.667    60.804  -42.6833  27.285  4.8524 2.3058 2.7286 1.3500 2.123835       2.671915  
1 1 1 29 1  15 o 4.7244 1.4632 33.715   27.578  -9.9671   63.397  43.910    30.628  4.2895 2.1100 5.1592 2.0278 -0.8696485     2.926430  
1 1 1 29 1  16 o 4.0886 1.3439 15.056   26.983  -39.4425  63.204  27.202    29.838  3.8454 1.9265 4.3318 1.8742 -0.4863720     2.687733  
1 1 1 29 1  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 1  24 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  0  o 2.1141 1.4954 -28.4124 25.891  0.0000    0.0000  -28.4124  25.891  2.1141 1.4954 2.1141 1.4954 -0.000000      0.000000  
1 1 1 29 2  1  o 10.078 1.0454 113.362  20.981  103.145   29.821  123.376   29.524  9.5710 1.5579 10.586 1.3945 -1.015035      2.090853  
1 1 1 29 2  2  o 4.8228 1.2818 14.332   19.542  -16.5592  27.139  47.598    28.163  3.4456 1.6066 6.2001 1.9976 -2.754505      2.563518  
1 1 1 29 2  3  o 7.0202 1.6999 63.862   25.476  67.007    60.492  63.184    28.088  6.9025 2.8032 7.1380 1.9239 -0.2354770     3.399882  
1 1 1 29 2  4  o 5.5084 1.3557 35.971   19.311  49.432    26.092  19.668    28.715  6.2913 1.9078 4.7255 1.9266 1.565886       2.711320  
1 1 1 29 2  5  o 4.5681 1.3215 16.352   19.480  29.041    28.734  5.5621    26.498  5.1044 1.9760 4.0318 1.7553 1.072590       2.642994  
1 1 1 29 2  6  f 5.6119 1.3920 36.430   20.454  16.954    27.696  59.793    30.335  4.5118 1.8711 6.7120 2.0614 -2.200206      2.783948  
1 1 1 29 2  7  o 6.0467 1.3846 47.560   19.286  41.474    28.097  52.982    26.520  5.6909 1.9962 6.4025 1.9193 -0.7115908     2.769201  
1 1 1 29 2  8  o 5.2089 1.3877 31.836   24.113  -81.2031  61.521  52.352    26.210  4.0666 2.0147 6.3512 1.9090 -2.284668      2.775475  
1 1 1 29 2  9  o 4.6135 1.5234 -1.3647  25.155  28.980    63.109  -7.0962   27.428  5.6017 2.5526 3.6254 1.6636 1.976324       3.046837  
1 1 1 29 2  10 o 6.6111 1.6933 62.911   25.295  76.616    62.846  60.262    27.632  6.5328 2.7707 6.6895 1.9473 -0.1566634     3.386585  
1 1 1 29 2  11 o 4.9128 1.4990 26.129   25.821  -24.9879  67.336  34.942    27.958  4.6611 2.2673 5.1645 1.9616 -0.5034146     2.998075  
1 1 1 29 2  12 o 8.0072 1.4509 122.520  27.991  51.104    66.564  137.861   30.852  5.3857 2.5129 10.629 1.4513 -5.242976      2.901876  
1 1 1 29 2  13 o 3.3790 1.1647 -29.4497 25.196  -133.1505 59.080  -6.3964   27.856  3.2930 1.6741 3.4649 1.6196 -0.1718507     2.329321  
1 1 1 29 2  14 o 4.4697 1.3976 23.864   26.655  -49.0001  64.471  38.887    29.274  3.9612 1.9787 4.9782 1.9742 -1.016966      2.795111  
1 1 1 29 2  15 o 3.4641 1.2170 -20.9015 25.370  -65.8457  68.942  -13.8620  27.285  3.7836 1.9105 3.1447 1.5080 0.6388690      2.433912  
1 1 1 29 2  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 2  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  0  o 5.2317 2.3830 45.498   27.050  0.0000    0.0000  45.498    27.050  5.2317 2.3830 5.2317 2.3830 -0.000000      0.000000  
1 1 1 29 3  1  o 6.3195 1.3735 51.203   20.030  68.507    27.992  33.048    28.673  7.3550 1.8921 5.2841 1.9915 2.070864       2.746994  
1 1 1 29 3  2  o 4.9252 1.3356 26.827   18.472  24.050    26.154  29.591    26.092  4.7856 1.8761 5.0647 1.9015 -0.2790980     2.671194  
1 1 1 29 3  3  o 6.4815 1.6432 12.730   22.890  150.619   60.047  -10.7132  24.759  9.5821 2.8915 3.3809 1.5619 6.201185       3.286430  
1 1 1 29 3  4  o 4.5179 1.4742 -0.8388  22.860  24.197    56.665  -5.7057   24.984  5.4951 2.4696 3.5407 1.6106 1.954315       2.948354  
1 1 1 29 3  5  o 4.0033 1.3345 -6.1941  21.637  -39.7642  57.590  -0.6766   23.348  4.4114 2.1342 3.5951 1.6026 0.8163638      2.668902  
1 1 1 29 3  6  o 10.233 1.6581 140.775  26.721  157.620   65.212  137.376   29.293  9.3866 3.0414 11.079 1.3221 -1.692037      3.316290  
1 1 1 29 3  7  o 10.135 1.6168 172.848  29.159  100.232   70.435  187.867   32.033  7.2358 2.9910 13.034 1.2289 -5.797920      3.233619  
1 1 1 29 3  8  o 5.6643 1.6995 18.861   24.743  105.644   63.905  3.5571    26.836  7.4243 2.9255 3.9043 1.7305 3.520014       3.399018  
1 1 1 29 3  9  o 5.4910 1.6575 28.072   25.899  81.871    59.341  15.413    28.785  6.6224 2.7421 4.3597 1.8628 2.262758       3.314964  
1 1 1 29 3  10 o 8.9859 1.6857 123.706  27.684  138.401   65.387  120.497   30.557  7.9636 3.0059 10.008 1.5266 -2.044588      3.371333  
1 1 1 29 3  11 o 2.9270 1.0577 -76.4255 25.448  -112.1410 57.190  -67.6075  28.417  3.3700 1.7061 2.4839 1.2507 0.8861020      2.115477  
1 1 1 29 3  12 o 6.6240 1.5485 84.177   27.292  45.710    65.779  92.176    29.996  5.2011 2.4494 8.0470 1.8951 -2.845841      3.096911  
1 1 1 29 3  13 o 6.4421 1.5143 85.155   28.148  31.927    64.318  97.764    31.305  4.8123 2.3096 8.0718 1.9590 -3.259497      3.028533  
1 1 1 29 3  14 o 3.5331 1.2316 -18.0293 26.252  -46.5056  61.906  -11.7858  28.987  3.7969 1.9028 3.2692 1.5641 0.5277591      2.463177  
1 1 1 29 3  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 3  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  0  o 4.1075 1.8643 -10.5244 40.136  -89.5092  57.614  63.951    55.945  2.7135 1.9666 5.5015 3.1679 -0.000000      0.000000  
1 1 1 29 4  1  o 2.9075 1.0250 -44.4126 18.825  -55.1595  38.749  -41.0927  21.537  3.3736 1.6575 2.4414 1.2064 0.9322343      2.050027  
1 1 1 29 4  2  o 4.5387 1.4316 11.831   22.713  -35.5334  62.870  18.940    24.358  4.6240 2.2353 4.4534 1.7892 0.1706367      2.863170  
1 1 1 29 4  3  o 6.7121 1.4711 70.969   25.788  -3.9598   61.360  87.043    28.420  5.0250 2.3662 8.3992 1.7487 -3.374273      2.942214  
1 1 1 29 4  4  o 5.7188 1.5039 45.097   24.178  -5.6546   59.371  55.187    26.472  4.9316 2.3238 6.5060 1.9095 -1.574363      3.007724  
1 1 1 29 4  5  o 6.0429 1.7195 47.603   28.122  65.586    60.711  42.690    31.732  6.4050 2.7202 5.6808 2.1039 0.7242641      3.438943  
1 1 1 29 4  6  f 6.9781 1.7315 68.131   25.558  94.227    62.771  62.944    27.983  7.0877 2.8635 6.8684 1.9475 0.2193666      3.462987  
1 1 1 29 4  7  o 4.3102 1.4229 3.9077   23.353  -27.4853  67.445  8.1840    24.892  4.6856 2.2768 3.9348 1.7071 0.7508187      2.845747  
1 1 1 29 4  8  o 3.8178 1.3387 -28.1958 23.915  -12.4003  63.367  -30.8194  25.825  4.7251 2.2741 2.9106 1.4131 1.814457       2.677385  
1 1 1 29 4  9  o 7.4397 1.6192 96.819   27.175  81.747    62.566  100.324   30.169  6.1880 2.6955 8.6915 1.7950 -2.503445      3.238499  
1 1 1 29 4  10 o 8.7214 1.7380 135.079  29.425  163.180   66.583  128.259   32.801  7.7206 3.0025 9.7223 1.7513 -2.001703      3.475949  
1 1 1 29 4  11 o 5.4515 1.5446 51.698   26.414  25.489    63.150  57.256    29.081  4.8736 2.3253 6.0295 2.0338 -1.155911      3.089232  
1 1 1 29 4  12 o 5.5605 1.4928 60.547   28.376  -7.2507   62.661  78.038    31.827  4.2916 2.1084 6.8293 2.1138 -2.537713      2.985522  
1 1 1 29 4  13 o 4.8358 1.5712 33.783   27.451  98.966    64.738  19.493    30.311  5.5758 2.5575 4.0959 1.8259 1.479900       3.142436  
1 1 1 29 4  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 4  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  0  o 3.8671 1.8405 4.5743   40.809  -1.7022   58.208  10.642    57.230  3.7623 2.5563 3.9719 2.6486 -0.000000      0.000000  
1 1 1 29 5  1  o 6.7145 1.6907 66.730   30.744  35.685    43.530  97.631    43.429  5.4574 2.3098 7.9717 2.4695 -2.514286      3.381328  
1 1 1 29 5  2  o 4.2648 1.4122 -15.1076 30.710  -40.1157  42.972  10.995    43.903  3.7590 1.8245 4.7705 2.1560 -1.011493      2.824398  
1 1 1 29 5  3  o 6.2984 1.6319 55.567   30.883  10.663    45.398  94.248    42.135  4.7830 2.1739 7.8137 2.4344 -3.030778      3.263727  
1 1 1 29 5  4  o 7.6901 1.3739 92.980   23.623  41.487    45.870  111.569   27.560  5.5583 2.3626 9.8218 1.4030 -4.263576      2.747797  
1 1 1 29 5  5  o 4.3072 1.4228 1.9249   24.198  -1.0442   58.892  2.5280    26.542  4.8115 2.2813 3.8029 1.7010 1.008519       2.845643  
1 1 1 29 5  6  o 5.6632 1.4249 48.463   26.016  -54.2995  62.943  69.637    28.571  4.2130 2.0781 7.1135 1.9501 -2.900519      2.849806  
1 1 1 29 5  7  o 8.4816 1.5583 126.151  27.693  90.791    64.157  134.248   30.700  6.3947 2.7575 10.569 1.4524 -4.173907      3.116632  
1 1 1 29 5  8  o 4.6733 1.5302 14.093   24.311  75.834    62.204  2.9629    26.411  5.7047 2.5734 3.6419 1.6564 2.062775       3.060352  
1 1 1 29 5  9  o 3.6387 1.2865 -29.9336 24.015  -0.4486   60.838  -35.3759  26.138  4.5058 2.1832 2.7715 1.3616 1.734280       2.572981  
1 1 1 29 5  10 o 4.2360 1.4183 8.1439   25.340  22.164    62.254  5.3599    27.742  4.7294 2.2705 3.7425 1.7004 0.9868271      2.836606  
1 1 1 29 5  11 o 4.8882 1.5767 31.277   27.282  89.155    63.134  17.987    30.253  5.6478 2.5657 4.1285 1.8332 1.519279       3.153313  
1 1 1 29 5  12 f 3.6373 1.2501 -5.9734  25.453  -39.2911  61.380  0.9453    27.971  3.7896 1.8985 3.4851 1.6270 0.3045115      2.500293  
1 1 1 29 5  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 5  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  0  o 2.8137 1.4367 -74.0635 41.400  -74.2748  60.540  -73.8779  56.741  2.8683 2.0699 2.7590 1.9929 -0.000000      0.000000  
1 1 1 29 6  1  o 5.4852 1.6232 40.470   30.567  59.156    43.368  22.022    43.091  6.0691 2.4042 4.9013 2.1816 1.167798       3.246408  
1 1 1 29 6  2  o 4.8732 1.5249 14.176   31.643  50.359    43.580  -26.1730  46.020  5.7375 2.3602 4.0090 1.9316 1.728471       3.049860  
1 1 1 29 6  3  o 7.0300 1.7364 84.764   31.223  63.917    45.157  103.861   43.219  6.1363 2.4461 7.9237 2.4650 -1.787438      3.472709  
1 1 1 29 6  4  o 4.6033 1.4943 12.679   31.296  25.539    45.959  1.5591    42.736  4.9028 2.2118 4.3037 2.0098 0.5991826      2.988558  
1 1 1 29 6  5  o 4.2330 1.4137 1.0616   31.501  -6.8841   46.297  7.9115    42.986  4.1390 1.9793 4.3269 2.0190 -0.1878762     2.827395  
1 1 1 29 6  6  o 5.3330 1.6277 50.860   31.523  62.403    47.106  41.498    42.423  5.6097 2.3896 5.0564 2.2106 0.5532846      3.255306  
1 1 1 29 6  7  o 7.7732 1.7464 98.973   26.142  153.009   67.250  89.355    28.373  7.5107 2.9879 8.0357 1.8090 -0.5250430     3.492887  
1 1 1 29 6  8  o 3.7751 1.2619 -4.9919  24.869  -88.4986  61.460  11.357    27.195  3.6264 1.8277 3.9237 1.7404 -0.2973683     2.523792  
1 1 1 29 6  9  o 4.4864 1.4736 20.294   25.687  46.273    62.488  15.011    28.178  4.9642 2.3526 4.0086 1.7751 0.9555316      2.947194  
1 1 1 29 6  10 o 5.7001 1.6412 64.883   26.706  97.804    63.479  57.803    29.438  5.6575 2.5711 5.7428 2.0405 -0.8534241E-01 3.282344  
1 1 1 29 6  11 o 4.4871 1.4708 25.329   25.749  77.193    56.048  11.455    28.989  5.2049 2.3846 3.7694 1.7224 1.435536       2.941597  
1 1 1 29 6  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 6  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  0  o 4.3679 2.0225 38.726   44.257  77.752    65.871  6.6148    59.752  5.1050 3.1805 3.6308 2.4991 -0.000000      0.000000  
1 1 1 29 7  1  o 5.2176 1.6649 48.153   35.819  56.719    61.761  43.811    43.968  5.3197 2.4609 5.1155 2.2431 0.2042418      3.329786  
1 1 1 29 7  2  o 4.4458 1.4604 13.960   31.472  -0.7926   44.314  28.975    44.705  4.1398 1.9675 4.7517 2.1587 -0.6119356     2.920826  
1 1 1 29 7  3  o 4.0860 1.3399 -17.8499 29.669  -90.3260  44.081  42.172    40.115  3.0495 1.5383 5.1225 2.1942 -2.072936      2.679729  
1 1 1 29 7  4  o 4.8525 1.4974 11.674   31.595  78.562    45.226  -52.0848  44.156  6.2738 2.4647 3.4313 1.7012 2.842508       2.994773  
1 1 1 29 7  5  o 4.9093 1.5552 32.455   31.832  55.018    46.556  12.646    43.622  5.4308 2.3454 4.3878 2.0429 1.042963       3.110376  
1 1 1 29 7  6  o 4.8684 1.5074 25.894   31.758  -29.7151  46.553  74.302    43.434  3.7222 1.8263 6.0145 2.3986 -2.292287      3.014726  
1 1 1 29 7  7  o 4.3202 1.4334 4.0495   32.653  51.580    46.869  -40.7788  45.517  5.1285 2.2793 3.5119 1.7387 1.616645       2.866762  
1 1 1 29 7  8  o 4.3281 1.4442 18.633   32.549  28.491    47.514  9.9167    44.679  4.5130 2.1114 4.1433 1.9710 0.3697205      2.888413  
1 1 1 29 7  9  o 2.9819 1.0584 -38.0164 21.339  -27.9184  43.325  -41.2507  24.519  3.4759 1.7164 2.4878 1.2391 0.9881814      2.116889  
1 1 1 29 7  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 7  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  0  o 3.4755 1.7179 -5.2837  44.392  -22.2735  68.049  7.3032    58.571  3.3660 2.3890 3.5850 2.4693 -0.000000      0.000000  
1 1 1 29 8  1  o 7.6103 1.6758 113.931  33.029  61.649    47.756  161.872   45.730  5.4770 2.3704 9.7436 2.3695 -4.266633      3.351609  
1 1 1 29 8  2  o 4.1352 1.3882 3.7136   30.999  5.6764    44.904  1.9266    42.847  4.1910 1.9885 4.0795 1.9376 0.1114979      2.776446  
1 1 1 29 8  3  o 4.6843 1.4522 14.586   30.063  -46.6318  42.536  75.683    42.494  3.3522 1.6633 6.0165 2.3809 -2.664360      2.904370  
1 1 1 29 8  4  o 4.2980 1.4298 11.066   32.425  -17.1273  47.110  36.445    44.696  3.8415 1.8747 4.7546 2.1595 -0.9131014     2.859680  
1 1 1 29 8  5  o 5.3624 1.6518 63.483   33.119  74.518    48.992  54.196    44.944  5.5933 2.4108 5.1315 2.2586 0.4617949      3.303502  
1 1 1 29 8  6  o 4.2394 1.4189 9.9011   32.639  50.882    47.217  -27.6014  45.168  4.9118 2.2264 3.5669 1.7596 1.344860       2.837837  
1 1 1 29 8  7  o 3.7150 1.2815 -14.0066 31.468  -44.1593  45.299  14.116    43.747  3.3441 1.6686 4.0859 1.9456 -0.7417531     2.563082  
1 1 1 29 8  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 8  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  0  o 3.2000 1.6005 -17.4290 42.989  -62.3588  66.060  15.575    56.618  2.8612 2.0777 3.5388 2.4350 -0.000000      0.000000  
1 1 1 29 9  1  o 4.2098 1.3991 17.823   30.734  -1.6244   46.539  32.864    40.928  3.9230 1.9028 4.4965 2.0516 -0.5735543     2.798147  
1 1 1 29 9  2  o 5.4697 1.6331 70.487   32.401  42.264    47.040  95.964    44.693  4.6689 2.1555 6.2705 2.4540 -1.601610      3.266267  
1 1 1 29 9  3  o 3.8959 1.3344 0.4414   32.023  1.0302    46.988  -0.0693   43.759  3.9329 1.9086 3.8589 1.8653 0.7390690E-01  2.668745  
1 1 1 29 9  4  o 5.1425 1.5685 54.122   31.961  10.341    44.604  100.319   45.819  4.0216 1.9283 6.2635 2.4743 -2.241836      3.136997  
1 1 1 29 9  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 9  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 10 16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 11 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 12 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 13 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 14 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 15 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 16 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 16 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 29 16 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  0  o 12.152 1.3736 161.152  32.283  0.0000    0.0000  161.152   32.283  12.152 1.3736 12.152 1.3736 -0.000000      0.000000  
1 1 1 30 1  1  o 6.0688 1.3616 43.602   20.922  14.386    29.195  74.445    29.997  4.4938 1.8962 7.6437 1.9545 -3.149902      2.723191  
1 1 1 30 1  2  o 5.6241 1.3985 39.294   19.594  34.159    27.414  44.656    28.016  5.3351 1.9591 5.9131 1.9962 -0.5779719     2.796948  
1 1 1 30 1  3  o 5.9021 1.4434 43.919   21.387  29.387    29.779  59.398    30.735  5.1194 2.0032 6.6849 2.0785 -1.565464      2.886755  
1 1 1 30 1  4  o 3.9362 1.1910 0.4394   18.312  23.394    25.291  -24.8551  26.549  4.7212 1.8465 3.1512 1.5047 1.569976       2.381924  
1 1 1 30 1  5  o 5.4335 1.4233 36.410   20.443  34.554    27.431  38.729    30.658  5.3189 1.9587 5.5482 2.0654 -0.2293024     2.846514  
1 1 1 30 1  6  f 6.6917 1.4524 60.641   21.902  46.792    32.091  72.716    29.967  5.9276 2.1278 7.4557 1.9773 -1.528048      2.904743  
1 1 1 30 1  7  o 3.6412 1.1693 -12.3337 19.502  12.844    28.107  -35.7083  27.082  4.3268 1.8446 2.9555 1.4377 1.371305       2.338651  
1 1 1 30 1  8  o 3.9975 1.2402 -3.6533  21.318  -40.7995  32.451  24.546    28.275  3.2055 1.5625 4.7895 1.9264 -1.584031      2.480429  
1 1 1 30 1  9  o 5.9174 1.4527 46.077   23.660  14.641    33.870  76.035    33.064  4.5193 1.9755 7.3155 2.1303 -2.796142      2.905364  
1 1 1 30 1  10 o 4.5686 1.3319 15.000   21.317  43.596    31.088  -10.3803  29.288  5.5666 2.0784 3.5706 1.6663 1.995975       2.663841  
1 1 1 30 1  11 o 5.0701 1.4517 37.106   23.259  47.655    32.662  26.251    33.130  5.4946 2.1122 4.6456 1.9921 0.8490496      2.903421  
1 1 1 30 1  12 o 9.6513 1.3356 130.956  25.125  123.003   36.913  137.822   34.296  9.0479 2.0830 10.255 1.6722 -1.206841      2.671155  
1 1 1 30 1  13 o 4.3142 1.3193 20.666   21.621  32.652    28.936  5.5173    32.530  4.7288 1.9316 3.8996 1.7976 0.8291552      2.638686  
1 1 1 30 1  14 o 2.4665 0.8708 -47.8747 17.757  -33.6608  23.491  -66.8210  27.121  2.5686 1.2675 2.3643 1.1944 0.2042880      1.741568  
1 1 1 30 1  15 o 2.8867 1.0047 -30.4547 20.033  -40.9105  26.923  -17.4866  29.984  2.6259 1.3063 3.1476 1.5268 -0.5216813     2.009418  
1 1 1 30 1  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 1  23 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  0  o 5.6984 2.4106 52.391   27.790  0.0000    0.0000  52.391    27.790  5.6984 2.4106 5.6984 2.4106 -0.000000      0.000000  
1 1 1 30 2  1  o 4.2909 1.3021 10.846   20.095  14.679    28.424  7.0170    28.413  4.4324 1.8707 4.1494 1.8117 0.2830310      2.604212  
1 1 1 30 2  2  o 7.7891 1.3546 78.024   21.098  66.906    29.783  89.223    29.890  7.1224 2.0056 8.4558 1.8212 -1.333444      2.709102  
1 1 1 30 2  3  o 4.5416 1.2766 7.3597   20.860  -33.2419  30.017  45.283    29.010  3.2052 1.5483 5.8779 2.0302 -2.672682      2.553231  
1 1 1 30 2  4  o 6.4385 1.3553 52.788   20.480  26.813    28.489  80.566    29.461  4.9308 1.9500 7.9462 1.8827 -3.015461      2.710536  
1 1 1 30 2  5  o 3.7697 1.2069 -2.9738  19.620  1.7992    26.635  -8.6360   29.010  3.8581 1.7163 3.6813 1.6972 0.1767764      2.413732  
1 1 1 30 2  6  o 6.6671 1.3318 57.672   22.727  10.918    32.995  99.876    31.348  4.4313 1.9431 8.9029 1.8219 -4.471602      2.663693  
1 1 1 30 2  7  o 6.5731 1.5011 61.459   23.030  73.615    31.999  48.394    33.172  7.2698 2.0896 5.8763 2.1555 1.393500       3.002142  
1 1 1 30 2  8  o 3.9123 1.1987 -15.6034 20.075  36.410    30.056  -57.4966  26.974  5.2514 2.0242 2.5731 1.2845 2.678211       2.397363  
1 1 1 30 2  9  o 6.9772 1.5230 72.823   23.281  73.586    35.880  72.268    30.597  6.8613 2.2577 7.0932 2.0446 -0.2319059     3.045976  
1 1 1 30 2  10 o 3.8466 1.3160 -8.0649  24.813  -27.5422  62.397  -4.4064   27.043  4.2183 2.0785 3.4749 1.6147 0.7434056      2.632028  
1 1 1 30 2  11 o 4.0632 1.3375 2.8737   26.679  -92.4856  68.750  19.779    28.947  3.8257 1.9288 4.3007 1.8534 -0.4750316     2.674953  
1 1 1 30 2  12 o 7.4785 1.7951 103.643  28.641  159.709   69.507  92.176    31.434  7.2057 2.9743 7.7513 2.0106 -0.5455484     3.590124  
1 1 1 30 2  13 o 4.2467 1.3608 20.251   25.892  -41.0644  63.537  32.461    28.353  3.8992 1.9502 4.5942 1.8983 -0.6949277     2.721518  
1 1 1 30 2  14 o 4.1386 1.4027 15.484   27.088  35.043    68.723  11.887    29.474  4.4897 2.2062 3.7875 1.7330 0.7021544      2.805439  
1 1 1 30 2  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 2  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  0  o 8.4228 2.0720 90.638   30.223  0.0000    0.0000  90.638    30.223  8.4228 2.0720 8.4228 2.0720 -0.000000      0.000000  
1 1 1 30 3  1  o 3.8837 1.1633 -6.4570  18.492  -44.6544  26.501  29.786    25.815  2.7572 1.3578 5.0103 1.8893 -2.253071      2.326572  
1 1 1 30 3  2  o 4.4440 1.3130 16.683   19.485  15.183    27.071  18.295    28.069  4.3626 1.8326 4.5254 1.8808 -0.1627936     2.625978  
1 1 1 30 3  3  o 5.3919 1.4139 36.918   20.269  41.182    29.588  33.147    27.824  5.5978 2.0384 5.1859 1.9600 0.4118996      2.827825  
1 1 1 30 3  4  o 6.1470 1.3955 51.346   20.315  35.673    29.862  64.849    27.717  5.2986 2.0238 6.9955 1.9219 -1.696932      2.790954  
1 1 1 30 3  5  o 8.7878 1.6012 128.775  29.468  85.124    64.413  140.329   33.139  6.6827 2.8180 10.893 1.5211 -4.210195      3.202354  
1 1 1 30 3  6  o 5.5010 1.6583 35.113   25.370  63.629    66.068  30.181    27.476  6.0623 2.6996 4.9397 1.9266 1.122564       3.316568  
1 1 1 30 3  7  o 11.560 1.7233 166.451  28.912  270.943   76.060  148.802   31.258  11.828 3.1565 11.291 1.3842 0.5368099      3.446669  
1 1 1 30 3  8  o 4.3222 1.3908 11.372   26.838  -59.0318  64.335  26.204    29.530  4.0347 2.0092 4.6097 1.9236 -0.5749936     2.781539  
1 1 1 30 3  9  o 5.4745 1.6885 39.154   27.069  117.639   65.083  22.737    29.766  6.5557 2.8011 4.3933 1.8862 2.162361       3.376948  
1 1 1 30 3  10 o 4.3804 1.4060 16.378   27.014  -41.2190  63.883  28.920    29.811  4.1107 2.0395 4.6501 1.9359 -0.5393524     2.811992  
1 1 1 30 3  11 o 3.6173 1.2813 -29.7782 25.387  4.7058    61.655  -36.8186  27.858  4.4223 2.1552 2.8123 1.3863 1.609994       2.562533  
1 1 1 30 3  12 f 4.3102 1.3959 22.896   27.043  -19.7490  65.407  31.689    29.700  4.0865 2.0335 4.5339 1.9128 -0.4474978     2.791740  
1 1 1 30 3  13 o 3.9063 1.3619 -4.7660  27.094  49.284    64.679  -16.2690  29.838  4.6493 2.2523 3.1634 1.5318 1.485951       2.723820  
1 1 1 30 3  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 3  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  0  o 5.2307 2.0388 48.613   25.453  72.518    66.095  44.450    27.580  5.4606 3.2997 5.0008 2.3955 -0.000000      0.000000  
1 1 1 30 4  1  o 4.7528 1.5252 12.650   23.850  37.515    60.124  8.0072    25.981  5.5348 2.5103 3.9709 1.7332 1.563977       3.050457  
1 1 1 30 4  2  f 4.9438 1.4189 27.775   25.312  -80.5422  66.328  46.238    27.385  4.0949 2.0393 5.7928 1.9735 -1.697865      2.837860  
1 1 1 30 4  3  o 6.1893 1.7118 52.252   25.069  86.822    64.295  46.055    27.223  6.6037 2.8017 5.7749 1.9677 0.8287940      3.423645  
1 1 1 30 4  4  o 3.6965 1.2526 -17.1031 24.255  -95.4415  60.127  -1.8781   26.507  3.7468 1.8773 3.6462 1.6587 0.1005249      2.505148  
1 1 1 30 4  5  o 4.7718 1.5319 18.017   25.081  35.102    63.033  14.804    27.338  5.3335 2.4739 4.2102 1.8076 1.123298       3.063886  
1 1 1 30 4  6  o 5.2262 1.6511 24.825   26.145  107.390   65.120  8.9588    28.547  6.5012 2.7905 3.9511 1.7659 2.550009       3.302264  
1 1 1 30 4  7  o 5.3835 1.6715 24.603   25.614  135.269   64.413  3.8172    27.916  7.0437 2.8802 3.7233 1.6971 3.320386       3.342957  
1 1 1 30 4  8  o 5.2309 1.5591 44.649   27.098  28.159    65.176  48.095    29.795  4.9392 2.3582 5.5226 2.0400 -0.5833769     3.118160  
1 1 1 30 4  9  o 4.0046 1.3207 4.4203   25.939  -71.4666  64.381  19.127    28.342  3.8056 1.9118 4.2035 1.8227 -0.3979163     2.641388  
1 1 1 30 4  10 o 4.9481 1.3780 40.727   26.160  -72.8988  65.016  62.676    28.575  3.7330 1.8812 6.1632 2.0142 -2.430246      2.756077  
1 1 1 30 4  11 o 5.2967 1.5561 62.274   29.351  39.063    67.591  67.668    32.584  4.6290 2.2560 5.9644 2.1438 -1.335402      3.112161  
1 1 1 30 4  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 4  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  0  f 4.7748 2.1511 50.423   46.507  90.424    68.108  15.477    63.660  5.6205 3.3729 3.9291 2.6706 -0.000000      0.000000  
1 1 1 30 5  1  o 4.3177 1.4258 -1.4069  31.452  -34.1623  44.777  30.493    44.188  3.7214 1.8186 4.9140 2.1965 -1.192596      2.851692  
1 1 1 30 5  2  o 4.2421 1.4182 -1.7764  32.002  17.499    45.553  -20.5611  44.970  4.5888 2.1195 3.8954 1.8849 0.6933503      2.836350  
1 1 1 30 5  3  o 4.3739 1.3884 17.509   22.089  25.322    47.348  15.336    24.974  4.7216 2.1736 4.0263 1.7281 0.6952353      2.776895  
1 1 1 30 5  4  o 8.9022 1.7554 129.259  27.906  186.831   67.053  117.199   30.690  8.4515 3.0700 9.3528 1.7034 -0.9013529     3.510886  
1 1 1 30 5  5  o 3.6423 1.2592 -18.4357 25.405  -55.5620  61.428  -10.7749  27.904  3.9254 1.9561 3.3593 1.5860 0.5661054      2.518321  
1 1 1 30 5  6  o 5.5151 1.5752 53.363   26.910  34.875    66.329  57.005    29.442  5.0302 2.3954 6.0001 2.0463 -0.9698315     3.150394  
1 1 1 30 5  7  o 5.6659 1.5810 61.239   27.474  43.111    64.632  65.238    30.353  5.0241 2.3844 6.3077 2.0766 -1.283587      3.161903  
1 1 1 30 5  8  o 4.4134 1.3870 24.065   26.136  -42.5468  64.162  37.316    28.618  3.9615 1.9781 4.8653 1.9447 -0.9038520     2.773941  
1 1 1 30 5  9  o 3.9047 1.3418 -0.4918  26.942  -4.6197   67.224  0.2982    29.407  4.2481 2.1049 3.5613 1.6645 0.6867740      2.683517  
1 1 1 30 5  10 o 4.3255 1.3569 26.021   27.705  -73.8023  65.580  47.708    30.567  3.5910 1.8190 5.0600 2.0140 -1.469041      2.713809  
1 1 1 30 5  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 5  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  0  o 4.5987 2.1059 53.394   45.886  67.753    65.880  39.864    63.949  4.9050 3.1085 4.2924 2.8420 -0.000000      0.000000  
1 1 1 30 6  1  o 5.5182 1.7413 45.969   37.242  115.295   64.083  10.615    45.763  6.6253 2.8032 4.4111 2.0664 2.214259       3.482526  
1 1 1 30 6  2  o 5.1862 1.5287 22.700   32.886  94.488    45.083  -58.9410  48.078  6.8783 2.5144 3.4942 1.7395 3.384099       3.057462  
1 1 1 30 6  3  o 3.7448 1.2924 -26.7261 31.610  -22.7306  45.958  -30.3131  43.545  3.8359 1.8675 3.6537 1.7872 0.1821787      2.584898  
1 1 1 30 6  4  o 4.6749 1.5244 24.944   33.915  0.4207    48.835  47.792    47.137  4.2110 2.0188 5.1387 2.2848 -0.9276981     3.048879  
1 1 1 30 6  5  o 7.0361 1.6503 88.961   34.481  179.572   51.178  13.638    46.662  9.7283 2.5860 4.3439 2.0509 5.384410       3.300534  
1 1 1 30 6  6  o 3.6351 1.1965 -2.5703  22.615  -65.8408  47.091  16.397    25.783  3.2945 1.6522 3.9757 1.7312 -0.6812570     2.393066  
1 1 1 30 6  7  o 3.6775 1.2932 -16.3656 25.008  11.700    63.799  -21.4610  27.184  4.3648 2.1409 2.9902 1.4513 1.374618       2.586411  
1 1 1 30 6  8  o 3.5952 1.2724 -21.1860 26.430  11.648    63.881  -27.9673  29.032  4.2545 2.0977 2.9359 1.4409 1.318578       2.544858  
1 1 1 30 6  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 6  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  0  f 3.6734 1.7950 7.5123   46.346  -38.8699  71.111  41.761    61.106  3.2078 2.3042 4.1391 2.7528 -0.000000      0.000000  
1 1 1 30 7  1  f 3.9422 1.3491 -12.6222 33.014  -44.6405  46.674  19.439    46.705  3.4885 1.7329 4.3958 2.0682 -0.9072571     2.698243  
1 1 1 30 7  2  o 5.4027 1.6349 60.658   33.052  30.750    47.221  89.384    46.278  4.5991 2.1360 6.2062 2.4756 -1.607095      3.269718  
1 1 1 30 7  3  o 5.7920 1.7213 81.647   35.056  59.904    51.367  100.602   47.961  5.1508 2.3296 6.4332 2.5346 -1.282418      3.442588  
1 1 1 30 7  4  o 5.3216 1.6397 63.967   34.315  32.893    48.873  94.181    48.192  4.5477 2.1320 6.0956 2.4917 -1.547922      3.279342  
1 1 1 30 7  5  o 3.8114 1.3151 -9.1517  33.062  -27.7941  49.091  6.3236    44.727  3.6321 1.7995 3.9907 1.9181 -0.3586206     2.630116  
1 1 1 30 7  6  o 4.0357 1.3696 8.4840   32.263  29.214    45.473  -12.5279  45.782  4.3614 2.0484 3.7101 1.8185 0.6512721      2.739181  
1 1 1 30 7  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 7  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  0  o 4.4845 2.0734 70.929   46.665  58.962    72.501  79.394    60.974  4.2011 2.8540 4.7679 3.0085 -0.000000      0.000000  
1 1 1 30 8  1  o 4.8972 1.5400 52.213   31.817  27.473    48.577  70.801    42.106  4.3394 2.0617 5.4551 2.2882 -1.115690      3.079983  
1 1 1 30 8  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 8  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 9  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 10 15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 11 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 12 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 13 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 30 14 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  0  o 9.5119 1.9624 110.674  32.963  0.0000    0.0000  110.674   32.963  9.5119 1.9624 9.5119 1.9624 -0.000000      0.000000  
1 1 1 31 1  1  o 2.8398 0.9848 -40.8094 18.758  -42.8411  24.947  -38.1661  28.455  2.6752 1.3174 3.0044 1.4642 -0.3291612     1.969595  
1 1 1 31 1  2  o 3.9086 1.2446 -4.3360  20.739  13.811    30.937  -19.1485  27.950  4.4649 1.9201 3.3523 1.5841 1.112626       2.489210  
1 1 1 31 1  3  o 7.7090 1.3900 81.353   22.966  109.278   31.450  49.447    33.617  9.4243 1.7324 5.9937 2.1742 3.430599       2.780021  
1 1 1 31 1  4  o 5.6924 1.4846 43.419   22.332  41.081    32.154  45.598    31.039  5.5793 2.1074 5.8056 2.0917 -0.2262321     2.969271  
1 1 1 31 1  5  o 6.5154 1.3776 57.503   22.250  89.227    30.671  22.263    32.326  8.2738 1.8943 4.7570 2.0006 3.516738       2.755193  
1 1 1 31 1  6  o 5.7699 1.4641 46.691   21.490  47.421    29.988  45.920    30.810  5.8153 2.0602 5.7245 2.0808 0.9079313E-01  2.928111  
1 1 1 31 1  7  o 5.7134 1.4752 46.085   23.070  27.899    33.675  62.168    31.668  4.9093 2.0519 6.5175 2.1199 -1.608258      2.950305  
1 1 1 31 1  8  o 4.7253 1.3497 23.424   21.402  -1.0127   30.360  47.567    30.176  3.8008 1.7463 5.6499 2.0584 -1.849135      2.699361  
1 1 1 31 1  9  o 7.6397 1.5030 92.502   24.204  111.456   35.123  75.360    33.401  8.5629 2.0730 6.7165 2.1767 1.846444       3.005902  
1 1 1 31 1  10 o 5.1422 1.4606 40.774   22.908  43.974    33.564  37.984    31.342  5.2550 2.1041 5.0295 2.0264 0.2255244      2.921210  
1 1 1 31 1  11 o 4.5158 1.3637 27.470   21.804  29.308    29.383  25.219    32.526  4.5773 1.9152 4.4544 1.9419 0.1228194      2.727409  
1 1 1 31 1  12 f 3.8305 1.2499 7.3383   22.365  2.7489    31.603  11.943    31.656  3.7132 1.7322 3.9479 1.8024 -0.2346683     2.499804  
1 1 1 31 1  13 o 3.4886 1.1765 -4.3383  22.816  -2.8602   32.101  -5.8472   32.435  3.5132 1.6711 3.4640 1.6566 0.4923320E-01  2.353055  
1 1 1 31 1  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 1  22 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  0  o 3.6991 2.2175 22.216   29.374  0.0000    0.0000  22.216    29.374  3.6991 2.2175 3.6991 2.2175 -0.000000      0.000000  
1 1 1 31 2  1  o 4.5261 1.2632 12.891   19.521  44.873    27.725  -18.5529  27.490  5.7520 1.9849 3.3003 1.5630 2.451728       2.526394  
1 1 1 31 2  2  o 4.9787 1.3034 25.470   20.260  -8.2443   29.929  53.984    27.524  3.6848 1.7076 6.2726 1.9697 -2.587832      2.606835  
1 1 1 31 2  3  o 3.1226 1.0566 -31.2289 19.053  -2.8230   27.855  -56.2058  26.120  3.7118 1.6931 2.5333 1.2645 1.178510       2.113214  
1 1 1 31 2  4  o 5.3428 1.4696 36.878   23.212  53.514    33.466  21.457    32.222  6.0265 2.1719 4.6591 1.9803 1.367416       2.939196  
1 1 1 31 2  5  o 6.0769 1.4903 52.772   24.667  81.741    34.301  21.748    35.497  7.4377 2.1710 4.7162 2.0424 2.721529       2.980664  
1 1 1 31 2  6  o 5.4592 1.4622 44.025   21.937  42.572    31.034  45.475    31.013  5.3903 2.0621 5.5282 2.0735 -0.1379375     2.924305  
1 1 1 31 2  7  o 4.9065 1.4355 35.450   22.986  34.546    33.103  36.291    31.942  4.8718 2.0351 4.9411 2.0252 -0.6934929E-01 2.871100  
1 1 1 31 2  8  o 5.5943 1.4362 47.178   22.527  21.923    31.234  74.557    32.521  4.4111 1.9130 6.7774 2.1428 -2.366277      2.872477  
1 1 1 31 2  9  o 3.4556 1.1521 -13.3732 21.023  -32.5568  29.093  7.5913    30.413  2.9849 1.4602 3.9263 1.7825 -0.9414532     2.304243  
1 1 1 31 2  10 o 3.9165 1.2498 10.937   20.795  8.7891    30.075  12.904    28.784  3.8738 1.7640 3.9593 1.7711 -0.8552527E-01 2.499696  
1 1 1 31 2  11 f 3.4611 1.2095 -20.1178 25.410  -61.6918  63.562  -12.2099  27.721  3.7176 1.8718 3.2047 1.5322 0.5129366      2.418952  
1 1 1 31 2  12 o 4.3471 1.5162 -13.2348 28.843  138.709   70.963  -43.3046  31.569  5.8608 2.6844 2.8335 1.4104 3.027333       3.032340  
1 1 1 31 2  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 2  21 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  0  o 10.963 1.7565 143.254  35.547  0.0000    0.0000  143.254   35.547  10.963 1.7565 10.963 1.7565 -0.000000      0.000000  
1 1 1 31 3  1  o 3.1875 1.0755 -20.1789 19.106  -22.4510  26.676  -17.7853  27.379  3.1148 1.4929 3.2602 1.5486 -0.1454883     2.151053  
1 1 1 31 3  2  o 3.8055 1.2203 -0.2730  20.242  -11.4255  27.693  12.520    29.660  3.4153 1.6023 4.1957 1.8410 -0.7804003     2.440627  
1 1 1 31 3  3  o 3.7944 1.2225 -10.4740 21.394  26.924    32.386  -39.4277  28.496  4.7044 1.9918 2.8843 1.4180 1.820139       2.444952  
1 1 1 31 3  4  o 7.8358 1.3255 90.296   23.362  45.810    32.717  136.582   33.372  5.3631 2.0994 10.308 1.6187 -4.945293      2.650980  
1 1 1 31 3  5  o 3.8417 1.2149 6.5656   19.742  -8.5512   28.668  20.199    27.225  3.4329 1.6167 4.2505 1.8138 -0.8176877     2.429763  
1 1 1 31 3  6  o 4.5148 1.4104 22.302   26.101  -52.7147  67.561  35.462    28.298  4.0941 2.0420 4.9355 1.9462 -0.8414164     2.820855  
1 1 1 31 3  7  o 6.2666 1.5263 76.385   27.302  21.240    73.270  85.276    29.421  4.8758 2.3702 7.6573 1.9236 -2.781497      3.052527  
1 1 1 31 3  8  f 5.0765 1.6017 42.448   29.192  61.025    70.466  38.599    32.073  5.2205 2.4811 4.9326 2.0264 0.2878876      3.203477  
1 1 1 31 3  9  o 4.4175 1.4145 24.781   27.151  -25.2618  67.242  34.529    29.678  4.1305 2.0564 4.7046 1.9428 -0.5741501     2.829047  
1 1 1 31 3  10 o 5.6903 1.7250 72.123   30.577  135.527   69.956  57.149    33.996  5.9922 2.7137 5.3883 2.1305 0.6038651      3.450041  
1 1 1 31 3  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 3  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  0  o 5.0457 2.4896 50.186   30.100  0.0000    0.0000  50.186    30.100  5.0457 2.4896 5.0457 2.4896 -0.000000      0.000000  
1 1 1 31 4  1  o 2.9228 1.0009 -25.4306 18.183  -16.1880  24.586  -36.5903  27.016  3.0438 1.4519 2.8017 1.3780 0.2420640      2.001728  
1 1 1 31 4  2  o 5.6076 1.7118 45.279   26.564  114.339   71.536  34.232    28.610  6.3398 2.8169 4.8755 1.9459 1.464295       3.423673  
1 1 1 31 4  3  o 4.5762 1.4352 23.921   26.508  -31.7773  65.424  34.861    28.995  4.2437 2.0980 4.9086 1.9590 -0.6649194     2.870454  
1 1 1 31 4  4  o 5.9739 1.6416 64.304   26.739  71.366    66.253  62.930    29.225  5.6055 2.5771 6.3423 2.0341 -0.7368412     3.283113  
1 1 1 31 4  5  o 4.7087 1.4569 31.076   26.824  -16.9369  65.381  40.794    29.414  4.3135 2.1259 5.1039 1.9926 -0.7903357     2.913740  
1 1 1 31 4  6  o 5.1155 1.3910 43.620   27.195  -86.2424  67.237  69.020    29.736  3.7277 1.8828 6.5033 2.0482 -2.775609      2.782070  
1 1 1 31 4  7  o 4.6508 1.4606 33.385   27.103  2.8260    64.951  39.828    29.823  4.3725 2.1478 4.9290 1.9799 -0.5565071     2.921159  
1 1 1 31 4  8  o 5.3290 1.5528 60.092   27.574  49.704    70.375  61.976    29.970  4.7775 2.3225 5.8804 2.0617 -1.102930      3.105579  
1 1 1 31 4  9  f 4.3842 1.4502 28.910   28.736  30.151    70.234  28.660    31.493  4.4495 2.1949 4.3188 1.8960 0.1307282      2.900386  
1 1 1 31 4  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 4  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  0  o 4.1107 1.9569 28.488   48.272  -19.0431  71.461  68.379    65.465  3.4450 2.4457 4.7763 3.0555 -0.000000      0.000000  
1 1 1 31 5  1  o 4.3980 1.5043 -6.9503  36.299  65.031    62.756  -43.1411  44.498  5.3198 2.4679 3.4762 1.7207 1.843607       3.008502  
1 1 1 31 5  2  o 3.6447 1.2277 -5.4934  23.312  -42.9376  50.862  4.4643    26.229  3.6673 1.8195 3.6222 1.6486 0.4511189E-01  2.455355  
1 1 1 31 5  3  o 4.4182 1.5018 0.1708   25.570  91.027    65.622  -16.0930  27.764  5.6681 2.5906 3.1683 1.5198 2.499818       3.003510  
1 1 1 31 5  4  o 6.1683 1.7976 68.964   28.591  164.268   69.980  49.868    31.325  6.9997 2.9437 5.3370 2.0639 1.662720       3.595141  
1 1 1 31 5  5  o 4.0112 1.3867 -1.9452  26.240  38.668    66.348  -9.4758   28.570  4.7151 2.2834 3.3074 1.5742 1.407614       2.773455  
1 1 1 31 5  6  o 7.5010 1.4305 128.622  30.519  56.064    69.861  145.736   33.928  4.7986 2.3284 10.203 1.6626 -5.404629      2.861086  
1 1 1 31 5  7  o 5.3910 1.4282 63.979   28.045  -31.7579  69.211  82.786    30.676  3.9231 1.9724 6.8589 2.0660 -2.935714      2.856346  
1 1 1 31 5  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 5  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  0  o 3.1750 1.6034 -23.0123 45.895  -25.7211  65.941  -20.4673  63.917  3.1658 2.2650 3.1843 2.2699 -0.000000      0.000000  
1 1 1 31 6  1  o 5.5098 1.6752 73.665   34.806  106.404   49.557  41.795    48.895  6.3438 2.5508 4.6759 2.1723 1.667955       3.350451  
1 1 1 31 6  2  o 4.4137 1.4594 14.586   33.831  74.003    48.764  -40.5546  46.975  5.3813 2.3609 3.4461 1.7162 1.935217       2.918774  
1 1 1 31 6  3  o 3.7506 1.3031 -14.1419 33.898  -17.8999  49.069  -10.7114  46.883  3.7293 1.8387 3.7718 1.8470 -0.4246879E-01 2.606125  
1 1 1 31 6  4  o 3.5989 1.2602 -27.6724 34.114  -50.1072  49.876  -7.9499   46.764  3.4072 1.7076 3.7905 1.8537 -0.3832963     2.520331  
1 1 1 31 6  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 6  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 7  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 8  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 9  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 10 13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 11 11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 12 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 13 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 13 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 13 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 13 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 13 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 31 13 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  0  o 3.6870 2.2456 22.283   31.125  0.0000    0.0000  22.283    31.125  3.6870 2.2456 3.6870 2.2456 -0.000000      0.000000  
1 1 1 32 1  1  o 3.9242 1.2174 -2.6280  20.230  27.873    28.497  -33.6193  28.725  4.8087 1.9340 3.0396 1.4791 1.769043       2.434791  
1 1 1 32 1  2  o 5.6313 1.6578 47.630   29.130  39.004    66.987  49.641    32.349  5.4736 2.5428 5.7889 2.1278 -0.3153148     3.315628  
1 1 1 32 1  3  f 6.0527 1.4225 49.897   22.466  85.905    33.226  19.569    30.493  7.6416 2.1063 4.4638 1.9126 3.177836       2.845060  
1 1 1 32 1  4  o 3.7918 1.2295 -4.6393  21.534  -24.6199  29.070  19.660    32.058  3.1640 1.5272 4.4195 1.9272 -1.255517      2.458967  
1 1 1 32 1  5  o 3.6798 1.2210 -7.2766  22.840  -21.2154  31.300  8.5981    33.403  3.3053 1.5927 4.0543 1.8512 -0.7489562     2.442034  
1 1 1 32 1  6  o 3.6142 1.1881 -3.2316  20.805  -9.5587   29.284  3.2161    29.562  3.4480 1.6270 3.7804 1.7319 -0.3323531     2.376243  
1 1 1 32 1  7  o 3.5629 1.1675 -6.4230  20.299  11.234    28.678  -24.1526  28.737  4.0005 1.7802 3.1254 1.5109 0.8751423      2.334982  
1 1 1 32 1  8  o 10.907 1.2085 160.217  26.322  160.661   38.146  159.814   36.367  10.836 1.7602 10.978 1.6564 -0.1418667     2.417020  
1 1 1 32 1  9  o 4.1953 1.3305 17.805   23.029  26.621    34.334  10.595    31.050  4.4562 1.9671 3.9345 1.7919 0.5216839      2.660911  
1 1 1 32 1  10 o 4.0129 1.2573 4.9294   22.065  -32.0734  30.283  46.802    32.215  2.9612 1.4569 5.0645 2.0495 -2.103359      2.514581  
1 1 1 32 1  11 o 3.9613 1.2897 15.119   23.782  24.231    33.209  5.5266    34.073  4.1848 1.8847 3.7378 1.7610 0.4470322      2.579415  
1 1 1 32 1  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 1  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  0  o 2.8191 1.8585 4.5159   26.879  0.0000    0.0000  4.5159    26.879  2.8191 1.8585 2.8191 1.8585 -0.000000      0.000000  
1 1 1 32 2  1  o 4.8372 1.3982 34.090   21.916  24.027    32.911  42.108    29.376  4.4791 1.9529 5.1952 2.0016 -0.7161102     2.796478  
1 1 1 32 2  2  o 4.7133 1.5157 27.603   29.014  15.489    66.290  30.473    32.269  4.7280 2.2879 4.6986 1.9887 0.2944899E-01  3.031401  
1 1 1 32 2  3  o 5.6239 1.4822 51.806   22.580  45.071    32.943  57.774    31.010  5.2935 2.0959 5.9544 2.0965 -0.6608906     2.964456  
1 1 1 32 2  4  o 4.4055 1.3540 18.441   22.607  2.6903    30.673  37.174    33.451  3.8232 1.7562 4.9878 2.0615 -1.164564      2.708079  
1 1 1 32 2  5  o 5.1286 1.4201 37.939   22.423  16.942    31.246  60.236    32.199  4.2391 1.8736 6.0181 2.1345 -1.778916      2.840143  
1 1 1 32 2  6  o 5.6923 1.5415 57.568   24.576  54.687    34.916  60.396    34.598  5.5611 2.1711 5.8234 2.1890 -0.2623129     3.083031  
1 1 1 32 2  7  o 7.9664 1.4545 102.757  24.720  69.900    34.232  138.564   35.735  6.1935 2.2004 9.7394 1.9028 -3.545889      2.909007  
1 1 1 32 2  8  o 4.9117 1.4138 33.898   24.482  73.290    35.402  -2.2047   33.892  6.1557 2.2315 3.6676 1.7365 2.488135       2.827582  
1 1 1 32 2  9  o 5.5475 1.5502 63.931   25.431  70.106    36.961  58.379    35.046  5.7389 2.2356 5.3562 2.1481 0.3827486      3.100380  
1 1 1 32 2  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 2  20 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  0  o 2.8049 1.8836 0.5960   29.851  0.0000    0.0000  0.5960    29.851  2.8049 1.8836 2.8049 1.8836 -0.000000      0.000000  
1 1 1 32 3  1  o 4.3741 1.3263 20.711   21.288  36.952    30.761  5.7847    29.489  4.9244 1.9993 3.8238 1.7434 1.100598       2.652617  
1 1 1 32 3  2  o 5.4102 1.5519 55.189   29.227  7.7415    67.534  66.123    32.420  4.5923 2.2419 6.2281 2.1465 -1.635743      3.103816  
1 1 1 32 3  3  o 3.4123 1.1480 -12.2324 21.345  -20.3610  29.023  -2.6564   31.501  3.1695 1.5289 3.6552 1.7130 -0.4856751     2.296017  
1 1 1 32 3  4  o 3.7716 1.2176 0.2239   22.010  -31.2128  33.219  24.825    29.386  3.1706 1.5530 4.3725 1.8756 -1.201886      2.435107  
1 1 1 32 3  5  o 4.5136 1.3389 18.307   23.068  -19.5146  31.732  60.699    33.594  3.2793 1.5859 5.7479 2.1577 -2.468596      2.677813  
1 1 1 32 3  6  f 5.7141 1.4835 59.710   22.315  56.583    32.506  62.496    30.689  5.5194 2.1107 5.9088 2.0851 -0.3894305     2.966902  
1 1 1 32 3  7  o 2.9061 1.0151 -35.4493 21.619  -48.5352  32.563  -25.1346  28.910  2.8290 1.4121 2.9832 1.4586 -0.1541698     2.030110  
1 1 1 32 3  8  o 3.8497 1.3494 -5.2146  26.966  34.745    71.443  -11.8530  29.119  4.4830 2.2118 3.2163 1.5464 1.266686       2.698786  
1 1 1 32 3  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 3  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  0  o 6.5453 2.6092 77.536   33.048  0.0000    0.0000  77.536    33.048  6.5453 2.6092 6.5453 2.6092 -0.000000      0.000000  
1 1 1 32 4  1  o 4.1354 1.2869 19.478   20.829  27.580    29.357  11.265    29.558  4.4005 1.8808 3.8704 1.7572 0.5301454      2.573896  
1 1 1 32 4  2  o 4.2979 1.4667 12.002   28.084  56.089    73.450  4.4533    30.393  4.8977 2.3790 3.6982 1.7162 1.199459       2.933442  
1 1 1 32 4  3  o 6.2210 1.4838 69.614   21.896  74.041    31.555  65.503    30.409  6.4064 2.1177 6.0355 2.0789 0.3709412      2.967618  
1 1 1 32 4  4  o 4.0392 1.3821 8.0338   26.157  31.081    68.739  4.1316    28.285  4.5058 2.2125 3.5727 1.6572 0.9331048      2.764291  
1 1 1 32 4  5  o 3.8924 1.3001 9.1780   26.376  -62.5925  69.134  21.404    28.534  3.7196 1.8823 4.0652 1.7939 -0.3456721     2.600234  
1 1 1 32 4  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 4  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 5  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 6  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 7  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 8  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 9  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 10 10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 11 7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 12 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 12 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 12 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 12 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 32 12 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  0  o 2.8816 1.9152 3.4690   29.489  0.0000    0.0000  3.4690    29.489  2.8816 1.9152 2.8816 1.9152 -0.000000      0.000000  
1 1 1 33 1  1  o 3.5236 1.1790 -11.1896 22.194  0.0937    31.359  -22.5132  31.415  3.7636 1.7454 3.2836 1.5856 0.4799685      2.358073  
1 1 1 33 1  2  o 5.0268 1.4407 35.664   23.340  15.484    31.394  60.599    34.898  4.1755 1.8600 5.8782 2.2006 -1.702701      2.881377  
1 1 1 33 1  3  o 3.7734 1.2291 -1.9198  22.022  21.367    31.933  -23.0363  30.409  4.3452 1.9083 3.2017 1.5494 1.143480       2.458120  
1 1 1 33 1  4  f 4.4737 1.3889 24.448   24.265  38.085    34.586  11.229    34.053  4.8830 2.0623 4.0643 1.8608 0.8187280      2.777732  
1 1 1 33 1  5  o 4.9113 1.4161 38.546   22.566  51.051    31.391  25.173    32.461  5.4215 2.0739 4.4011 1.9287 1.020356       2.832124  
1 1 1 33 1  6  o 8.1412 1.5251 111.418  25.669  135.118   37.449  90.417    35.253  9.2200 2.0803 7.0624 2.2308 2.157557       3.050249  
1 1 1 33 1  7  o 4.8025 1.3730 33.884   24.167  -9.3608   35.979  69.432    32.621  3.5520 1.7106 6.0529 2.1482 -2.500866      2.746078  
1 1 1 33 1  8  o 5.4470 1.4936 58.216   24.157  38.789    33.438  79.426    34.938  4.6394 1.9957 6.2547 2.2229 -1.615310      2.987284  
1 1 1 33 1  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 1  19 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  0  o 2.2737 1.6017 -20.2891 28.729  0.0000    0.0000  -20.2891  28.729  2.2737 1.6017 2.2737 1.6017 -0.000000      0.000000  
1 1 1 33 2  1  o 5.4258 1.3987 47.980   22.283  75.328    30.868  18.220    32.201  6.6895 2.0836 4.1621 1.8667 2.527415       2.797465  
1 1 1 33 2  2  o 4.2594 1.3057 17.609   22.764  -15.1978  34.135  43.886    30.549  3.4447 1.6607 5.0742 2.0153 -1.629451      2.611440  
1 1 1 33 2  3  o 5.9291 1.5044 63.501   23.844  41.538    32.745  88.289    34.788  4.8987 2.0333 6.9595 2.2179 -2.060809      3.008872  
1 1 1 33 2  4  o 6.0158 1.5519 70.239   24.513  82.779    35.492  58.800    33.897  6.5244 2.2461 5.5073 2.1422 1.017141       3.103828  
1 1 1 33 2  5  o 6.6841 1.5948 88.227   25.247  84.113    34.587  92.920    36.938  6.5767 2.2180 6.7915 2.2921 -0.2147827     3.189573  
1 1 1 33 2  6  o 3.2575 1.1086 -18.3368 22.079  8.5719    30.298  -48.8091  32.242  3.7178 1.7212 2.7973 1.3976 0.9205618      2.217123  
1 1 1 33 2  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 2  18 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  0  o 2.7099 1.8427 -0.0363  30.370  0.0000    0.0000  -0.0363   30.370  2.7099 1.8427 2.7099 1.8427 -0.000000      0.000000  
1 1 1 33 3  1  o 5.1199 1.4289 48.542   22.369  64.878    31.790  32.521    31.482  5.7911 2.1123 4.4488 1.9250 1.342267       2.857832  
1 1 1 33 3  2  o 4.6422 1.3961 34.118   24.411  63.605    34.702  5.2323    34.347  5.5444 2.1644 3.7399 1.7639 1.804514       2.792144  
1 1 1 33 3  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 3  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 4  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 5  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 6  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 7  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 8  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 9  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 33 10 6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  0  o 2.4115 1.6818 -12.4649 29.413  0.0000    0.0000  -12.4649  29.413  2.4115 1.6818 2.4115 1.6818 -0.000000      0.000000  
1 1 1 34 1  1  o 3.2092 1.1032 -22.3078 22.115  -41.5595  29.744  1.4906    33.070  2.7748 1.3792 3.6436 1.7222 -0.8688407     2.206427  
1 1 1 34 1  2  o 3.3686 1.1394 -20.1777 23.087  -63.8834  33.586  18.976    31.789  2.7017 1.3603 4.0354 1.8282 -1.333688      2.278790  
1 1 1 34 1  3  o 3.7582 1.2402 7.7044   22.887  2.0202    31.369  14.173    33.465  3.5910 1.6912 3.9255 1.8143 -0.3344529     2.480327  
1 1 1 34 1  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 1  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 2  17 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 3  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 4  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 5  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 6  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 7  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 8  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 9  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 9  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 9  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 9  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 34 9  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 1  16 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 2  15 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 3  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 4  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 5  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 6  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 7  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 8  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 35 8  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 1  14 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  12 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 2  13 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 3  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 4  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 5  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 6  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 6  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 6  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 6  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 36 6  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 1  11 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  9  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 2  10 x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 3  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 4  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 4  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 4  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 4  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 4  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 37 4  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  7  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 1  8  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  3  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  4  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  5  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 2  6  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 3  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 38 3  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 39 1  0  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 39 1  1  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
1 1 1 39 1  2  x ?      ?      ?        ?       ?         ?       ?         ?       ?      ?      ?      ?      ?              ?         
# 
#END OF REFLECTIONS
